762	762	941	0:SP2_SP2_SP2	C[6,6]	C[6,6]	N	4:3:2:	3:3:3:	3:2:	C[3x6]-4:C[6,6]-3:N-2:	C[6,6]-3:N[3x6]-3:C-3:	C[6,6]-3:O-2:	C[6,6](C[3x6]C[6,6]2H)(C[6,6]N[3x6]C)(NO)	C[6,6](C[6,6]C[3x6]N)(N[3x6]C[6,6]2)(CC[5a]H)	N(C[6,6]C[3x6]C[6,6])(OH)	C[6,6](C[3x6]C[6,6]2H)(C[6,6]N[3x6]C)(NO){2|C<4>,4|H<1>}	C[6,6](C[6,6]C[3x6]N)(N[3x6]C[6,6]2)(CC[5a]H){2|C<4>,5|H<1>}	N(C[6,6]C[3x6]C[6,6])(OH)	118.5240	0.000	1	118.5240	0.000	1	118.5240	0.000	1	118.5240	0.000	1	122.6754	15.558	13	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6,6]	C[6,6]	N	4:3:2:	3:3:3:	3:3:	C[3x6]-4:C[6,6]-3:N-2:	C[6,6]-3:N[3x6]-3:C-3:	C[6,6]-3:N-3:	C[6,6](C[3x6]C[6,6]2H)(C[6,6]N[3x6]C)(NN)	C[6,6](C[6,6]C[3x6]N)(N[3x6]C[6,6]2)(CC[5a]H)	N(C[6,6]C[3x6]C[6,6])(NCH)	C[6,6](C[3x6]C[6,6]2H)(C[6,6]N[3x6]C)(NN){2|C<4>,4|H<1>}	C[6,6](C[6,6]C[3x6]N)(N[3x6]C[6,6]2)(CC[5a]H){2|C<4>,5|H<1>}	N(C[6,6]C[3x6]C[6,6])(NCH)	119.8170	0.000	1	119.8170	0.000	1	119.8170	0.000	1	119.8170	0.000	1	122.6754	15.558	13	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6,6]	C[6,6]	N	4:3:2:	4:3:2:	3:3:	C[3x6]-4:C[6,6]-3:N-2:	C[3x6]-4:C[6,6]-3:N-2:	C[6,6]-3:C[6a]-3:	C[6,6](C[3x6]C[6,6,6a]2H)(C[6,6]C[3x6]N)(NC[6a])	C[6,6](C[3x6]C[6,6,6a]2H)(C[6,6]C[3x6]N)(NC[6a])	N(C[6,6]C[3x6]C[6,6])(C[6a]C[6a]2)	C[6,6](C[3x6]C[6,6,6a]2H)(C[6,6]C[3x6]N)(NC[6a]){1|H<1>,4|C<3>}	C[6,6](C[3x6]C[6,6,6a]2H)(C[6,6]C[3x6]N)(NC[6a]){1|H<1>,4|C<3>}	N(C[6,6]C[3x6]C[6,6])(C[6a]C[6a]2)	124.1230	4.420	8	124.1230	19.533	8	124.1230	19.533	8	124.1230	19.533	8	122.6754	15.558	13	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6,6]	C[6,6]	N	4:3:2:	4:3:3:	3:3:	C[3x6]-4:C[6,6]-3:N-2:	C[3x6]-4:C[6,6]-3:C-3:	C[6,6]-3:C[6a]-3:	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]C)(NC[6a])	C[6,6](C[3x6]C[6,6]N[6,6]H)(C[6,6]C[3x6]N)(CC[6a]H)	N(C[6,6]C[3x6]C[6,6])(C[6a]C[6a]2)	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]C)(NC[6a]){1|C<3>,1|C<4>,1|N<3>,4|H<1>}	C[6,6](C[3x6]C[6,6]N[6,6]H)(C[6,6]C[3x6]N)(CC[6a]H){1|C<3>,2|C<4>,3|H<1>}	N(C[6,6]C[3x6]C[6,6])(C[6a]C[6a]2)	121.1517	0.644	3	121.1517	0.415	3	121.1517	0.415	3	121.1517	0.415	3	122.6754	15.558	13	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[3x6]	N	3:3:2:	4:3:3:	3:4:	C[3x6]-3:N[6]-3:N-2:	C[4x6]-4:C[6,6]-3:C[6]-3:	C[6]-3:C-4:	C[6](C[3x6]C[4x6]C[6,6])(N[6]Si[4,6]C)(NC)	C[3x6](C[4x6]Si[4,3x6]C[6,6]H)(C[6,6]C[3x6]H)(C[6]N[6]N)	N(C[6]C[3x6]N[6])(CC3)	C[6](C[3x6]C[4x6]C[6,6])(N[6]Si[4,6]C)(NC){1|Si<4>,1|C<4>,1|O<2>,2|C<3>,2|H<1>}	C[3x6](C[4x6]Si[4,3x6]C[6,6]H)(C[6,6]C[3x6]H)(C[6]N[6]N){1|Si<5>,2|Si<4>,1|C<3>,1|C<4>,2|H<1>}	N(C[6]C[3x6]N[6])(CC3)	126.7820	0.000	1	126.7820	0.000	1	126.7820	0.000	1	126.7820	0.000	1	126.7820	0.000	1	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6,6]	N	3:2:2:	3:3:2:	3:3:	C[6,6]-3:C[6]-2:N-2:	C[6,6]-3:C[6]-3:N[6]-2:	C[6]-3:C-3:	C[6](C[6,6]C[6,6]N[6])(C[6]C[6])(NC)	C[6,6](C[6,6]C[6]2)(C[6]C[6]N)(N[6]C[6])	N(C[6]C[6,6]C[6])(CCO)	C[6](C[6,6]C[6,6]N[6])(C[6]C[6])(NC){3|C<2>}	C[6,6](C[6,6]C[6]2)(C[6]C[6]N)(N[6]C[6]){2|C<2>}	N(C[6]C[6,6]C[6])(CCO)	115.3465	1.418	2	115.3465	2.010	2	115.1957	1.073	3	115.1957	1.073	3	118.0860	27.858	7	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6,6]	N	3:2:2:	3:3:2:	3:3:	C[6,6]-3:C[6]-2:N-2:	C[6,6]-3:C[6]-3:N[6]-2:	C[6]-3:C-3:	C[6](C[6,6]C[6,6]N[6])(C[6]C[6])(NC)	C[6,6](C[6,6]C[6]2)(C[6]C[6]N)(N[6]C[6])	N(C[6]C[6,6]C[6])(CC[4]O)	C[6](C[6,6]C[6,6]N[6])(C[6]C[6])(NC){3|C<2>}	C[6,6](C[6,6]C[6]2)(C[6]C[6]N)(N[6]C[6]){2|C<2>}	N(C[6]C[6,6]C[6])(CC[4]O)	114.8940	0.000	1	114.8940	0.000	1	115.1957	1.073	3	115.1957	1.073	3	118.0860	27.858	7	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6,6]	N	3:3:2:	4:3:3:	3:3:	C[6,6]-3:C[6]-3:N-2:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:N-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(NN)	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(C[6]C[6]N)	N(C[6]C[6,6]C[6])(NC[6a]H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(NN){1|H<1>,2|C<3>,3|C<4>}	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(C[6]C[6]N){1|C<4>,1|O<1>,2|C<3>,3|H<1>}	N(C[6]C[6,6]C[6])(NC[6a]H)	129.7190	0.000	1	129.7190	0.000	1	129.7190	0.000	1	129.7190	0.000	1	118.0860	27.858	7	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6,6]	N	3:3:2:	4:4:3:	3:2:	C[6,6]-3:C[6]-3:N-2:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:N-2:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(NN)	C[6,6](C[6,6]C[6,6]C[6]N)(C[6]C[6]HH)(C[6]C[6]N)	N(C[6]C[6,6]C[6])(NN)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(NN){1|C<3>,2|C<4>,2|H<1>,2|N<2>}	C[6,6](C[6,6]C[6,6]C[6]N)(C[6]C[6]HH)(C[6]C[6]N){1|C<3>,1|O<1>,2|C<4>,4|H<1>}	N(C[6]C[6,6]C[6])(NN)	117.9380	0.000	1	117.9380	0.000	1	117.9380	0.000	1	117.9380	0.000	1	118.0860	27.858	7	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6,6]	N	3:4:2:	4:3:3:	3:3:	C[6,6]-3:C[6]-4:N-2:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:N-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]HH)(NN)	C[6,6](C[6,6]C[6]O[6]H)(C[6]C[6,6a]H)(C[6]C[6]N)	N(C[6]C[6,6]C[6])(NCH)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]HH)(NN){1|C<3>,1|C<4>,1|O<2>,4|H<1>}	C[6,6](C[6,6]C[6]O[6]H)(C[6]C[6,6a]H)(C[6]C[6]N){1|C<4>,2|C<3>,4|H<1>}	N(C[6]C[6,6]C[6])(NCH)	116.1160	0.000	1	116.1160	0.000	1	116.1160	0.000	1	116.6790	0.634	2	118.0860	27.858	7	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6,6]	N	3:4:2:	4:3:3:	3:3:	C[6,6]-3:C[6]-4:N-2:	C[6]-4:C[6,6]-3:C[6]-3:	C[6]-3:C[6a]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]HH)(NC[6a])	C[6,6](C[6]C[6,6a]C[6a]H)(C[6,6]C[6]O[6])(C[6]C[6]N)	N(C[6]C[6,6]C[6])(C[6a]C[6a]2)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]HH)(NC[6a]){1|H<1>,1|O<2>,2|C<3>,3|C<4>}	C[6,6](C[6]C[6,6a]C[6a]H)(C[6,6]C[6]O[6])(C[6]C[6]N){1|C<4>,4|C<3>,4|H<1>}	N(C[6]C[6,6]C[6])(C[6a]C[6a]2)	117.2420	0.000	1	117.2420	0.000	1	117.2420	0.000	1	116.6790	0.634	2	118.0860	27.858	7	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	2:3:2:	2:3:3:	3:3:	O[6]-2:C[6]-3:N-2:	N[6]-2:C[6]-3:N-3:	C[6]-3:C[6a]-3:	C[6](O[6]C[6,6a])(C[6]N[6]N)(NC[6a])	C[6](N[6]C[6,6a])(C[6]O[6]N)(NC[6a]H)	N(C[6]C[6]O[6])(C[6a]C[6a]2)	C[6](O[6]C[6,6a])(C[6]N[6]N)(NC[6a]){2|C<3>}	C[6](N[6]C[6,6a])(C[6]O[6]N)(NC[6a]H){2|C<3>}	N(C[6]C[6]O[6])(C[6a]C[6a]2)	117.6650	0.000	1	117.6650	0.000	1	117.6650	0.000	1	117.6650	0.000	1	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	2:3:2:	2:3:4:	3:3:	S[6]-2:C[6]-3:N-2:	N[6]-2:C[6]-3:C-4:	C[6]-3:N-3:	C[6](S[6]C[5a,6])(C[6]N[6]C)(NN)	C[6](N[6]N[5a,6])(C[6]S[6]N)(CH3)	N(C[6]C[6]S[6])(NC[6a]H)	C[6](S[6]C[5a,6])(C[6]N[6]C)(NN){1|N<2>,1|N<3>}	C[6](N[6]N[5a,6])(C[6]S[6]N)(CH3){2|C<3>}	N(C[6]C[6]S[6])(NC[6a]H)	115.1960	0.342	2	115.1960	0.117	2	115.1960	0.117	2	115.1960	0.117	2	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	2:3:2:	2:3:4:	3:4:	C[6]-2:C[6]-3:N-2:	C[6]-2:C[6]-3:C-4:	C[6]-3:C-4:	C[6](C[6]C[6,6])(C[6]C[6]C)(NC)	C[6](C[6]C[6,6])(C[6]C[6]N)(CH3)	N(C[6]C[6]2)(CCHH)	C[6](C[6]C[6,6])(C[6]C[6]C)(NC){1|C<3>,1|O<2>}	C[6](C[6]C[6,6])(C[6]C[6]N)(CH3){2|C<3>}	N(C[6]C[6]2)(CCHH)	118.8740	0.000	1	118.8740	0.000	1	118.8740	0.000	1	118.8740	0.000	1	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	2:3:2:	3:3:2:	3:2:	S[6]-2:C[6]-3:N-2:	N[6]-3:C[6]-3:N-2:	C[6]-3:O-2:	C[6](S[6]C[6,6a])(C[6]N[6]N)(NO)	C[6](N[6]C[6,6a]H)(C[6]S[6]N)(NO)	N(C[6]C[6]S[6])(OH)	C[6](S[6]C[6,6a])(C[6]N[6]N)(NO){1|H<1>,2|C<3>}	C[6](N[6]C[6,6a]H)(C[6]S[6]N)(NO){2|C<3>}	N(C[6]C[6]S[6])(OH)	117.4610	0.000	1	117.4610	0.000	1	117.4610	0.000	1	117.4610	0.000	1	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	2:3:2:	3:3:3:	3:1:	O[6]-2:C[6]-3:N-2:	C[6]-3:C[6]-3:C-3:	C[6]-3:H-1:	C[6](O[6]C[6,6a])(C[6]C[6]C)(NH)	C[6](C[6]C[6,6a]H)(C[6]O[6]N)(CNS)	N(C[6]C[6]O[6])(H)	C[6](O[6]C[6,6a])(C[6]C[6]C)(NH){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]O[6]N)(CNS){2|C<3>}	N(C[6]C[6]O[6])(H)	124.5300	0.000	1	124.5300	0.000	1	124.5300	0.000	1	124.5300	0.000	1	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	2:3:2:	3:3:3:	3:3:	O[6]-2:C[6]-3:N-2:	C[6]-3:C[6]-3:C-3:	C[6]-3:C[6a]-3:	C[6](O[6]C[6,6a])(C[6]C[6]C)(NC[6a])	C[6](C[6]C[6,6a]H)(C[6]O[6]N)(CC[6a]O)	N(C[6]C[6]O[6])(C[6a]C[6a]2)	C[6](O[6]C[6,6a])(C[6]C[6]C)(NC[6a]){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]O[6]N)(CC[6a]O){2|C<3>}	N(C[6]C[6]O[6])(C[6a]C[6a]2)	121.4290	0.177	2	121.4290	0.031	2	122.9534	2.011	7	122.7740	1.981	8	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	2:3:2:	3:3:3:	3:3:	O[6]-2:C[6]-3:N-2:	C[6]-3:C[6]-3:C-3:	C[6]-3:C[6a]-3:	C[6](O[6]C[6,6a])(C[6]C[6]C)(NC[6a])	C[6](C[6]C[6,6a]H)(C[6]O[6]N)(CNO)	N(C[6]C[6]O[6])(C[6a]C[6a]2)	C[6](O[6]C[6,6a])(C[6]C[6]C)(NC[6a]){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]O[6]N)(CNO){2|C<3>}	N(C[6]C[6]O[6])(C[6a]C[6a]2)	123.5632	1.175	5	123.5632	1.381	5	122.9534	2.011	7	122.7740	1.981	8	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	2:3:2:	3:3:3:	3:3:	O[6]-2:C[6]-3:N-2:	C[6]-3:C[6]-3:N-3:	C[6]-3:C[6a]-3:	C[6](O[6]C[5a,6])(C[6]C[6]N)(NC[6a])	C[6](C[6]C[5a,6]C)(C[6]O[6]N)(NC[6a]H)	N(C[6]C[6]O[6])(C[6a]C[6a]2)	C[6](O[6]C[5a,6])(C[6]C[6]N)(NC[6a]){1|N<3>,2|C<3>}	C[6](C[6]C[5a,6]C)(C[6]O[6]N)(NC[6a]H){2|C<3>}	N(C[6]C[6]O[6])(C[6a]C[6a]2)	121.5180	0.000	1	121.5180	0.000	1	121.5180	0.000	1	122.7740	1.981	8	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	2:3:2:	3:3:4:	3:3:	O[6]-2:C[6]-3:N-2:	C[6]-3:C[6]-3:C-4:	C[6]-3:C[6a]-3:	C[6](O[6]C[6,6a])(C[6]C[6]C)(NC[6a])	C[6](C[6]C[6,6a]H)(C[6]O[6]N)(CHHO)	N(C[6]C[6]O[6])(C[6a]C[6a]2)	C[6](O[6]C[6,6a])(C[6]C[6]C)(NC[6a]){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]O[6]N)(CHHO){2|C<3>}	N(C[6]C[6]O[6])(C[6a]C[6a]2)	121.5710	0.000	1	121.5710	0.000	1	121.5710	0.000	1	121.5710	0.000	1	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	2:3:2:	3:3:4:	3:4:	O[6]-2:C[6]-3:N-2:	C[6]-3:C[6]-3:C-4:	C[6]-3:S-4:	C[6](O[6]C[6,6a])(C[6]C[6]C)(NS)	C[6](C[6]C[6,6a]H)(C[6]O[6]N)(CHHO)	N(C[6]C[6]O[6])(SC[6a]OO)	C[6](O[6]C[6,6a])(C[6]C[6]C)(NS){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]O[6]N)(CHHO){2|C<3>}	N(C[6]C[6]O[6])(SC[6a]OO)	120.0070	0.000	1	120.0070	0.000	1	120.0070	0.000	1	120.0070	0.000	1	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	2:3:2:	4:3:2:	3:1:	O[6]-2:C[6]-3:N-2:	C[6]-4:C[6]-3:C-2:	C[6]-3:H-1:	C[6](O[6]C[5,6])(C[6]C[6]C)(NH)	C[6](C[6]C[5,6]C[6a]H)(C[6]O[6]N)(CN)	N(C[6]C[6]O[6])(H)	C[6](O[6]C[5,6])(C[6]C[6]C)(NH){1|H<1>,3|C<3>}	C[6](C[6]C[5,6]C[6a]H)(C[6]O[6]N)(CN){1|C<4>,3|C<3>}	N(C[6]C[6]O[6])(H)	127.6190	0.000	1	127.6190	0.000	1	127.8515	0.108	2	127.8515	0.108	2	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	2:3:2:	4:3:2:	3:1:	O[6]-2:C[6]-3:N-2:	C[6]-4:C[6]-3:C-2:	C[6]-3:H-1:	C[6](O[6]C[6,6a])(C[6]C[6]C)(NH)	C[6](C[6]C[6,6a]CC)(C[6]O[6]N)(CN)	N(C[6]C[6]O[6])(H)	C[6](O[6]C[6,6a])(C[6]C[6]C)(NH){1|C<4>,3|C<3>}	C[6](C[6]C[6,6a]CC)(C[6]O[6]N)(CN){2|C<3>}	N(C[6]C[6]O[6])(H)	128.0840	0.000	1	128.0840	0.000	1	127.8515	0.108	2	127.8515	0.108	2	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	2:3:2:	4:3:2:	3:3:	O[6]-2:C[6]-3:N-2:	C[6]-4:C[6]-3:C-2:	C[6]-3:C-3:	C[6](O[6]C[6,6a])(C[6]C[6]C)(NC)	C[6](C[6]C[6,6a]C[6a]H)(C[6]O[6]N)(CN)	N(C[6]C[6]O[6])(CHN)	C[6](O[6]C[6,6a])(C[6]C[6]C)(NC){1|H<1>,3|C<3>}	C[6](C[6]C[6,6a]C[6a]H)(C[6]O[6]N)(CN){4|C<3>}	N(C[6]C[6]O[6])(CHN)	122.4470	0.000	1	122.4470	0.000	1	122.4470	0.000	1	122.4470	0.000	1	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	2:3:2:	4:3:2:	3:4:	O[6]-2:C[6]-3:N-2:	C[6]-4:C[6]-3:N-2:	C[6]-3:C[6]-4:	C[6](O[6]C[5,6])(C[6]C[6]N)(NC[6])	C[6](C[6]C[5,6]CC)(C[6]O[6]N)(NC[6])	N(C[6]C[6]O[6])(C[6]C[6]2H)	C[6](O[6]C[5,6])(C[6]C[6]N)(NC[6]){2|C<3>,2|C<4>}	C[6](C[6]C[5,6]CC)(C[6]O[6]N)(NC[6]){2|C<3>}	N(C[6]C[6]O[6])(C[6]C[6]2H)	122.8930	0.000	1	122.8930	0.000	1	122.8930	0.000	1	122.8930	0.000	1	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:2:2:	3:2:1:	4:3:	C[6]-3:C[6]-2:N-2:	C[6]-3:C[6]-2:H-1:	P[5]-4:C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(NP[5])	C[6](C[6]C[6]N)(C[6]C[6])(H)	N(P[5]N[5,5]N[5]N)(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(NP[5]){1|C<3>,1|H<1>}	C[6](C[6]C[6]N)(C[6]C[6])(H){1|C<3>,1|H<1>}	N(P[5]N[5,5]N[5]N)(C[6]C[6]2)	118.8360	0.000	1	118.8360	0.000	1	118.8360	0.000	1	118.8360	0.000	1	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:2:2:	3:2:2:	3:3:	C[6]-3:S[6]-2:N-2:	C[6]-3:S[6]-2:N-2:	C[6]-3:C[6a]-3:	C[6](C[6]S[6]N)(S[6]C[6])(NC[6a])	C[6](C[6]S[6]N)(S[6]C[6])(NC[6a])	N(C[6]C[6]S[6])(C[6a]C[6a]2)	C[6](C[6]S[6]N)(S[6]C[6])(NC[6a]){1|C<4>,2|H<1>}	C[6](C[6]S[6]N)(S[6]C[6])(NC[6a]){1|C<4>,2|H<1>}	N(C[6]C[6]S[6])(C[6a]C[6a]2)	117.3420	0.000	1	117.3420	0.000	1	117.3420	0.000	1	117.3420	0.000	1	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:2:2:	3:2:3:	3:3:	C[6]-3:S[6]-2:N-2:	C[6a]-3:N[6]-2:C[6]-3:	C[6]-3:C[6a]-3:	C[6](C[6]C[6a]N[6])(S[6]C[6,6a])(NC[6a])	C[6](C[6a]C[6a]2)(N[6]C[6,6a])(C[6]S[6]N)	N(C[6]C[6]S[6])(C[6a]C[6a]2)	C[6](C[6]C[6a]N[6])(S[6]C[6,6a])(NC[6a]){4|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6,6a])(C[6]S[6]N){2|H<1>,4|C<3>}	N(C[6]C[6]S[6])(C[6a]C[6a]2)	120.2870	0.000	1	120.2870	0.000	1	120.2870	0.000	1	120.2870	0.000	1	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:2:2:	3:3:1:	3:2:	C[6]-3:C[6]-2:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:N-2:	C[6](C[6]C[6]H)(C[6]C[6])(NN)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	N(C[6]C[6]2)(NC[6a])	C[6](C[6]C[6]H)(C[6]C[6])(NN){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|C<4>}	N(C[6]C[6]2)(NC[6a])	115.6850	0.000	1	115.6850	0.000	1	115.6850	0.000	1	115.6850	0.000	1	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:2:2:	3:3:1:	3:3:	C[6]-3:C[6]-2:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C-3:	C[6](C[6]C[6]H)(C[6]C[6])(NC)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	N(C[6]C[6]2)(CCO)	C[6](C[6]C[6]H)(C[6]C[6])(NC){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>}	N(C[6]C[6]2)(CCO)	122.2610	0.000	1	122.2610	0.000	1	122.2610	0.000	1	119.5961	5.118	8	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:2:2:	3:3:1:	3:3:	C[6]-3:N[6]-2:N-2:	N[6]-3:C[6]-3:H-1:	C[6]-3:C-3:	C[6](C[6]N[6]H)(N[6]C[6])(NC)	C[6](N[6]C[6]Cu)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(CC[5]H)	C[6](C[6]N[6]H)(N[6]C[6])(NC){1|Cu<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]N[6]N)(H){1|C<3>,1|H<1>}	N(C[6]C[6]N[6])(CC[5]H)	117.0550	0.000	1	117.0550	0.000	1	117.0317	0.017	3	119.5961	5.118	8	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:2:2:	3:3:1:	3:3:	C[6]-3:N[6]-2:N-2:	N[6]-3:C[6]-3:H-1:	C[6]-3:C-3:	C[6](C[6]N[6]H)(N[6]C[6])(NC)	C[6](N[6]C[6]Mn)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(CC[5]H)	C[6](C[6]N[6]H)(N[6]C[6])(NC){1|Mn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]N[6]N)(H){1|C<3>,1|H<1>}	N(C[6]C[6]N[6])(CC[5]H)	117.1470	0.000	1	117.1470	0.000	1	117.0317	0.017	3	119.5961	5.118	8	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:2:2:	3:3:1:	3:3:	C[6]-3:N[6]-2:N-2:	N[6]-3:C[6]-3:H-1:	C[6]-3:C-3:	C[6](C[6]N[6]H)(N[6]C[6])(NC)	C[6](N[6]C[6]Zn)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(CC[5]H)	C[6](C[6]N[6]H)(N[6]C[6])(NC){1|Zn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]N[6]N)(H){1|C<3>,1|H<1>}	N(C[6]C[6]N[6])(CC[5]H)	116.8930	0.000	1	116.8930	0.000	1	117.0317	0.017	3	119.5961	5.118	8	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:2:2:	3:3:1:	3:3:	C[6]-3:S[6]-2:N-2:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6a]-3:	C[6](C[6]C[5,6]H)(S[6]C[6])(NC[6a])	C[6](C[5,6]C[5,6]C[5])(C[6]S[6]N)(H)	N(C[6]C[6]S[6])(C[6a]C[6a]2)	C[6](C[6]C[5,6]H)(S[6]C[6])(NC[6a]){1|C<3>,1|C<4>,1|H<1>}	C[6](C[5,6]C[5,6]C[5])(C[6]S[6]N)(H){1|C<3>,2|C<4>,2|H<1>}	N(C[6]C[6]S[6])(C[6a]C[6a]2)	121.2975	1.319	2	120.8533	0.879	4	120.8533	0.879	4	119.5961	5.118	8	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:2:2:	3:3:1:	3:3:	C[6]-3:S[6]-2:N-2:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6a]-3:	C[6](C[6]C[5,6]H)(S[6]C[6])(NC[6a])	C[6](C[5,6]C[5,6]C[5])(C[6]S[6]N)(H)	N(C[6]C[6]S[6])(C[6a]C[6a]2)	C[6](C[6]C[5,6]H)(S[6]C[6])(NC[6a]){1|C<3>,2|C<4>}	C[6](C[5,6]C[5,6]C[5])(C[6]S[6]N)(H){1|C<3>,2|C<4>,2|H<1>}	N(C[6]C[6]S[6])(C[6a]C[6a]2)	120.4090	0.330	2	120.8533	0.879	4	120.8533	0.879	4	119.5961	5.118	8	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:2:2:	3:3:2:	3:4:	C[6]-3:O[6]-2:N-2:	C[6,6a]-3:C[6]-3:N-2:	C[6]-3:S-4:	C[6](C[6]C[6,6a]N)(O[6]C[6])(NS)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]O[6]N)(NN)	N(C[6]C[6]O[6])(SC[6a]OO)	C[6](C[6]C[6,6a]N)(O[6]C[6])(NS){2|C<3>,2|H<1>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]O[6]N)(NN){1|C<4>,1|H<1>,2|C<3>}	N(C[6]C[6]O[6])(SC[6a]OO)	120.8680	0.011	2	120.8680	0.000	2	120.8680	0.000	2	120.8680	0.000	2	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:2:2:	3:3:3:	3:1:	C[6]-3:O[6]-2:N-2:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:H-1:	C[6](C[6]C[5a]C[6])(O[6]C[6,6a])(NH)	C[6](C[5a]N[5a]S[5a])(C[6]C[6,6a]H)(C[6]O[6]N)	N(C[6]C[6]O[6])(H)	C[6](C[6]C[5a]C[6])(O[6]C[6,6a])(NH){1|H<1>,1|N<2>,1|S<2>,2|C<3>}	C[6](C[5a]N[5a]S[5a])(C[6]C[6,6a]H)(C[6]O[6]N){4|C<3>}	N(C[6]C[6]O[6])(H)	123.3410	0.000	1	123.3410	0.000	1	123.3410	0.000	1	123.2340	0.023	2	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:2:2:	3:3:3:	3:1:	C[6]-3:O[6]-2:N-2:	C[6]-3:C[5a]-3:C[6]-3:	C[6]-3:H-1:	C[6](C[6]C[5a]C[6])(O[6]C[6,6a])(NH)	C[6](C[6]C[6,6a]H)(C[5a]N[5a]2)(C[6]O[6]N)	N(C[6]C[6]O[6])(H)	C[6](C[6]C[5a]C[6])(O[6]C[6,6a])(NH){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[5a]N[5a]2)(C[6]O[6]N){1|C<4>,4|C<3>}	N(C[6]C[6]O[6])(H)	123.1270	0.000	1	123.1270	0.000	1	123.1270	0.000	1	123.2340	0.023	2	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:2:2:	3:3:3:	3:3:	C[6]-3:O[6]-2:N-2:	C[6]-3:C[6]-3:N-3:	C[6]-3:C[6a]-3:	C[6](C[6]C[6]N)(O[6]C[6])(NC[6a])	C[6](C[6]C[6]C)(C[6]O[6]N)(NC[6a]H)	N(C[6]C[6]O[6])(C[6a]C[6a]2)	C[6](C[6]C[6]N)(O[6]C[6])(NC[6a]){1|C<2>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]O[6]N)(NC[6a]H){2|C<3>}	N(C[6]C[6]O[6])(C[6a]C[6a]2)	120.2800	0.000	1	120.2800	0.000	1	121.3650	2.354	2	121.3650	2.354	2	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:2:2:	3:3:3:	3:3:	C[6]-3:O[6]-2:N-2:	C[6]-3:C[6]-3:N-3:	C[6]-3:C[6a]-3:	C[6](C[6]C[6]N)(O[6]C[6])(NC[6a])	C[6](C[6]N[6]C)(C[6]O[6]N)(NC[6a]H)	N(C[6]C[6]O[6])(C[6a]C[6a]2)	C[6](C[6]C[6]N)(O[6]C[6])(NC[6a]){1|N<2>,2|C<3>}	C[6](C[6]N[6]C)(C[6]O[6]N)(NC[6a]H){1|C<3>}	N(C[6]C[6]O[6])(C[6a]C[6a]2)	122.4500	0.000	1	122.4500	0.000	1	121.3650	2.354	2	121.3650	2.354	2	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:2:2:	3:3:3:	3:4:	C[6]-3:O[6]-2:N-2:	C[6]-3:C[6a]-3:C[6]-3:	C[6]-3:S-4:	C[6](C[6]C[6a]C[6])(O[6]C[6,6a])(NS)	C[6](C[6]C[6,6a]C[6a])(C[6a]C[6a]2)(C[6]O[6]N)	N(C[6]C[6]O[6])(SC[6a]OO)	C[6](C[6]C[6a]C[6])(O[6]C[6,6a])(NS){5|C<3>}	C[6](C[6]C[6,6a]C[6a])(C[6a]C[6a]2)(C[6]O[6]N){2|H<1>,6|C<3>}	N(C[6]C[6]O[6])(SC[6a]OO)	121.9880	0.000	1	121.9880	0.000	1	121.9880	0.000	1	123.3320	3.613	2	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:2:2:	3:3:3:	3:4:	C[6]-3:O[6]-2:N-2:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:S-4:	C[6](C[6]C[6a]C[6])(O[6]C[6])(NS)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]O[6]N)	N(C[6]C[6]O[6])(SC[6a]OO)	C[6](C[6]C[6a]C[6])(O[6]C[6])(NS){1|H<1>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]O[6]N){3|C<3>,3|H<1>}	N(C[6]C[6]O[6])(SC[6a]OO)	124.6760	0.000	1	124.6760	0.000	1	124.6760	0.000	1	123.3320	3.613	2	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:2:2:	4:3:2:	3:3:	C[6]-3:O[6]-2:N-2:	C[5,6]-4:C[6]-3:C-2:	C[6]-3:C-3:	C[6](C[6]C[5,6]C)(O[6]C[5a,6])(NC)	C[6](C[5,6]C[5,6a]C[5a,6]C[5])(C[6]O[6]N)(CN)	N(C[6]C[6]O[6])(CHO)	C[6](C[6]C[5,6]C)(O[6]C[5a,6])(NC){1|N<3>,3|C<3>}	C[6](C[5,6]C[5,6a]C[5a,6]C[5])(C[6]O[6]N)(CN){1|N<3>,1|O<1>,4|C<3>}	N(C[6]C[6]O[6])(CHO)	121.0635	0.624	2	121.0635	0.390	2	121.0635	0.390	2	122.0267	2.978	3	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:2:2:	4:3:2:	3:3:	C[6]-3:O[6]-2:N-2:	C[6]-4:C[6]-3:C-2:	C[6]-3:C-3:	C[6](C[6]C[6]C)(O[6]C[6])(NC)	C[6](C[6]C[6a]C[6]H)(C[6]O[6]N)(CN)	N(C[6]C[6]O[6])(CHN)	C[6](C[6]C[6]C)(O[6]C[6])(NC){1|C<4>,1|H<1>,2|C<3>}	C[6](C[6]C[6a]C[6]H)(C[6]O[6]N)(CN){4|C<3>}	N(C[6]C[6]O[6])(CHN)	123.9530	0.000	1	123.9530	0.000	1	123.9530	0.000	1	122.0267	2.978	3	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:2:2:	4:3:3:	3:3:	C[6]-3:C[6]-2:N-2:	C[6]-4:C[6]-3:C-3:	C[6a]-3:C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6])(NC[6a])	C[6](C[6]C[6a]N[6]H)(C[6]C[6]N)(COO)	N(C[6a]C[6a]2)(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6])(NC[6a]){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6a]N[6]H)(C[6]C[6]N)(COO){1|C<4>,3|C<3>}	N(C[6a]C[6a]2)(C[6]C[6]2)	124.3750	0.000	1	124.3750	0.000	1	124.3750	0.000	1	124.3750	0.000	1	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	2:3:1:	3:3:	C[6]-3:C[6]-3:N-2:	O[6]-2:C[6]-3:O-1:	C[6]-3:N-3:	C[6](C[6]C[6,6a]O)(C[6]O[6]O)(NN)	C[6](O[6]C[6,6a])(C[6]C[6]N)(O)	N(C[6]C[6]2)(NC[5a]H)	C[6](C[6]C[6,6a]O)(C[6]O[6]O)(NN){2|C<3>}	C[6](O[6]C[6,6a])(C[6]C[6]N)(O){1|O<1>,2|C<3>}	N(C[6]C[6]2)(NC[5a]H)	113.3740	0.000	1	113.3740	0.000	1	113.3740	0.000	1	113.3740	0.000	1	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	2:3:2:	3:2:	N[6]-3:C[6]-3:N-2:	S[6]-2:C[6]-3:N-2:	C[6]-3:O-2:	C[6](N[6]C[6,6a]H)(C[6]S[6]N)(NO)	C[6](S[6]C[6,6a])(C[6]N[6]N)(NO)	N(C[6]C[6]N[6])(OH)	C[6](N[6]C[6,6a]H)(C[6]S[6]N)(NO){2|C<3>}	C[6](S[6]C[6,6a])(C[6]N[6]N)(NO){1|H<1>,2|C<3>}	N(C[6]C[6]N[6])(OH)	117.0200	0.000	1	117.0200	0.000	1	117.0200	0.000	1	117.0200	0.000	1	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:2:1:	3:1:	C[6]-3:C[6]-3:N-2:	C[6]-3:N[6]-2:O-1:	C[6]-3:O-1:	C[6](C[6]N[6]N)(C[6]N[6]O)(NO)	C[6](C[6]C[6]N)(N[6]C[6])(O)	N(C[6]C[6]2)(O)	C[6](C[6]N[6]N)(C[6]N[6]O)(NO){1|C<3>}	C[6](C[6]C[6]N)(N[6]C[6])(O){1|N<2>,2|N<3>}	N(C[6]C[6]2)(O)	116.0080	0.000	1	116.0080	0.000	1	116.0080	0.000	1	116.0080	0.000	1	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:2:1:	3:2:	C[6]-3:C[6]-3:N-2:	C[6]-3:N[6]-2:O-1:	C[6]-3:O-2:	C[6](C[6]N[6]O)2(NO)	C[6](C[6]C[6]N)(N[6]C[6])(O)	N(C[6]C[6]2)(OH)	C[6](C[6]N[6]O)2(NO){1|C<3>,1|H<1>}	C[6](C[6]C[6]N)(N[6]C[6])(O){1|N<3>,2|O<1>}	N(C[6]C[6]2)(OH)	126.9960	0.000	1	126.9960	0.000	1	126.9960	0.000	1	126.9960	0.000	1	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:2:1:	3:3:	C[6]-3:C[6]-3:N-2:	C[6]-3:N[6]-2:Cl-1:	C[6a]-3:C[6]-3:	C[6](C[6]N[6]Cl)2(NC[6a])	C[6](C[6]C[6]N)(N[6]S[6])(Cl)	N(C[6a]C[6a]2)(C[6]C[6]2)	C[6](C[6]N[6]Cl)2(NC[6a]){1|S<2>}	C[6](C[6]C[6]N)(N[6]S[6])(Cl){1|Cl<1>,1|N<2>}	N(C[6a]C[6a]2)(C[6]C[6]2)	123.6880	10.523	2	123.6880	110.737	2	123.6880	110.737	2	120.5023	35.290	10	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:2:1:	3:3:	C[6]-3:C[6]-3:N-2:	C[6]-3:N[6]-2:O-1:	C[6]-3:N-3:	C[6](C[6]N[6]O)2(NN)	C[6](C[6]C[6]N)(N[6]C[6])(O)	N(C[6]C[6]2)(NCH)	C[6](C[6]N[6]O)2(NN){1|C<3>,1|H<1>}	C[6](C[6]C[6]N)(N[6]C[6])(O){1|N<3>,2|O<1>}	N(C[6]C[6]2)(NCH)	125.3030	0.000	1	125.3030	0.000	1	125.3030	0.000	1	120.5023	35.290	10	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:2:1:	3:3:	C[6]-3:C[6]-3:N-2:	C[6]-3:O[6]-2:O-1:	C[6]-3:N-3:	C[6](C[6]O[6]O)2(NN)	C[6](C[6]C[6]N)(O[6]C[6])(O)	N(C[6]C[6]2)(NBH)	C[6](C[6]O[6]O)2(NN){1|C<4>}	C[6](C[6]C[6]N)(O[6]C[6])(O){1|O<1>,1|O<2>,2|C<4>}	N(C[6]C[6]2)(NBH)	118.5230	5.153	5	118.5230	26.552	5	118.9063	24.283	7	120.5023	35.290	10	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:2:1:	3:3:	C[6]-3:C[6]-3:N-2:	C[6]-3:O[6]-2:O-1:	C[6]-3:N-3:	C[6](C[6]O[6]O)2(NN)	C[6](C[6]C[6]N)(O[6]C[6])(O)	N(C[6]C[6]2)(NC[6a]H)	C[6](C[6]O[6]O)2(NN){1|C<4>}	C[6](C[6]C[6]N)(O[6]C[6])(O){1|O<1>,1|O<2>,2|C<4>}	N(C[6]C[6]2)(NC[6a]H)	119.8645	6.076	2	119.8645	36.920	2	118.9063	24.283	7	120.5023	35.290	10	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:2:2:	3:1:	C[6,6a]-3:C[6]-3:N-2:	C[6]-3:O[6]-2:N-2:	C[6]-3:N-1:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]O[6]N)(NN)	C[6](C[6]C[6,6a]N)(O[6]C[6])(NS)	N(C[6]C[6,6a]C[6])(N)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]O[6]N)(NN){1|C<4>,1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]N)(O[6]C[6])(NS){2|C<3>,2|H<1>}	N(C[6]C[6,6a]C[6])(N)	114.6075	0.511	2	114.6075	0.261	2	114.6075	0.261	2	114.6075	0.261	2	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:2:3:	3:1:	C[6]-3:C[6]-3:N-2:	C[6]-3:N[6]-2:N-3:	C[6]-3:O-1:	C[6](C[6]N[6]N)(C[6]N[6]O)(NO)	C[6](C[6]C[6]N)(N[6]C[6])(NHH)	N(C[6]C[6]2)(O)	C[6](C[6]N[6]N)(C[6]N[6]O)(NO){1|C<3>,1|C<4>}	C[6](C[6]C[6]N)(N[6]C[6])(NHH){1|N<3>,2|O<1>}	N(C[6]C[6]2)(O)	127.9800	0.000	1	127.4825	0.495	2	127.4825	0.495	2	127.4825	0.495	2	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:2:3:	3:1:	C[6]-3:C[6]-3:N-2:	C[6]-3:N[6]-2:N-3:	C[6]-3:O-1:	C[6](C[6]N[6]N)(C[6]N[6]O)(NO)	C[6](C[6]C[6]N)(N[6]C[6])(NHH)	N(C[6]C[6]2)(O)	C[6](C[6]N[6]N)(C[6]N[6]O)(NO){1|C<3>}	C[6](C[6]C[6]N)(N[6]C[6])(NHH){1|N<2>,1|N<3>,1|O<1>}	N(C[6]C[6]2)(O)	126.9850	0.000	1	127.4825	0.495	2	127.4825	0.495	2	127.4825	0.495	2	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:2:3:	3:3:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-2:C-3:	C[6]-3:C-3:	C[6](C[6]C[6]C)2(NC)	C[6](C[6]C[6]N)(C[6]C[6])(CCC)	N(C[6]C[6]2)(CC[6]N)	C[6](C[6]C[6]C)2(NC){1|C<2>}	C[6](C[6]C[6]N)(C[6]C[6])(CCC){1|C<2>,1|C<3>}	N(C[6]C[6]2)(CC[6]N)	119.1050	3.448	2	119.1050	11.888	2	119.1050	11.888	2	118.3253	7.767	3	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:2:3:	3:3:	C[6]-3:C[6]-3:N-2:	C[6]-3:N[6]-2:N-3:	C[6]-3:N-3:	C[6](C[6]N[6]N)(C[6]N[6]O)(NN)	C[6](C[6]C[6]N)(N[6]C[6])(NHH)	N(C[6]C[6]2)(NC[6a]H)	C[6](C[6]N[6]N)(C[6]N[6]O)(NN){1|C<3>,1|H<1>}	C[6](C[6]C[6]N)(N[6]C[6])(NHH){1|N<3>,2|O<1>}	N(C[6]C[6]2)(NC[6a]H)	116.7660	0.000	1	116.7660	0.000	1	116.7660	0.000	1	118.3253	7.767	3	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:2:4:	3:2:	C[6]-3:C[6]-3:N-2:	C[6]-3:O[6]-2:C-4:	C[6]-3:N-2:	C[6](C[6]N[6]C)(C[6]O[6]C)(NN)	C[6](C[6]C[6]N)(O[6]B[6])(CH3)	N(C[6]C[6]2)(NC[6a])	C[6](C[6]N[6]C)(C[6]O[6]C)(NN){1|B<4>,1|C<3>}	C[6](C[6]C[6]N)(O[6]B[6])(CH3){1|C<4>,1|N<3>,2|C<3>}	N(C[6]C[6]2)(NC[6a])	126.7530	0.000	1	125.2393	1.725	3	125.2393	1.725	3	125.2393	1.725	3	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:2:4:	3:2:	C[6]-3:C[6]-3:N-2:	C[6]-3:O[6]-2:C-4:	C[6]-3:N-2:	C[6](C[6]N[6]C)(C[6]O[6]C)(NN)	C[6](C[6]C[6]N)(O[6]B[6])(CH3)	N(C[6]C[6]2)(NC[6a])	C[6](C[6]N[6]C)(C[6]O[6]C)(NN){1|B<4>,1|C<4>}	C[6](C[6]C[6]N)(O[6]B[6])(CH3){1|C<4>,1|N<3>,2|C<3>}	N(C[6]C[6]2)(NC[6a])	124.4825	0.112	2	125.2393	1.725	3	125.2393	1.725	3	125.2393	1.725	3	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:2:4:	3:3:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-2:C-4:	C[6]-3:C-3:	C[6](C[6]C[6]C)2(NC)	C[6](C[6]C[6]N)(C[6]C[6])(CCCH)	N(C[6]C[6]2)(CC[6]H)	C[6](C[6]C[6]C)2(NC){1|C<3>,1|H<1>}	C[6](C[6]C[6]N)(C[6]C[6])(CCCH){1|C<3>,2|C<4>}	N(C[6]C[6]2)(CC[6]H)	120.9870	0.000	1	120.9870	0.000	1	120.9870	0.000	1	120.9870	0.000	1	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:1:	C[5a,6]-3:C[6]-3:N-2:	C[6]-3:N[6]-3:O-1:	C[6]-3:H-1:	C[6](C[5a,6]C[5a,6]S[5a])(C[6]N[6]O)(NH)	C[6](C[6]C[5a,6]N)(N[6]C[6]H)(O)	N(C[6]C[5a,6]C[6])(H)	C[6](C[5a,6]C[5a,6]S[5a])(C[6]N[6]O)(NH){1|H<1>,3|C<3>}	C[6](C[6]C[5a,6]N)(N[6]C[6]H)(O){1|C<3>,1|O<1>,1|S<2>}	N(C[6]C[5a,6]C[6])(H)	121.0490	0.000	1	121.0490	0.000	1	121.0490	0.000	1	121.4270	14.204	63	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:1:	C[6,6a]-3:C[6]-3:N-2:	C[5,6]-3:C[6]-3:O-1:	C[6]-3:N-1:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]O)(NN)	C[6](C[5,6]C[5,6a]C[5,6])(C[6]C[6,6a]N)(O)	N(C[6]C[6,6a]C[6])(N)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]O)(NN){1|H<1>,4|C<3>}	C[6](C[5,6]C[5,6a]C[5,6])(C[6]C[6,6a]N)(O){5|C<3>}	N(C[6]C[6,6a]C[6])(N)	113.5240	0.659	2	113.5240	0.434	2	113.5240	0.434	2	121.4270	14.204	63	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:1:	C[6,6a]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:O-1:	C[6]-3:H-1:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]O)(NH)	C[6](C[6]C[6,6a]N)(C[6]C[6]H)(O)	N(C[6]C[6,6a]C[6])(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]O)(NH){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6,6a]N)(C[6]C[6]H)(O){1|H<1>,2|C<3>}	N(C[6]C[6,6a]C[6])(H)	118.4550	0.000	1	118.4550	0.000	1	118.4550	0.000	1	121.4270	14.204	63	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:1:	C[6,6a]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:O-1:	C[6]-3:N-1:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]O)(NN)	C[6](C[6]C[6,6a]N)(C[6]C[6]H)(O)	N(C[6]C[6,6a]C[6])(N)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]O)(NN){2|H<1>,3|C<3>}	C[6](C[6]C[6,6a]N)(C[6]C[6]H)(O){1|H<1>,2|C<3>}	N(C[6]C[6,6a]C[6])(N)	113.7180	0.000	1	113.7180	0.000	1	113.7180	0.000	1	121.4270	14.204	63	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:1:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:H-1:	C[6](C[6]C[6]H)(C[6]N[6]H)(NH)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	N(C[6]C[6]2)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NH){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	N(C[6]C[6]2)(H)	121.7480	0.000	1	122.0470	0.710	5	121.9301	0.487	9	121.4270	14.204	63	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:1:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:H-1:	C[6](C[6]C[6]H)(C[6]N[6]H)(NH)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	N(C[6]C[6]2)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NH){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|N<3>}	N(C[6]C[6]2)(H)	122.7510	0.000	1	122.0470	0.710	5	121.9301	0.487	9	121.4270	14.204	63	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:1:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:H-1:	C[6](C[6]C[6]H)(C[6]N[6]H)(NH)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	N(C[6]C[6]2)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NH){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	N(C[6]C[6]2)(H)	121.6560	0.000	1	122.0470	0.710	5	121.9301	0.487	9	121.4270	14.204	63	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:1:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:H-1:	C[6](C[6]C[6]H)(C[6]N[6]H)(NH)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	N(C[6]C[6]2)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NH){1|Pd<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|N<3>}	N(C[6]C[6]2)(H)	122.0400	1.450	2	122.0470	0.710	5	121.9301	0.487	9	121.4270	14.204	63	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:1:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:H-1:	C[6](C[6]C[6]H)2(NH)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	N(C[6]C[6]2)(H)	C[6](C[6]C[6]H)2(NH){1|N<3>,2|H<1>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	N(C[6]C[6]2)(H)	121.7585	0.255	2	121.7840	0.302	4	121.9301	0.487	9	121.4270	14.204	63	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:1:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:H-1:	C[6](C[6]C[6]H)2(NH)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	N(C[6]C[6]2)(H)	C[6](C[6]C[6]H)2(NH){1|N<3>,2|H<1>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Co<4>,1|C<3>,1|H<1>}	N(C[6]C[6]2)(H)	121.8095	0.916	2	121.7840	0.302	4	121.9301	0.487	9	121.4270	14.204	63	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:1:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:O-1:	C[6](C[6]C[6]C)(C[6]C[6]H)(NO)	C[6](C[6]C[6]C)(C[6]C[6]N)(H)	N(C[6]C[6]2)(O)	C[6](C[6]C[6]C)(C[6]C[6]H)(NO){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]C[6]N)(H){1|C<3>,1|C<4>,1|O<1>}	N(C[6]C[6]2)(O)	125.0950	0.000	1	125.0950	0.000	1	125.0950	0.000	1	121.4270	14.204	63	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:1:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:O-1:	C[6]-3:N-1:	C[6](C[6]C[6]O)2(NN)	C[6](C[6]C[6]N)2(O)	N(C[6]C[6]2)(N)	C[6](C[6]C[6]O)2(NN){1|C<3>,2|N<2>}	C[6](C[6]C[6]N)2(O){1|C<3>,2|O<1>}	N(C[6]C[6]2)(N)	116.1825	0.561	2	116.1825	0.314	2	116.1825	0.314	2	121.4270	14.204	63	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:1:	C[6]-3:C[6]-3:N-2:	C[6]-3:N[6]-3:H-1:	C[6]-3:H-1:	C[6](C[6]C[6]H)(C[6]N[6]H)(NH)	C[6](C[6]C[6]N)(N[6]C[6]C)(H)	N(C[6]C[6]2)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NH){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]N)(N[6]C[6]C)(H){1|C<3>,2|H<1>}	N(C[6]C[6]2)(H)	120.0320	0.000	1	120.0320	0.000	1	120.8750	0.357	4	121.4270	14.204	63	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:1:	C[6]-3:C[6]-3:N-2:	C[6]-3:N[6]-3:H-1:	C[6]-3:H-1:	C[6](C[6]C[6]H)(C[6]N[6]H)(NH)	C[6](C[6]C[6]N)(N[6]C[6]H)(H)	N(C[6]C[6]2)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NH){1|C<3>,2|H<1>}	C[6](C[6]C[6]N)(N[6]C[6]H)(H){1|C<3>,2|H<1>}	N(C[6]C[6]2)(H)	121.2740	0.000	1	121.0730	0.081	2	120.8750	0.357	4	121.4270	14.204	63	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:1:	C[6]-3:C[6]-3:N-2:	C[6]-3:N[6]-3:H-1:	C[6]-3:H-1:	C[6](C[6]C[6]H)(C[6]N[6]H)(NH)	C[6](C[6]C[6]N)(N[6]C[6]H)(H)	N(C[6]C[6]2)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NH){1|C<3>,2|H<1>}	C[6](C[6]C[6]N)(N[6]C[6]H)(H){1|H<1>,2|C<3>}	N(C[6]C[6]2)(H)	120.8720	0.000	1	121.0730	0.081	2	120.8750	0.357	4	121.4270	14.204	63	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:1:	C[6]-3:C[6]-3:N-2:	C[6]-3:N[6]-3:H-1:	C[6]-3:H-1:	C[6](C[6]C[6]N)(C[6]N[6]H)(NH)	C[6](C[6]C[6]N)(N[6]C[6]H)(H)	N(C[6]C[6]2)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(NH){1|C<3>,2|H<1>}	C[6](C[6]C[6]N)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	N(C[6]C[6]2)(H)	121.3220	0.000	1	121.3220	0.000	1	120.8750	0.357	4	121.4270	14.204	63	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:1:	C[6]-3:C[6]-3:N-2:	C[6]-3:N[6]-3:O-1:	C[6]-3:O-1:	C[6](C[6]N[6]N)(C[6]N[6]O)(NO)	C[6](C[6]C[6]N)(N[6]C[6]C)(O)	N(C[6]C[6]2)(O)	C[6](C[6]N[6]N)(C[6]N[6]O)(NO){1|C<3>,1|C<4>}	C[6](C[6]C[6]N)(N[6]C[6]C)(O){1|N<2>,1|N<3>,1|O<1>}	N(C[6]C[6]2)(O)	114.0230	0.000	1	114.8850	1.486	2	118.5991	39.763	8	121.4270	14.204	63	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:1:	C[6]-3:C[6]-3:N-2:	C[6]-3:N[6]-3:O-1:	C[6]-3:O-1:	C[6](C[6]N[6]N)(C[6]N[6]O)(NO)	C[6](C[6]C[6]N)(N[6]C[6]C)(O)	N(C[6]C[6]2)(O)	C[6](C[6]N[6]N)(C[6]N[6]O)(NO){1|Sr<10>,2|C<4>}	C[6](C[6]C[6]N)(N[6]C[6]C)(O){1|Sr<10>,1|O<2>,2|N<3>}	N(C[6]C[6]2)(O)	115.7470	0.000	1	114.8850	1.486	2	118.5991	39.763	8	121.4270	14.204	63	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:1:	C[6]-3:C[6]-3:N-2:	C[6]-3:N[6]-3:O-1:	C[6]-3:O-1:	C[6](C[6]N[6]O)2(NO)	C[6](C[6]C[6]N)(N[6]C[6]C)(O)	N(C[6]C[6]2)(O)	C[6](C[6]N[6]O)2(NO){1|C<3>,2|C<4>}	C[6](C[6]C[6]N)(N[6]C[6]C)(O){1|N<3>,2|O<1>}	N(C[6]C[6]2)(O)	119.5125	9.480	2	119.5125	89.874	2	118.5991	39.763	8	121.4270	14.204	63	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:1:	C[6]-3:C[6]-3:N-2:	C[6]-3:N[6]-3:O-1:	C[6]-3:O-1:	C[6](C[6]N[6]O)2(NO)	C[6](C[6]C[6]N)(N[6]C[6]H)(O)	N(C[6]C[6]2)(O)	C[6](C[6]N[6]O)2(NO){1|C<3>,2|H<1>}	C[6](C[6]C[6]N)(N[6]C[6]H)(O){1|N<3>,2|O<1>}	N(C[6]C[6]2)(O)	119.9995	7.068	4	119.9995	49.959	4	118.5991	39.763	8	121.4270	14.204	63	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:1:	C[6]-3:C[6]-3:N-2:	N[6]-3:C[6]-3:H-1:	C[6]-3:H-1:	C[6](C[6]C[6]H)(C[6]N[6]H)(NH)	C[6](N[6]C[6]Pd)(C[6]C[6]N)(H)	N(C[6]C[6]2)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NH){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]N)(H){1|H<1>,2|C<3>}	N(C[6]C[6]2)(H)	120.6845	1.225	2	120.6845	1.502	2	120.6845	1.502	2	121.4270	14.204	63	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:1:	C[6]-3:N[6]-3:N-2:	C[6]-3:C[6]-3:Br-1:	C[6]-3:H-1:	C[6](C[6]C[6]Br)(N[6]C[6]H)(NH)	C[6](C[6]C[6]H)(C[6]N[6]N)(Br)	N(C[6]C[6]N[6])(H)	C[6](C[6]C[6]Br)(N[6]C[6]H)(NH){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]N)(Br){1|C<3>,2|H<1>}	N(C[6]C[6]N[6])(H)	126.7600	0.823	2	126.4667	0.597	3	126.4667	0.597	3	121.4270	14.204	63	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:1:	C[6]-3:N[6]-3:N-2:	C[6]-3:C[6]-3:Br-1:	C[6]-3:H-1:	C[6](C[6]C[6]Br)(N[6]C[6]H)(NH)	C[6](C[6]C[6]H)(C[6]N[6]N)(Br)	N(C[6]C[6]N[6])(H)	C[6](C[6]C[6]Br)(N[6]C[6]H)(NH){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(Br){1|Br<1>,1|C<3>,1|H<1>}	N(C[6]C[6]N[6])(H)	125.8800	0.000	1	126.4667	0.597	3	126.4667	0.597	3	121.4270	14.204	63	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:1:	C[6]-3:N[6]-3:N-2:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:H-1:	C[6](C[6]C[6]Cl)(N[6]C[6]H)(NH)	C[6](C[6]C[6]H)(C[6]N[6]N)(Cl)	N(C[6]C[6]N[6])(H)	C[6](C[6]C[6]Cl)(N[6]C[6]H)(NH){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(Cl){1|Cl<1>,1|C<3>,1|H<1>}	N(C[6]C[6]N[6])(H)	124.2460	0.000	1	124.2460	0.000	1	124.2460	0.000	1	121.4270	14.204	63	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:1:	C[6]-3:N[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]C)(NH)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(NH){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,1|C<4>,1|H<1>}	N(C[6]C[6]N[6])(H)	121.6465	0.183	2	121.6465	0.034	2	123.6200	1.612	22	121.4270	14.204	63	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:1:	C[6]-3:N[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(NH)	C[6](C[6]C[6]C)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(NH){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]N)(H){1|C<3>,2|H<1>}	N(C[6]C[6]N[6])(H)	123.3710	0.000	1	123.3710	0.000	1	123.6200	1.612	22	121.4270	14.204	63	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:1:	C[6]-3:N[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(NH)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(NH){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Br<1>,1|C<3>,1|H<1>}	N(C[6]C[6]N[6])(H)	126.4350	1.756	2	124.3432	1.754	11	123.6200	1.612	22	121.4270	14.204	63	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:1:	C[6]-3:N[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(NH)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(NH){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,2|H<1>}	N(C[6]C[6]N[6])(H)	124.5220	0.662	2	124.3432	1.754	11	123.6200	1.612	22	121.4270	14.204	63	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:1:	C[6]-3:N[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(NH)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(NH){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,2|H<1>}	N(C[6]C[6]N[6])(H)	123.9023	0.661	3	124.3432	1.754	11	123.6200	1.612	22	121.4270	14.204	63	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:1:	C[6]-3:N[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(NH)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(NH){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Br<1>,1|C<3>,1|H<1>}	N(C[6]C[6]N[6])(H)	123.0325	0.062	2	124.3432	1.754	11	123.6200	1.612	22	121.4270	14.204	63	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:1:	C[6]-3:N[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(NH)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(NH){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,2|H<1>}	N(C[6]C[6]N[6])(H)	124.0445	0.357	2	124.3432	1.754	11	123.6200	1.612	22	121.4270	14.204	63	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:1:	C[6]-3:N[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(NH)	C[6](C[6]N[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(NH){1|H<1>,1|N<3>,1|O<1>}	C[6](C[6]N[6]H)(C[6]N[6]N)(H){1|C<3>,1|C<4>,1|H<1>}	N(C[6]C[6]N[6])(H)	123.3950	0.000	1	123.1934	0.133	7	123.6200	1.612	22	121.4270	14.204	63	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:1:	C[6]-3:N[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(NH)	C[6](C[6]N[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(NH){1|H<1>,1|N<3>,1|O<1>}	C[6](C[6]N[6]H)(C[6]N[6]N)(H){1|C<3>,2|H<1>}	N(C[6]C[6]N[6])(H)	123.0437	0.364	3	123.1934	0.133	7	123.6200	1.612	22	121.4270	14.204	63	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:1:	C[6]-3:N[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(NH)	C[6](C[6]N[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(NH){1|H<1>,1|N<3>,1|S<1>}	C[6](C[6]N[6]H)(C[6]N[6]N)(H){1|C<3>,2|H<1>}	N(C[6]C[6]N[6])(H)	123.2760	0.451	3	123.1934	0.133	7	123.6200	1.612	22	121.4270	14.204	63	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:1:	C[6]-3:N[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:H-1:	C[6](C[6]C[6]H)(N[6]C[6]H)(NH)	C[6](C[6]N[6]N)2(H)	N(C[6]C[6]N[6])(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(NH){3|N<3>}	C[6](C[6]N[6]N)2(H){1|C<3>,2|H<1>}	N(C[6]C[6]N[6])(H)	122.8460	0.000	1	122.8460	0.000	1	123.6200	1.612	22	121.4270	14.204	63	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:1:	C[6]-3:S[6]-3:N-2:	C[6,6a]-3:C[6]-3:O-1:	C[6]-3:N-1:	C[6](C[6]C[6,6a]O)(S[6]C[6]O)(NN)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]S[6]N)(O)	N(C[6]C[6]S[6])(N)	C[6](C[6]C[6,6a]O)(S[6]C[6]O)(NN){2|C<3>,2|H<1>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]S[6]N)(O){1|C<4>,1|H<1>,1|O<1>,2|C<3>}	N(C[6]C[6]S[6])(N)	115.7750	0.000	1	115.7750	0.000	1	115.7750	0.000	1	121.4270	14.204	63	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:1:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:H-1:	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NH)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NH){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Fe<6>,1|C<3>,1|H<1>}	N(C[6]C[6]N[6])(H)	119.4060	0.000	1	119.4060	0.000	1	120.4156	0.670	5	121.4270	14.204	63	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:1:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:H-1:	C[6](N[6]C[6]Mn)(C[6]C[6]H)(NH)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(NH){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Mn<6>,1|C<3>,1|C<4>}	N(C[6]C[6]N[6])(H)	121.1730	0.621	2	121.1730	0.385	2	120.4156	0.670	5	121.4270	14.204	63	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:1:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:H-1:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NH)	C[6](C[6]C[6]C)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NH){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]N)(H){1|Ru<9>,1|C<3>,1|H<1>}	N(C[6]C[6]N[6])(H)	120.1630	0.000	2	120.1630	0.000	2	120.4156	0.670	5	121.4270	14.204	63	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:2:	C[6,6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:O-1:	C[6]-3:N-2:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(NN)	C[6](C[6]C[6,6]N)(C[6]C[6]N)(O)	N(C[6]C[6,6]C[6])(NN)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(NN){1|C<3>,2|C<4>,2|H<1>,2|N<2>}	C[6](C[6]C[6,6]N)(C[6]C[6]N)(O){1|H<1>,2|C<4>}	N(C[6]C[6,6]C[6])(NN)	119.0540	0.000	1	119.0540	0.000	1	119.0540	0.000	1	120.7879	22.308	142	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:2:	C[6,6a]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:O-1:	C[6]-3:N-2:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]O)(NN)	C[6](C[6]C[6,6a]N)(C[6]C[6]H)(O)	N(C[6]C[6,6a]C[6])(NC[6a])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]O)(NN){1|H<1>,1|S<4>,3|C<3>}	C[6](C[6]C[6,6a]N)(C[6]C[6]H)(O){1|H<1>,2|C<3>}	N(C[6]C[6,6a]C[6])(NC[6a])	122.5470	0.000	1	123.4517	0.632	3	123.4517	0.632	3	120.7879	22.308	142	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:2:	C[6,6a]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:O-1:	C[6]-3:N-2:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]O)(NN)	C[6](C[6]C[6,6a]N)(C[6]C[6]H)(O)	N(C[6]C[6,6a]C[6])(NC[6a])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]O)(NN){2|H<1>,3|C<3>}	C[6](C[6]C[6,6a]N)(C[6]C[6]H)(O){1|H<1>,2|C<3>}	N(C[6]C[6,6a]C[6])(NC[6a])	123.9040	0.190	2	123.4517	0.632	3	123.4517	0.632	3	120.7879	22.308	142	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:2:	C[6,6a]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:O-1:	C[6]-3:O-2:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]O)(NO)	C[6](C[6]C[6,6a]N)(C[6]C[6]H)(O)	N(C[6]C[6,6a]C[6])(OC)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]O)(NO){2|H<1>,3|C<3>}	C[6](C[6]C[6,6a]N)(C[6]C[6]H)(O){1|H<1>,2|C<3>}	N(C[6]C[6,6a]C[6])(OC)	109.7890	0.000	1	109.7890	0.000	1	116.7285	96.313	2	120.7879	22.308	142	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:2:	C[6,6a]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:O-1:	C[6]-3:O-2:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]O)(NO)	C[6](C[6]C[6,6a]N)(C[6]C[6]H)(O)	N(C[6]C[6,6a]C[6])(OH)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]O)(NO){2|H<1>,3|C<3>}	C[6](C[6]C[6,6a]N)(C[6]C[6]H)(O){1|H<1>,2|C<3>}	N(C[6]C[6,6a]C[6])(OH)	123.6680	0.000	1	123.6680	0.000	1	116.7285	96.313	2	120.7879	22.308	142	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:2:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C-2:	C[6](C[6]C[6]H)(C[6]N[6]H)(NC)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	N(C[6]C[6]2)(CS)	C[6](C[6]C[6]H)(C[6]N[6]H)(NC){1|Re<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	N(C[6]C[6]2)(CS)	120.5030	0.000	1	120.5030	0.000	1	120.5030	0.000	1	120.7879	22.308	142	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:2:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:N-2:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(NN)	C[6](C[6]C[6,6]H)(C[6]C[6]N)(H)	N(C[6]C[6]2)(NC[6a])	C[6](C[6]C[6,6]H)(C[6]C[6]H)(NN){1|Cr<9>,1|H<1>,2|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]N)(H){1|Cr<9>,1|H<1>,2|C<4>}	N(C[6]C[6]2)(NC[6a])	124.3520	0.000	1	124.3520	0.000	1	120.3829	20.264	102	120.7879	22.308	142	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:2:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:N-2:	C[6](C[6]C[6]H)(C[6]C[6]O)(NN)	C[6](C[6]C[6]Cl)(C[6]C[6]N)(H)	N(C[6]C[6]2)(NC)	C[6](C[6]C[6]H)(C[6]C[6]O)(NN){2|Cl<1>,1|C<3>}	C[6](C[6]C[6]Cl)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<1>}	N(C[6]C[6]2)(NC)	114.2860	0.000	1	114.2860	0.000	1	120.3829	20.264	102	120.7879	22.308	142	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:2:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:N-2:	C[6](C[6]C[6]H)(C[6]C[6]O)(NN)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	N(C[6]C[6]2)(NC[6a])	C[6](C[6]C[6]H)(C[6]C[6]O)(NN){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|O<1>,1|O<2>}	N(C[6]C[6]2)(NC[6a])	115.7520	0.000	1	115.7520	0.000	1	120.3829	20.264	102	120.7879	22.308	142	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:2:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:N-2:	C[6](C[6]C[6]H)(C[6]N[6]N)(NN)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	N(C[6]C[6]2)(NC[6a])	C[6](C[6]C[6]H)(C[6]N[6]N)(NN){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){3|N<3>}	N(C[6]C[6]2)(NC[6a])	118.5792	4.788	5	118.5792	22.930	5	120.3829	20.264	102	120.7879	22.308	142	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:2:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:N-2:	C[6](C[6]C[6]H)2(NN)	C[6](C[6]C[6]C)(C[6]C[6]N)(H)	N(C[6]C[6]2)(NC[5])	C[6](C[6]C[6]H)2(NN){1|O<2>,2|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]N)(H){1|Dy<16>,1|C<3>,1|H<1>,1|O<2>}	N(C[6]C[6]2)(NC[5])	114.5200	0.000	1	115.1955	0.913	2	120.3829	20.264	102	120.7879	22.308	142	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:2:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:N-2:	C[6](C[6]C[6]H)2(NN)	C[6](C[6]C[6]C)(C[6]C[6]N)(H)	N(C[6]C[6]2)(NC[5])	C[6](C[6]C[6]H)2(NN){1|O<2>,2|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]N)(H){1|Tb<16>,1|C<3>,1|H<1>,1|O<2>}	N(C[6]C[6]2)(NC[5])	115.8710	0.000	1	115.1955	0.913	2	120.3829	20.264	102	120.7879	22.308	142	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:2:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:N-2:	C[6](C[6]C[6]H)2(NN)	C[6](C[6]C[6]C)(C[6]C[6]N)(H)	N(C[6]C[6]2)(NC[5a])	C[6](C[6]C[6]H)2(NN){1|O<2>,2|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]N)(H){1|Dy<16>,1|C<3>,1|H<1>,1|O<2>}	N(C[6]C[6]2)(NC[5a])	115.7260	0.419	2	115.8768	0.441	4	120.3829	20.264	102	120.7879	22.308	142	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:2:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:N-2:	C[6](C[6]C[6]H)2(NN)	C[6](C[6]C[6]C)(C[6]C[6]N)(H)	N(C[6]C[6]2)(NC[5a])	C[6](C[6]C[6]H)2(NN){1|O<2>,2|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]N)(H){1|Tb<16>,1|C<3>,1|H<1>,1|O<2>}	N(C[6]C[6]2)(NC[5a])	116.0275	1.027	2	115.8768	0.441	4	120.3829	20.264	102	120.7879	22.308	142	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:2:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:N-2:	C[6](C[6]C[6]H)2(NN)	C[6](C[6]C[6]C)(C[6]C[6]N)(H)	N(C[6]C[6]2)(NC[6a])	C[6](C[6]C[6]H)2(NN){1|H<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<1>}	N(C[6]C[6]2)(NC[6a])	116.2980	0.459	3	119.9218	26.630	8	120.3829	20.264	102	120.7879	22.308	142	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:2:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:N-2:	C[6](C[6]C[6]H)2(NN)	C[6](C[6]C[6]C)(C[6]C[6]N)(H)	N(C[6]C[6]2)(NC[6a])	C[6](C[6]C[6]H)2(NN){1|O<2>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<1>}	N(C[6]C[6]2)(NC[6a])	122.0960	5.544	5	119.9218	26.630	8	120.3829	20.264	102	120.7879	22.308	142	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:2:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:N-2:	C[6](C[6]C[6]H)2(NN)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	N(C[6]C[6]2)(NC[6a])	C[6](C[6]C[6]H)2(NN){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<1>}	N(C[6]C[6]2)(NC[6a])	124.4507	0.634	3	124.4507	0.402	3	120.3829	20.264	102	120.7879	22.308	142	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:2:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:N-2:	C[6](C[6]C[6]H)2(NN)	C[6](C[6]C[6]N)(C[6]C[6]O)(H)	N(C[6]C[6]2)(NC[5])	C[6](C[6]C[6]H)2(NN){1|O<2>,2|C<4>}	C[6](C[6]C[6]N)(C[6]C[6]O)(H){1|Dy<16>,1|C<3>,1|H<1>,1|O<2>}	N(C[6]C[6]2)(NC[5])	124.5740	0.000	1	124.2925	0.158	2	120.3829	20.264	102	120.7879	22.308	142	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:2:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:N-2:	C[6](C[6]C[6]H)2(NN)	C[6](C[6]C[6]N)(C[6]C[6]O)(H)	N(C[6]C[6]2)(NC[5])	C[6](C[6]C[6]H)2(NN){1|O<2>,2|C<4>}	C[6](C[6]C[6]N)(C[6]C[6]O)(H){1|Tb<16>,1|C<3>,1|H<1>,1|O<2>}	N(C[6]C[6]2)(NC[5])	124.0110	0.000	1	124.2925	0.158	2	120.3829	20.264	102	120.7879	22.308	142	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:2:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:N-2:	C[6](C[6]C[6]H)2(NN)	C[6](C[6]C[6]N)(C[6]C[6]O)(H)	N(C[6]C[6]2)(NC[5a])	C[6](C[6]C[6]H)2(NN){1|O<2>,2|C<4>}	C[6](C[6]C[6]N)(C[6]C[6]O)(H){1|Dy<16>,1|C<3>,1|H<1>,1|O<2>}	N(C[6]C[6]2)(NC[5a])	124.6080	0.021	2	124.5798	0.464	4	120.3829	20.264	102	120.7879	22.308	142	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:2:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:N-2:	C[6](C[6]C[6]H)2(NN)	C[6](C[6]C[6]N)(C[6]C[6]O)(H)	N(C[6]C[6]2)(NC[5a])	C[6](C[6]C[6]H)2(NN){1|O<2>,2|C<4>}	C[6](C[6]C[6]N)(C[6]C[6]O)(H){1|Tb<16>,1|C<3>,1|H<1>,1|O<2>}	N(C[6]C[6]2)(NC[5a])	124.5515	1.179	2	124.5798	0.464	4	120.3829	20.264	102	120.7879	22.308	142	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:2:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:N-2:	C[6](C[6]C[6]H)2(NN)	C[6](C[6]C[6]N)(C[6]C[6]O)(H)	N(C[6]C[6]2)(NC[6a])	C[6](C[6]C[6]H)2(NN){1|O<2>,2|C<3>}	C[6](C[6]C[6]N)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|O<1>}	N(C[6]C[6]2)(NC[6a])	117.7156	5.570	5	117.7156	31.026	5	120.3829	20.264	102	120.7879	22.308	142	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:2:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:N-2:	C[6](C[6]C[6]H)2(NN)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	N(C[6]C[6]2)(NC)	C[6](C[6]C[6]H)2(NN){1|N<3>,2|H<1>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	N(C[6]C[6]2)(NC)	122.7845	6.341	2	122.7845	40.204	2	120.3829	20.264	102	120.7879	22.308	142	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:2:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:N-2:	C[6](C[6]C[6]H)2(NN)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	N(C[6]C[6]2)(NC[6])	C[6](C[6]C[6]H)2(NN){1|N<3>,2|H<1>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	N(C[6]C[6]2)(NC[6])	120.4864	5.133	12	120.5321	19.812	28	120.3829	20.264	102	120.7879	22.308	142	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:2:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:N-2:	C[6](C[6]C[6]H)2(NN)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	N(C[6]C[6]2)(NC[6])	C[6](C[6]C[6]H)2(NN){1|N<3>,2|H<1>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	N(C[6]C[6]2)(NC[6])	120.3821	3.502	8	120.5321	19.812	28	120.3829	20.264	102	120.7879	22.308	142	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:2:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:N-2:	C[6](C[6]C[6]H)2(NN)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	N(C[6]C[6]2)(NC[6])	C[6](C[6]C[6]H)2(NN){1|N<3>,2|H<1>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	N(C[6]C[6]2)(NC[6])	119.8445	3.934	4	120.5321	19.812	28	120.3829	20.264	102	120.7879	22.308	142	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:2:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:N-2:	C[6](C[6]C[6]H)2(NN)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	N(C[6]C[6]2)(NC[6])	C[6](C[6]C[6]H)2(NN){1|N<3>,2|H<1>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Pt<6>,1|C<3>,1|H<1>}	N(C[6]C[6]2)(NC[6])	120.0615	5.567	2	120.5321	19.812	28	120.3829	20.264	102	120.7879	22.308	142	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:2:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:N-2:	C[6](C[6]C[6]H)2(NN)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	N(C[6]C[6]2)(NC[6])	C[6](C[6]C[6]H)2(NN){1|N<3>,2|H<1>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|V<11>,1|C<3>,1|H<1>}	N(C[6]C[6]2)(NC[6])	123.2525	8.033	2	120.5321	19.812	28	120.3829	20.264	102	120.7879	22.308	142	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:2:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:N-2:	C[6](C[6]C[6]H)2(NN)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	N(C[6]C[6]2)(NC[6a])	C[6](C[6]C[6]H)2(NN){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>}	N(C[6]C[6]2)(NC[6a])	125.1380	0.617	2	121.2448	18.242	22	120.3829	20.264	102	120.7879	22.308	142	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:2:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:N-2:	C[6](C[6]C[6]H)2(NN)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	N(C[6]C[6]2)(NC[6a])	C[6](C[6]C[6]H)2(NN){1|N<3>,2|H<1>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	N(C[6]C[6]2)(NC[6a])	121.8995	6.096	2	121.2448	18.242	22	120.3829	20.264	102	120.7879	22.308	142	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:2:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:N-2:	C[6](C[6]C[6]H)2(NN)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	N(C[6]C[6]2)(NC[6a])	C[6](C[6]C[6]H)2(NN){1|N<3>,2|H<1>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	N(C[6]C[6]2)(NC[6a])	121.6365	3.798	4	121.2448	18.242	22	120.3829	20.264	102	120.7879	22.308	142	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:2:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:N-2:	C[6](C[6]C[6]H)2(NN)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	N(C[6]C[6]2)(NC[6a])	C[6](C[6]C[6]H)2(NN){1|N<3>,2|H<1>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>}	N(C[6]C[6]2)(NC[6a])	119.8950	5.992	2	121.2448	18.242	22	120.3829	20.264	102	120.7879	22.308	142	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:2:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:N-2:	C[6](C[6]C[6]H)2(NN)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	N(C[6]C[6]2)(NC[6a])	C[6](C[6]C[6]H)2(NN){1|N<3>,2|H<1>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	N(C[6]C[6]2)(NC[6a])	120.6358	4.387	10	121.2448	18.242	22	120.3829	20.264	102	120.7879	22.308	142	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:2:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:N-2:	C[6](C[6]C[6]H)2(NN)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	N(C[6]C[6]2)(NC[6a])	C[6](C[6]C[6]H)2(NN){1|N<3>,2|H<1>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|H<1>}	N(C[6]C[6]2)(NC[6a])	120.3085	7.230	2	121.2448	18.242	22	120.3829	20.264	102	120.7879	22.308	142	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:2:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:N-2:	C[6](C[6]C[6]H)2(NN)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	N(C[6]C[6]2)(NN)	C[6](C[6]C[6]H)2(NN){1|N<3>,2|H<1>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Zn<4>,1|C<3>,1|H<1>}	N(C[6]C[6]2)(NN)	121.4520	3.510	4	120.8843	17.310	12	120.3829	20.264	102	120.7879	22.308	142	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:2:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:N-2:	C[6](C[6]C[6]H)2(NN)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	N(C[6]C[6]2)(NN)	C[6](C[6]C[6]H)2(NN){1|N<3>,2|H<1>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Zn<6>,1|C<3>,1|H<1>}	N(C[6]C[6]2)(NN)	120.6005	4.653	8	120.8843	17.310	12	120.3829	20.264	102	120.7879	22.308	142	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:2:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:N-2:	C[6](C[6]C[6]H)2(NN)	C[6](C[6]C[6]N[6])(C[6]C[6]N)(H)	N(C[6]C[6]2)(NC[6a])	C[6](C[6]C[6]H)2(NN){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]N)(H){1|Ir<6>,1|H<1>,1|N<3>,2|C<3>}	N(C[6]C[6]2)(NC[6a])	115.5965	0.541	2	115.5965	0.293	2	120.3829	20.264	102	120.7879	22.308	142	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:2:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:O-2:	C[6](C[6]C[6,6]C)(C[6]C[6]H)(NO)	C[6](C[6]C[6,6]H)(C[6]C[6]N)(H)	N(C[6]C[6]2)(OC)	C[6](C[6]C[6,6]C)(C[6]C[6]H)(NO){1|H<1>,2|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]N)(H){1|C<3>,3|C<4>}	N(C[6]C[6]2)(OC)	124.7070	0.877	2	124.7070	0.769	2	123.0779	20.251	9	120.7879	22.308	142	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:2:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:O-2:	C[6](C[6]C[6]H)(C[6]C[6]N)(NO)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	N(C[6]C[6]2)(OH)	C[6](C[6]C[6]H)(C[6]C[6]N)(NO){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|N<3>,1|O<1>}	N(C[6]C[6]2)(OH)	125.4450	0.000	1	125.4450	0.000	1	123.0779	20.251	9	120.7879	22.308	142	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:2:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:O-2:	C[6](C[6]C[6]H)(C[6]C[6]O)(NO)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	N(C[6]C[6]2)(OH)	C[6](C[6]C[6]H)(C[6]C[6]O)(NO){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|N<3>,1|O<1>}	N(C[6]C[6]2)(OH)	125.0840	0.000	1	125.4900	0.330	2	123.0779	20.251	9	120.7879	22.308	142	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:2:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:O-2:	C[6](C[6]C[6]H)(C[6]C[6]O)(NO)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	N(C[6]C[6]2)(OH)	C[6](C[6]C[6]H)(C[6]C[6]O)(NO){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|O<1>,1|O<2>}	N(C[6]C[6]2)(OH)	125.8960	0.000	1	125.4900	0.330	2	123.0779	20.251	9	120.7879	22.308	142	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:2:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:O-2:	C[6](C[6]C[6]H)2(NO)	C[6](C[6]C[6]C)(C[6]C[6]N)(H)	N(C[6]C[6]2)(OH)	C[6](C[6]C[6]H)2(NO){1|C<3>,2|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<1>}	N(C[6]C[6]2)(OH)	120.4655	6.084	4	120.4655	37.020	4	123.0779	20.251	9	120.7879	22.308	142	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:2:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:O-1:	C[6]-3:N-2:	C[6](C[6]C[6,6]H)(C[6]C[6]O)(NN)	C[6](C[6]C[6,6]N)(C[6]C[6]N)(O)	N(C[6]C[6]2)(NN)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(NN){1|C<3>,1|C<4>,2|N<2>}	C[6](C[6]C[6,6]N)(C[6]C[6]N)(O){1|H<1>,2|C<4>}	N(C[6]C[6]2)(NN)	119.4350	0.000	1	119.4350	0.000	1	123.0187	9.639	3	120.7879	22.308	142	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:2:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:O-1:	C[6]-3:N-2:	C[6](C[6]C[6]H)(C[6]C[6]O)(NN)	C[6](C[6]C[6]Cl)(C[6]C[6]N)(O)	N(C[6]C[6]2)(NC)	C[6](C[6]C[6]H)(C[6]C[6]O)(NN){2|Cl<1>,1|C<3>}	C[6](C[6]C[6]Cl)(C[6]C[6]N)(O){1|C<3>,2|H<1>}	N(C[6]C[6]2)(NC)	124.7280	0.000	1	124.7280	0.000	1	123.0187	9.639	3	120.7879	22.308	142	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:2:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:O-1:	C[6]-3:N-2:	C[6](C[6]C[6]H)(C[6]C[6]O)(NN)	C[6](C[6]C[6]H)(C[6]C[6]N)(O)	N(C[6]C[6]2)(NC[6a])	C[6](C[6]C[6]H)(C[6]C[6]O)(NN){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]C[6]N)(O){1|C<3>,1|H<1>,1|O<2>}	N(C[6]C[6]2)(NC[6a])	124.8930	0.000	1	124.8930	0.000	1	123.0187	9.639	3	120.7879	22.308	142	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:2:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:O-1:	C[6]-3:O-2:	C[6](C[6]C[6]H)(C[6]C[6]O)(NO)	C[6](C[6]C[6]H)(C[6]C[6]N)(O)	N(C[6]C[6]2)(OH)	C[6](C[6]C[6]H)(C[6]C[6]O)(NO){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]C[6]N)(O){1|C<3>,1|H<1>,1|N<3>}	N(C[6]C[6]2)(OH)	115.5080	0.000	1	115.2055	0.183	2	118.6693	36.086	3	120.7879	22.308	142	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:2:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:O-1:	C[6]-3:O-2:	C[6](C[6]C[6]H)(C[6]C[6]O)(NO)	C[6](C[6]C[6]H)(C[6]C[6]N)(O)	N(C[6]C[6]2)(OH)	C[6](C[6]C[6]H)(C[6]C[6]O)(NO){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]C[6]N)(O){1|C<3>,1|H<1>,1|O<2>}	N(C[6]C[6]2)(OH)	114.9030	0.000	1	115.2055	0.183	2	118.6693	36.086	3	120.7879	22.308	142	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:2:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:O-1:	C[6]-3:O-2:	C[6](C[6]C[6]O)2(NO)	C[6](C[6]C[6]C)(C[6]C[6]N)(O)	N(C[6]C[6]2)(OH)	C[6](C[6]C[6]O)2(NO){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]C)(C[6]C[6]N)(O){1|C<3>,1|O<1>,1|O<2>}	N(C[6]C[6]2)(OH)	125.5970	0.000	1	125.5970	0.000	1	118.6693	36.086	3	120.7879	22.308	142	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:2:	C[6]-3:C[6]-3:N-2:	C[6]-3:N[6]-3:O-1:	C[6]-3:O-2:	C[6](C[6]N[6]O)2(NO)	C[6](C[6]C[6]N)(N[6]C[6]H)(O)	N(C[6]C[6]2)(OH)	C[6](C[6]N[6]O)2(NO){1|C<3>,1|H<1>}	C[6](C[6]C[6]N)(N[6]C[6]H)(O){1|N<2>,2|O<1>}	N(C[6]C[6]2)(OH)	113.2880	0.000	1	119.0127	62.370	7	119.0127	62.370	7	120.7879	22.308	142	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:2:	C[6]-3:C[6]-3:N-2:	C[6]-3:N[6]-3:O-1:	C[6]-3:O-2:	C[6](C[6]N[6]O)2(NO)	C[6](C[6]C[6]N)(N[6]C[6]H)(O)	N(C[6]C[6]2)(OH)	C[6](C[6]N[6]O)2(NO){1|C<3>,2|H<1>}	C[6](C[6]C[6]N)(N[6]C[6]H)(O){1|N<3>,2|O<1>}	N(C[6]C[6]2)(OH)	119.9668	8.197	6	119.0127	62.370	7	119.0127	62.370	7	120.7879	22.308	142	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:2:	C[6]-3:C[6]-3:N-2:	N[6]-3:C[6]-3:H-1:	C[6]-3:C-2:	C[6](C[6]C[6]H)(C[6]N[6]H)(NC)	C[6](N[6]C[6]Re)(C[6]C[6]N)(H)	N(C[6]C[6]2)(CS)	C[6](C[6]C[6]H)(C[6]N[6]H)(NC){1|Re<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Re)(C[6]C[6]N)(H){1|C<3>,2|H<1>}	N(C[6]C[6]2)(CS)	118.6130	0.000	1	118.6130	0.000	1	118.6130	0.000	1	120.7879	22.308	142	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:2:	C[6]-3:N[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:N-2:	C[6](C[6]C[6]H)(N[6]C[6]H)(NN)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(NRe)	C[6](C[6]C[6]H)(N[6]C[6]H)(NN){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,2|H<1>}	N(C[6]C[6]N[6])(NRe)	127.0610	1.533	2	127.0610	2.350	2	127.0610	2.350	2	120.7879	22.308	142	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:2:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:N-2:	C[6](N[6]C[6]Co)(C[6]C[6]H)(NN)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(NC[6a])	C[6](N[6]C[6]Co)(C[6]C[6]H)(NN){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Co<4>,1|C<3>,1|H<1>}	N(C[6]C[6]N[6])(NC[6a])	125.7570	0.000	1	125.7570	0.000	1	123.8586	5.798	8	120.7879	22.308	142	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:2:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:N-2:	C[6](N[6]C[6]Re)(C[6]C[6]H)(NN)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(NRe)	C[6](N[6]C[6]Re)(C[6]C[6]H)(NN){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Re<6>,1|C<3>,1|H<1>}	N(C[6]C[6]N[6])(NRe)	121.7630	0.416	2	121.6215	0.091	4	123.8586	5.798	8	120.7879	22.308	142	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:2:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:N-2:	C[6](N[6]C[6]Re)(C[6]C[6]H)(NN)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(NRe)	C[6](N[6]C[6]Re)(C[6]C[6]H)(NN){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Re<7>,1|C<3>,1|H<1>}	N(C[6]C[6]N[6])(NRe)	121.3810	0.000	1	121.6215	0.091	4	123.8586	5.798	8	120.7879	22.308	142	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:2:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:N-2:	C[6](N[6]C[6]Re)(C[6]C[6]H)(NN)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(NRe)	C[6](N[6]C[6]Re)(C[6]C[6]H)(NN){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Re<8>,2|C<3>}	N(C[6]C[6]N[6])(NRe)	121.5790	0.000	1	121.6215	0.091	4	123.8586	5.798	8	120.7879	22.308	142	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:2:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:N-2:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(NN)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(NC[6a])	C[6](N[6]C[6]Zn)(C[6]C[6]H)(NN){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Zn<4>,1|C<3>,1|H<1>}	N(C[6]C[6]N[6])(NC[6a])	126.2087	0.245	3	126.2087	0.060	3	123.8586	5.798	8	120.7879	22.308	142	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	C[6,6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:N-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(NN)	C[6](C[6]C[6,6]N)(C[6]C[6]C)(H)	N(C[6]C[6,6]C[6])(NC[6a]H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(NN){1|H<1>,2|C<3>,3|C<4>}	C[6](C[6]C[6,6]N)(C[6]C[6]C)(H){1|C<3>,1|C<4>,1|O<1>}	N(C[6]C[6,6]C[6])(NC[6a]H)	113.3430	0.000	1	113.3430	0.000	1	113.3430	0.000	1	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	C[6,6a]-3:C[6]-3:N-2:	C[6,6]-3:C[6]-3:O-1:	C[6]-3:N-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]O)(NN)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6a]N)(O)	N(C[6]C[6,6a]C[6])(NC[6a]H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]O)(NN){1|C<4>,1|H<1>,3|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6a]N)(O){1|C<4>,1|O<2>,2|C<3>,2|H<1>}	N(C[6]C[6,6a]C[6])(NC[6a]H)	123.8080	0.000	1	123.8080	0.000	1	123.8080	0.000	1	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	C[6,6a]-3:C[6]-3:N-2:	C[6,6a]-3:C[6]-3:O-1:	C[6]-3:C-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6a]O)(NC)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6a]N)(O)	N(C[6]C[6,6a]C[6])(CCH)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6a]O)(NC){1|H<1>,1|N<2>,3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6a]N)(O){1|H<1>,1|N<2>,3|C<3>}	N(C[6]C[6,6a]C[6])(CCH)	124.8055	0.589	2	124.8055	0.347	2	124.8055	0.347	2	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	C[6,6a]-3:C[6]-3:N-2:	C[6,6a]-3:C[6]-3:O-1:	C[6]-3:N-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6a]O)(NN)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6a]N)(O)	N(C[6]C[6,6a]C[6])(NCH)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6a]O)(NN){1|H<1>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6a]N)(O){1|H<1>,4|C<3>}	N(C[6]C[6,6a]C[6])(NCH)	124.2210	0.000	1	124.2210	0.000	1	124.2210	0.000	1	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	C[6,6a]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6a]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(NC[6a])	C[6](C[6]C[6,6a]N)(C[6]C[6]N)(H)	N(C[6]C[6,6a]C[6])(C[6a]C[6a]2)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(NC[6a]){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6,6a]N)(C[6]C[6]N)(H){1|O<1>,2|C<3>}	N(C[6]C[6,6a]C[6])(C[6a]C[6a]2)	125.7030	0.000	1	125.7030	0.000	1	124.4396	0.399	7	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	C[6,6a]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6a]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(NC[6a])	C[6](C[6]C[6,6a]N)(C[6]C[6]O)(H)	N(C[6]C[6,6a]C[6])(C[6a]C[6a]2)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(NC[6a]){1|H<1>,1|O<2>,3|C<3>}	C[6](C[6]C[6,6a]N)(C[6]C[6]O)(H){1|O<1>,2|C<3>}	N(C[6]C[6,6a]C[6])(C[6a]C[6a]2)	124.2910	0.323	5	124.2910	0.104	5	124.4396	0.399	7	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	C[6,6a]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6a]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(NC[6a])	C[6](C[6]C[6a]S[6])(C[6]C[6,6a]N)(H)	N(C[6]C[6,6a]C[6])(C[6a]C[6a]2)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(NC[6a]){1|H<1>,1|S<2>,3|C<3>}	C[6](C[6]C[6a]S[6])(C[6]C[6,6a]N)(H){4|C<3>}	N(C[6]C[6,6a]C[6])(C[6a]C[6a]2)	123.9190	0.000	1	123.9190	0.000	1	124.4396	0.399	7	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	C[6,6a]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:N-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(NN)	C[6](C[6]C[6,6a]N)(C[6]C[6]C)(H)	N(C[6]C[6,6a]C[6])(NC[6a]H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(NN){1|C<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6,6a]N)(C[6]C[6]C)(H){1|O<1>,2|C<3>}	N(C[6]C[6,6a]C[6])(NC[6a]H)	126.0135	0.272	4	126.0135	0.074	4	126.4080	0.648	8	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	C[6,6a]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:N-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(NN)	C[6](C[6]C[6,6a]N)(C[6]C[6]H)(H)	N(C[6]C[6,6a]C[6])(NC[6a]H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(NN){1|N<2>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]N)(C[6]C[6]H)(H){1|O<1>,2|C<3>}	N(C[6]C[6,6a]C[6])(NC[6a]H)	125.5590	0.000	1	126.0340	0.451	2	126.4080	0.648	8	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	C[6,6a]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:N-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(NN)	C[6](C[6]C[6,6a]N)(C[6]C[6]H)(H)	N(C[6]C[6,6a]C[6])(NC[6a]H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(NN){2|H<1>,3|C<3>}	C[6](C[6]C[6,6a]N)(C[6]C[6]H)(H){1|O<1>,2|C<3>}	N(C[6]C[6,6a]C[6])(NC[6a]H)	126.5090	0.000	1	126.0340	0.451	2	126.4080	0.648	8	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	C[6,6a]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:N-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(NN)	C[6](C[6]C[6,6a]N)(C[6]N[6]H)(H)	N(C[6]C[6,6a]C[6])(NCH)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(NN){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]N)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	N(C[6]C[6,6a]C[6])(NCH)	127.5710	0.505	2	127.5710	0.255	2	126.4080	0.648	8	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	C[6,6a]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:O-1:	C[6]-3:N-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]O)(NN)	C[6](C[6]C[6,6a]N)(C[6]C[6]C)(O)	N(C[6]C[6,6a]C[6])(NC[6a]H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]O)(NN){1|H<1>,4|C<3>}	C[6](C[6]C[6,6a]N)(C[6]C[6]C)(O){1|H<1>,2|C<3>}	N(C[6]C[6,6a]C[6])(NC[6a]H)	123.2060	0.000	1	123.2060	0.000	1	123.7259	0.245	47	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	C[6,6a]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:O-1:	C[6]-3:N-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]O)(NN)	C[6](C[6]C[6,6a]N)(C[6]C[6]H)(O)	N(C[6]C[6,6a]C[6])(NC[5a]H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]O)(NN){2|H<1>,3|C<3>}	C[6](C[6]C[6,6a]N)(C[6]C[6]H)(O){1|H<1>,2|C<3>}	N(C[6]C[6,6a]C[6])(NC[5a]H)	123.9370	0.000	1	123.9370	0.000	1	123.7259	0.245	47	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	C[6,6a]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:O-1:	C[6]-3:N-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]O)(NN)	C[6](C[6]C[6,6a]N)(C[6]C[6]H)(O)	N(C[6]C[6,6a]C[6])(NC[6a]H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]O)(NN){1|H<1>,1|S<4>,3|C<3>}	C[6](C[6]C[6,6a]N)(C[6]C[6]H)(O){1|H<1>,2|C<3>}	N(C[6]C[6,6a]C[6])(NC[6a]H)	122.6587	0.486	3	123.7327	0.249	45	123.7259	0.245	47	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	C[6,6a]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:O-1:	C[6]-3:N-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]O)(NN)	C[6](C[6]C[6,6a]N)(C[6]C[6]H)(O)	N(C[6]C[6,6a]C[6])(NC[6a]H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]O)(NN){2|H<1>,3|C<3>}	C[6](C[6]C[6,6a]N)(C[6]C[6]H)(O){1|H<1>,2|C<3>}	N(C[6]C[6,6a]C[6])(NC[6a]H)	123.8094	0.406	42	123.7327	0.249	45	123.7259	0.245	47	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	C[6]-3:C[6]-3:N-2:	C[6,6a]-3:C[6]-3:O-1:	C[6]-3:N-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(NN)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]N)(O)	N(C[6]C[6]2)(NCH)	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(NN){1|H<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]N)(O){2|H<1>,3|C<3>}	N(C[6]C[6]2)(NCH)	124.9485	0.241	2	124.9485	0.058	2	125.0307	0.049	3	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	C[6]-3:C[6]-3:N-2:	C[6,6a]-3:C[6]-3:O-1:	C[6]-3:N-3:	C[6](C[6]C[6,6a]O)(C[6]O[6]O)(NN)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]N)(O)	N(C[6]C[6]2)(NC[5a]H)	C[6](C[6]C[6,6a]O)(C[6]O[6]O)(NN){2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]N)(O){1|H<1>,1|O<1>,1|O<2>,2|C<3>}	N(C[6]C[6]2)(NC[5a]H)	125.1950	0.000	1	125.1950	0.000	1	125.0307	0.049	3	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	C[6]-3:C[6]-3:N-2:	C[6,6a]-3:C[6]-3:O-1:	C[6a]-3:C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]Cl)(NC[6a])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]N)(O)	N(C[6a]C[6a]2)(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]Cl)(NC[6a]){1|O<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]N)(O){1|Cl<1>,1|H<1>,3|C<3>}	N(C[6a]C[6a]2)(C[6]C[6]2)	112.5840	0.000	1	112.5840	0.000	1	112.5840	0.000	1	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:Cl-1:	C[6a]-3:C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]Cl)(NC[6a])	C[6](C[6]C[6,6a]O)(C[6]C[6]N)(Cl)	N(C[6a]C[6a]2)(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]Cl)(NC[6a]){1|O<1>,2|C<3>}	C[6](C[6]C[6,6a]O)(C[6]C[6]N)(Cl){1|O<1>,2|C<3>}	N(C[6a]C[6a]2)(C[6]C[6]2)	128.9520	0.000	1	128.9520	0.000	1	128.9520	0.000	1	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:	C[6](C[6]C[6]H)2(NC[5a])	C[6](C[6]C[6]C)(C[6]C[6]N)(H)	N(C[5a]N[5a]2)(C[6]C[6]2)	C[6](C[6]C[6]H)2(NC[5a]){1|C<3>,2|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<1>}	N(C[5a]N[5a]2)(C[6]C[6]2)	121.1200	8.348	2	121.1200	69.691	2	121.1200	69.691	2	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(NC)	C[6](C[6]C[6]C)(C[6]C[6]N)(H)	N(C[6]C[6]2)(CCH)	C[6](C[6]C[6]C)(C[6]C[6]H)(NC){1|C<2>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]C[6]N)(H){1|C<3>,1|C<4>}	N(C[6]C[6]2)(CCH)	119.9430	0.000	1	119.9430	0.000	1	121.2021	13.886	11	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(NC)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	N(C[6]C[6]2)(CC[6a]H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NC){1|Co<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	N(C[6]C[6]2)(CC[6a]H)	122.1495	4.690	2	122.1495	21.998	2	121.2021	13.886	11	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(NC)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	N(C[6]C[6]2)(CNO)	C[6](C[6]C[6]H)(C[6]N[6]H)(NC){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	N(C[6]C[6]2)(CNO)	122.3375	3.215	2	121.3830	7.902	3	121.2021	13.886	11	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(NC)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	N(C[6]C[6]2)(CNO)	C[6](C[6]C[6]H)(C[6]N[6]H)(NC){1|Pd<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	N(C[6]C[6]2)(CNO)	119.4740	0.000	1	121.3830	7.902	3	121.2021	13.886	11	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C-3:	C[6](C[6]C[6]H)2(NC)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	N(C[6]C[6]2)(CC[6]O)	C[6](C[6]C[6]H)2(NC){1|N<3>,2|H<1>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	N(C[6]C[6]2)(CC[6]O)	122.1585	3.976	2	122.1585	15.809	2	121.2021	13.886	11	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C-3:	C[6](C[6]C[6]H)2(NC)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	N(C[6]C[6]2)(CC[6a]O)	C[6](C[6]C[6]H)2(NC){1|N<3>,2|H<1>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	N(C[6]C[6]2)(CC[6a]O)	122.3610	6.928	2	122.3610	48.000	2	121.2021	13.886	11	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(NC)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	N(C[6]C[6]2)(CC[6a]N)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(NC){1|Zn<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|N<3>}	N(C[6]C[6]2)(CC[6a]N)	115.7930	0.000	1	115.7930	0.000	1	121.2021	13.886	11	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(NC[6])	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	N(C[6]C[6]2)2	C[6](C[6]C[6]H)(C[6]C[6]P)(NC[6]){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|P<3>,2|C<3>}	N(C[6]C[6]2)2	122.3155	0.975	2	122.3155	0.951	2	122.3155	0.951	2	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:N-3:	C[6](C[6]C[6,6]C)(C[6]C[6]H)(NN)	C[6](C[6]C[6,6]H)(C[6]C[6]N)(H)	N(C[6]C[6]2)(NC[6a]H)	C[6](C[6]C[6,6]C)(C[6]C[6]H)(NN){1|H<1>,2|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]N)(H){1|C<3>,3|C<4>}	N(C[6]C[6]2)(NC[6a]H)	125.3170	0.000	1	125.3170	0.000	1	118.8661	31.758	9	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:N-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(NN)	C[6](C[6]C[6,6a]H)(C[6]C[6]N)(H)	N(C[6]C[6]2)(NCH)	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(NN){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]N)(H){1|O<1>,2|C<3>}	N(C[6]C[6]2)(NCH)	116.0365	0.110	2	116.0365	0.012	2	118.8661	31.758	9	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:N-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(NN)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	N(C[6]C[6]2)(NC[6a]H)	C[6](C[6]C[6]H)(C[6]C[6]O)(NN){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|O<1>,1|O<2>}	N(C[6]C[6]2)(NC[6a]H)	116.0700	0.757	3	116.0700	0.573	3	118.8661	31.758	9	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:N-3:	C[6](C[6]C[6]H)2(NN)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	N(C[6]C[6]2)(NOO)	C[6](C[6]C[6]H)2(NN){1|N<3>,2|H<1>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	N(C[6]C[6]2)(NOO)	122.3655	12.123	2	122.3655	146.976	2	118.8661	31.758	9	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:N-3:	C[6](C[6]C[6]Pd)(C[6]C[6]H)(NN)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	N(C[6]C[6]2)(NC[6a]Pd)	C[6](C[6]C[6]Pd)(C[6]C[6]H)(NN){1|C<2>,2|H<1>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|Pd<4>,1|C<3>}	N(C[6]C[6]2)(NC[6a]Pd)	119.4640	0.000	1	119.4640	0.000	1	118.8661	31.758	9	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:	C[6](C[6]C[6,6]C)(C[6]C[6]H)(NC[6a])	C[6](C[6]C[6,6]H)(C[6]C[6]N)(H)	N(C[6a]C[6a]2)(C[6]C[6]2)	C[6](C[6]C[6,6]C)(C[6]C[6]H)(NC[6a]){1|H<1>,2|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]N)(H){1|C<3>,3|C<4>}	N(C[6a]C[6a]2)(C[6]C[6]2)	124.4850	0.000	1	124.4850	0.000	1	122.1556	19.584	17	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(NC[6a])	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	N(C[6a]C[6a]2)(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(NC[6a]){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|O<1>,2|C<3>}	N(C[6a]C[6a]2)(C[6]C[6]2)	122.2018	1.081	4	120.2810	19.322	5	122.1556	19.584	17	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(NC[6a])	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	N(C[6a]C[6a]2)(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(NC[6a]){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|O<1>,2|C<3>}	N(C[6a]C[6a]2)(C[6]C[6]2)	112.5980	0.000	1	120.2810	19.322	5	122.1556	19.584	17	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(NC[6a])	C[6](C[6]C[6]C)(C[6]C[6]N)(H)	N(C[6a]C[6a]2)(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(NC[6a]){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]C[6]N)(H){1|C<3>,1|N<3>,1|O<1>}	N(C[6a]C[6a]2)(C[6]C[6]2)	127.1190	0.000	1	127.1190	0.000	1	122.1556	19.584	17	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(NC[6a])	C[6](C[6]C[6]N)2(H)	N(C[6a]C[6a]2)(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(NC[6a]){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)2(H){1|C<3>,1|N<3>,1|O<1>}	N(C[6a]C[6a]2)(C[6]C[6]2)	126.6740	0.000	1	126.6740	0.000	1	122.1556	19.584	17	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(NC[6a])	C[6](C[6]C[6]C)(C[6]C[6]N)(H)	N(C[6a]C[6a]2)(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(NC[6a]){1|C<3>,2|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<1>}	N(C[6a]C[6a]2)(C[6]C[6]2)	127.0230	0.000	1	127.0230	0.000	1	122.1556	19.584	17	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:	C[6](C[6]C[6]H)2(NC[6a])	C[6](C[6]C[6]C)(C[6]C[6]N)(H)	N(C[6a]C[6a,6a]C[6a])(C[6]C[6]2)	C[6](C[6]C[6]H)2(NC[6a]){1|C<3>,2|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<1>}	N(C[6a]C[6a,6a]C[6a])(C[6]C[6]2)	121.2080	4.608	2	121.2080	21.229	2	122.1556	19.584	17	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:	C[6](C[6]C[6]H)2(NC[6a])	C[6](C[6]C[6]C)(C[6]C[6]N)(H)	N(C[6a]C[6a]2)(C[6]C[6]2)	C[6](C[6]C[6]H)2(NC[6a]){1|C<3>,2|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<1>}	N(C[6a]C[6a]2)(C[6]C[6]2)	121.1887	5.155	4	121.1887	26.577	4	122.1556	19.584	17	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:	C[6](C[6]C[6]H)2(NC[6a])	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	N(C[6a]C[6a]2)(C[6]C[6]2)	C[6](C[6]C[6]H)2(NC[6a]){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<1>}	N(C[6a]C[6a]2)(C[6]C[6]2)	121.3840	6.053	2	121.3840	36.637	2	122.1556	19.584	17	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:O-1:	C[6]-3:N-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(NN)	C[6](C[6]C[6]H)(C[6]C[6]N)(O)	N(C[6]C[6]2)(NC[6a]H)	C[6](C[6]C[6]H)(C[6]C[6]O)(NN){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]C[6]N)(O){1|C<3>,1|H<1>,1|O<2>}	N(C[6]C[6]2)(NC[6a]H)	124.7737	0.758	3	124.7737	0.574	3	121.0382	30.729	9	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:O-1:	C[6]-3:N-3:	C[6](C[6]C[6]O)2(NN)	C[6](C[6]C[6]N)2(O)	N(C[6]C[6]2)(NC[6a]H)	C[6](C[6]C[6]O)2(NN){1|C<3>,2|N<2>}	C[6](C[6]C[6]N)2(O){1|C<3>,2|O<1>}	N(C[6]C[6]2)(NC[6a]H)	119.1705	6.032	6	119.1705	36.379	6	121.0382	30.729	9	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:O-1:	C[6a]-3:C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(NC[6a])	C[6](C[6]C[6]C)(C[6]C[6]N)(O)	N(C[6a]C[6a]2)(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(NC[6a]){1|C<3>,2|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]N)(O){1|C<3>,2|H<1>}	N(C[6a]C[6a]2)(C[6]C[6]2)	114.5950	0.000	1	114.5950	0.000	1	114.5950	0.000	1	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	C[6]-3:C[6]-3:N-2:	C[6]-3:N[6]-3:H-1:	C[6]-3:C-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(NC)	C[6](C[6]C[6]N)(N[6]C[6]C)(H)	N(C[6]C[6]2)(CNO)	C[6](C[6]C[6]H)(C[6]N[6]H)(NC){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]N)(N[6]C[6]C)(H){1|C<3>,2|H<1>}	N(C[6]C[6]2)(CNO)	119.1960	3.555	2	119.1960	12.640	2	119.1960	12.640	2	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	C[6]-3:C[6]-3:N-2:	C[6]-3:N[6]-3:O-1:	C[6]-3:N-3:	C[6](C[6]C[6]C)(C[6]N[6]O)(NN)	C[6](C[6]C[6]N)(N[6]C[6]C)(O)	N(C[6]C[6]2)(NC[6a]H)	C[6](C[6]C[6]C)(C[6]N[6]O)(NN){1|C<2>,1|C<3>,1|C<4>}	C[6](C[6]C[6]N)(N[6]C[6]C)(O){1|C<3>,1|C<4>,1|O<1>}	N(C[6]C[6]2)(NC[6a]H)	123.4660	0.310	10	123.4660	0.096	10	121.5922	18.821	19	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	C[6]-3:C[6]-3:N-2:	C[6]-3:N[6]-3:O-1:	C[6]-3:N-3:	C[6](C[6]N[6]N)(C[6]N[6]O)(NN)	C[6](C[6]C[6]N)(N[6]C[6]H)(O)	N(C[6]C[6]2)(NC[6a]H)	C[6](C[6]N[6]N)(C[6]N[6]O)(NN){1|C<3>,1|H<1>}	C[6](C[6]C[6]N)(N[6]C[6]H)(O){1|N<2>,1|N<3>,1|O<1>}	N(C[6]C[6]2)(NC[6a]H)	126.5670	0.000	1	126.5670	0.000	1	121.5922	18.821	19	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	C[6]-3:C[6]-3:N-2:	C[6]-3:N[6]-3:O-1:	C[6]-3:N-3:	C[6](C[6]N[6]O)2(NN)	C[6](C[6]C[6]N)(N[6]C[6]C)(O)	N(C[6]C[6]2)(NC[5a]H)	C[6](C[6]N[6]O)2(NN){1|C<3>,2|C<4>}	C[6](C[6]C[6]N)(N[6]C[6]C)(O){1|N<3>,2|O<1>}	N(C[6]C[6]2)(NC[5a]H)	119.3005	8.445	2	119.3005	71.318	2	121.5922	18.821	19	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	C[6]-3:C[6]-3:N-2:	C[6]-3:N[6]-3:O-1:	C[6]-3:N-3:	C[6](C[6]N[6]O)2(NN)	C[6](C[6]C[6]N)(N[6]C[6]H)(O)	N(C[6]C[6]2)(NCH)	C[6](C[6]N[6]O)2(NN){1|C<3>,1|H<1>}	C[6](C[6]C[6]N)(N[6]C[6]H)(O){1|N<2>,2|O<1>}	N(C[6]C[6]2)(NCH)	115.1250	0.000	1	115.1250	0.000	1	121.5922	18.821	19	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	C[6]-3:C[6]-3:N-2:	C[6]-3:N[6]-3:O-1:	C[6]-3:N-3:	C[6](C[6]N[6]O)2(NN)	C[6](C[6]C[6]N)(N[6]C[6]H)(O)	N(C[6]C[6]2)(NC[6a]H)	C[6](C[6]N[6]O)2(NN){1|C<3>,2|H<1>}	C[6](C[6]C[6]N)(N[6]C[6]H)(O){1|N<3>,2|O<1>}	N(C[6]C[6]2)(NC[6a]H)	120.1372	5.748	4	119.0596	30.583	5	121.5922	18.821	19	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	C[6]-3:C[6]-3:N-2:	C[6]-3:N[6]-3:O-1:	C[6]-3:N-3:	C[6](C[6]N[6]O)2(NN)	C[6](C[6]C[6]N)(N[6]C[6]H)(O)	N(C[6]C[6]2)(NC[6a]H)	C[6](C[6]N[6]O)2(NN){1|Zn<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]N)(N[6]C[6]H)(O){1|N<3>,2|O<1>}	N(C[6]C[6]2)(NC[6a]H)	114.7490	0.000	1	119.0596	30.583	5	121.5922	18.821	19	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	C[6]-3:C[6]-3:N-2:	N[6]-3:C[6]-3:H-1:	C[6]-3:C-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(NC)	C[6](N[6]C[6]Co)(C[6]C[6]N)(H)	N(C[6]C[6]2)(CC[6a]H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NC){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]N)(H){1|C<3>,2|H<1>}	N(C[6]C[6]2)(CC[6a]H)	119.3305	4.830	2	119.3305	23.331	2	120.1817	13.839	3	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	C[6]-3:C[6]-3:N-2:	N[6]-3:C[6]-3:H-1:	C[6]-3:C-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(NC)	C[6](N[6]C[6]Pd)(C[6]C[6]N)(H)	N(C[6]C[6]2)(CNO)	C[6](C[6]C[6]H)(C[6]N[6]H)(NC){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]N)(H){1|C<3>,2|H<1>}	N(C[6]C[6]2)(CNO)	121.8840	0.000	1	121.8840	0.000	1	120.1817	13.839	3	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	C[6]-3:C[6]-3:N-2:	N[6]-3:C[6]-3:O-1:	C[6]-3:N-3:	C[6](C[6]N[6]O)2(NN)	C[6](N[6]C[6]Zn)(C[6]C[6]N)(O)	N(C[6]C[6]2)(NC[6a]H)	C[6](C[6]N[6]O)2(NN){1|Zn<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]N)(O){1|N<3>,2|O<1>}	N(C[6]C[6]2)(NC[6a]H)	125.5770	0.000	1	125.5770	0.000	1	125.5770	0.000	1	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	C[6]-3:N[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(NC)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(CCH)	C[6](C[6]C[6]H)(N[6]C[6]C)(NC){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,1|C<4>,1|H<1>}	N(C[6]C[6]N[6])(CCH)	128.7890	0.000	1	128.7890	0.000	1	128.2874	0.901	12	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	C[6]-3:N[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(NC)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(CC[6]O)	C[6](C[6]C[6]H)(N[6]C[6]C)(NC){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,1|C<4>,1|H<1>}	N(C[6]C[6]N[6])(CC[6]O)	128.9026	0.742	5	128.9026	0.551	5	128.2874	0.901	12	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	C[6]-3:N[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(NC)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(CHN)	C[6](C[6]C[6]H)(N[6]C[6]C)(NC){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,1|C<4>,1|H<1>}	N(C[6]C[6]N[6])(CHN)	128.3303	0.391	3	128.3303	0.153	3	128.2874	0.901	12	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	C[6]-3:N[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(NC)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(CC[6]O)	C[6](C[6]C[6]H)(N[6]C[6]H)(NC){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,2|H<1>}	N(C[6]C[6]N[6])(CC[6]O)	126.8840	0.709	2	126.8840	0.502	2	128.2874	0.901	12	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	C[6]-3:N[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C-3:	C[6](C[6]C[6]H)(N[6]C[6]O)(NC)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(CC[5]O)	C[6](C[6]C[6]H)(N[6]C[6]O)(NC){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,1|H<1>,1|O<1>}	N(C[6]C[6]N[6])(CC[5]O)	127.3880	0.000	1	127.3880	0.000	1	128.2874	0.901	12	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	C[6]-3:N[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[5]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(NC[5])	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(C[5]N[5]2)	C[6](C[6]C[6]H)(N[6]C[6]H)(NC[5]){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,2|H<1>}	N(C[6]C[6]N[6])(C[5]N[5]2)	128.9010	0.454	2	128.9010	0.206	2	128.9010	0.206	2	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	C[6]-3:N[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(NC[6])	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])2	C[6](C[6]C[6]H)(N[6]C[6]C)(NC[6]){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,1|C<4>,1|H<1>}	N(C[6]C[6]N[6])2	128.0830	0.462	2	128.0830	0.214	2	128.0830	0.214	2	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	C[6]-3:N[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6a]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(NC[6a])	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(C[6a]C[6a]2)	C[6](C[6]C[6]H)(N[6]C[6]H)(NC[6a]){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,2|H<1>}	N(C[6]C[6]N[6])(C[6a]C[6a]2)	122.3450	0.000	1	122.3450	0.000	1	122.3450	0.000	1	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	C[6]-3:N[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:N-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(NN)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(NOO)	C[6](C[6]C[6]H)(N[6]C[6]C)(NN){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,2|C<4>}	N(C[6]C[6]N[6])(NOO)	130.9040	0.000	1	130.9040	0.000	1	132.1225	2.969	2	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	C[6]-3:N[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:N-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(NN)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(NOO)	C[6](C[6]C[6]H)(N[6]C[6]H)(NN){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,2|H<1>}	N(C[6]C[6]N[6])(NOO)	133.3410	0.000	1	133.3410	0.000	1	132.1225	2.969	2	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:	C[6](N[6]C[5,6]Co)(C[6]C[6]H)(NC[5a])	C[6](C[6]C[5,6]C)(C[6]N[6]N)(H)	N(C[5a]C[5a,6a]N[5a])(C[6]C[6]N[6])	C[6](N[6]C[5,6]Co)(C[6]C[6]H)(NC[5a]){1|C<3>,2|C<4>}	C[6](C[6]C[5,6]C)(C[6]N[6]N)(H){1|Co<4>,1|C<3>,1|C<4>}	N(C[5a]C[5a,6a]N[5a])(C[6]C[6]N[6])	114.1415	0.818	2	114.1415	0.669	2	114.5154	2.969	107	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:	C[6](N[6]C[5,6]Ir)(C[6]C[6]H)(NC[5a])	C[6](C[6]C[5,6]C)(C[6]N[6]N)(H)	N(C[5a]C[5a,6a]N[5a])(C[6]C[6]N[6])	C[6](N[6]C[5,6]Ir)(C[6]C[6]H)(NC[5a]){1|C<3>,2|C<4>}	C[6](C[6]C[5,6]C)(C[6]N[6]N)(H){1|Ir<8>,1|C<3>,1|C<4>}	N(C[5a]C[5a,6a]N[5a])(C[6]C[6]N[6])	115.5100	0.000	1	115.5100	0.000	1	114.5154	2.969	107	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:	C[6](N[6]C[6,6]Li)(C[6]C[6]H)(NC[5a])	C[6](C[6]C[6,6]H)(C[6]N[6]N)(H)	N(C[5a]C[5a,6a]N[5a])(C[6]C[6]N[6])	C[6](N[6]C[6,6]Li)(C[6]C[6]H)(NC[5a]){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6,6]H)(C[6]N[6]N)(H){1|Li<4>,1|C<3>,1|C<4>}	N(C[5a]C[5a,6a]N[5a])(C[6]C[6]N[6])	114.1140	0.322	2	114.1140	0.104	2	114.5154	2.969	107	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:	C[6](N[6]C[6]Al)(C[6]C[6]H)(NC[5a])	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[5a]C[5a,6a]N[5a])(C[6]C[6]N[6])	C[6](N[6]C[6]Al)(C[6]C[6]H)(NC[5a]){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Al<5>,1|C<3>,1|H<1>}	N(C[5a]C[5a,6a]N[5a])(C[6]C[6]N[6])	116.0777	0.329	4	116.0777	0.108	4	114.5154	2.969	107	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:	C[6](N[6]C[6]Cd)(C[6]C[6]H)(NC[5a])	C[6](C[6]C[6]C)(C[6]N[6]N)(H)	N(C[5a]C[5a,6a]N[5a])(C[6]C[6]N[6])	C[6](N[6]C[6]Cd)(C[6]C[6]H)(NC[5a]){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]N)(H){1|Cd<6>,1|C<3>,1|H<1>}	N(C[5a]C[5a,6a]N[5a])(C[6]C[6]N[6])	116.0397	0.163	4	116.0397	0.027	4	114.5154	2.969	107	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(NC[5a])	C[6](C[6]C[6]C)(C[6]N[6]N)(H)	N(C[5a]C[5a,6a]N[5a])(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(NC[5a]){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]N)(H){1|Cu<5>,1|C<3>,1|H<1>}	N(C[5a]C[5a,6a]N[5a])(C[6]C[6]N[6])	116.0975	0.306	2	116.0975	0.094	2	114.5154	2.969	107	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NC[5a])	C[6](C[6]C[6]C)(C[6]N[6]N)(H)	N(C[5a]C[5a,6a]N[5a])(C[6]C[6]N[6])	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NC[5a]){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]N)(H){1|Fe<5>,1|C<3>,1|H<1>}	N(C[5a]C[5a,6a]N[5a])(C[6]C[6]N[6])	115.9630	0.339	2	115.9630	0.115	2	114.5154	2.969	107	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NC[5a])	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[5a]C[5a,6a]N[5a])(C[6]C[6]N[6])	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NC[5a]){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Fe<4>,1|C<3>,1|H<1>}	N(C[5a]C[5a,6a]N[5a])(C[6]C[6]N[6])	113.4640	0.546	2	113.6563	0.927	6	114.5154	2.969	107	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NC[5a])	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[5a]C[5a,6a]N[5a])(C[6]C[6]N[6])	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NC[5a]){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Fe<5>,1|C<3>,1|H<1>}	N(C[5a]C[5a,6a]N[5a])(C[6]C[6]N[6])	113.7525	1.187	4	113.6563	0.927	6	114.5154	2.969	107	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NC[5a])	C[6](C[6]C[6]O)(C[6]N[6]N)(H)	N(C[5a]C[5a,6a]N[5a])(C[6]C[6]N[6])	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NC[5a]){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]O)(C[6]N[6]N)(H){1|Fe<6>,1|C<3>,1|H<1>}	N(C[5a]C[5a,6a]N[5a])(C[6]C[6]N[6])	114.3280	0.946	4	114.3280	0.895	4	114.5154	2.969	107	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]H)(NC[5a])	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[5a]C[5a,6a]N[5a])(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]H)(NC[5a]){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ir<8>,1|C<3>,1|H<1>}	N(C[5a]C[5a,6a]N[5a])(C[6]C[6]N[6])	114.0644	0.353	5	114.7436	0.593	11	114.5154	2.969	107	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]H)(NC[5a])	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[5a]C[5a,6a]N[5a])(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]H)(NC[5a]){1|C<3>,1|F<1>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ir<8>,1|C<3>,1|H<1>}	N(C[5a]C[5a,6a]N[5a])(C[6]C[6]N[6])	115.2465	0.559	4	114.7436	0.593	11	114.5154	2.969	107	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]H)(NC[5a])	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[5a]C[5a,6a]N[5a])(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]H)(NC[5a]){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ir<8>,2|C<3>}	N(C[5a]C[5a,6a]N[5a])(C[6]C[6]N[6])	115.4360	0.464	2	114.7436	0.593	11	114.5154	2.969	107	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:	C[6](N[6]C[6]Li)(C[6]C[6]H)(NC[5a])	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[5a]C[5a,6a]N[5a])(C[6]C[6]N[6])	C[6](N[6]C[6]Li)(C[6]C[6]H)(NC[5a]){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Li<5>,1|C<3>,1|H<1>}	N(C[5a]C[5a,6a]N[5a])(C[6]C[6]N[6])	114.8375	0.605	2	115.1073	0.401	3	114.5154	2.969	107	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:	C[6](N[6]C[6]Li)(C[6]C[6]H)(NC[5a])	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[5a]C[5a,6a]N[5a])(C[6]C[6]N[6])	C[6](N[6]C[6]Li)(C[6]C[6]H)(NC[5a]){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Li<5>,1|C<3>,1|H<1>}	N(C[5a]C[5a,6a]N[5a])(C[6]C[6]N[6])	115.6470	0.000	1	115.1073	0.401	3	114.5154	2.969	107	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:	C[6](N[6]C[6]Mn)(C[6]C[6]H)(NC[5a])	C[6](C[6]C[6]O)(C[6]N[6]N)(H)	N(C[5a]C[5a,6a]N[5a])(C[6]C[6]N[6])	C[6](N[6]C[6]Mn)(C[6]C[6]H)(NC[5a]){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]O)(C[6]N[6]N)(H){1|Mn<6>,1|C<3>,1|H<1>}	N(C[5a]C[5a,6a]N[5a])(C[6]C[6]N[6])	114.6470	1.007	4	114.6470	1.014	4	114.5154	2.969	107	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NC[5a])	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[5a]C[5a,6a]N[5a])(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NC[5a]){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<6>,1|C<3>,1|H<1>}	N(C[5a]C[5a,6a]N[5a])(C[6]C[6]N[6])	112.1285	0.179	2	112.1285	0.032	2	114.5154	2.969	107	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:	C[6](N[6]C[6]Os)(C[6]C[6]H)(NC[5a])	C[6](C[6]C[6]C)(C[6]N[6]N)(H)	N(C[5a]C[5a,6a]N[5a])(C[6]C[6]N[6])	C[6](N[6]C[6]Os)(C[6]C[6]H)(NC[5a]){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]N)(H){1|Os<6>,1|C<3>,1|H<1>}	N(C[5a]C[5a,6a]N[5a])(C[6]C[6]N[6])	114.3485	0.989	2	114.3485	0.979	2	114.5154	2.969	107	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]H)(NC[5a])	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[5a]C[5a,6a]N[5a])(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]H)(NC[5a]){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Pd<4>,1|C<3>,1|H<1>}	N(C[5a]C[5a,6a]N[5a])(C[6]C[6]N[6])	116.5360	0.000	1	116.5360	0.000	1	114.5154	2.969	107	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]H)(NC[5a])	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[5a]C[5a,6a]N[5a])(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]H)(NC[5a]){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Pt<4>,1|C<3>,1|H<1>}	N(C[5a]C[5a,6a]N[5a])(C[6]C[6]N[6])	113.7821	0.751	9	113.7821	0.564	9	114.5154	2.969	107	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:	C[6](N[6]C[6]Re)(C[6]C[6]H)(NC[5a])	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[5a]C[5a,6a]N[5a])(C[6]C[6]N[6])	C[6](N[6]C[6]Re)(C[6]C[6]H)(NC[5a]){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Re<6>,1|C<3>,1|H<1>}	N(C[5a]C[5a,6a]N[5a])(C[6]C[6]N[6])	114.5620	0.000	1	114.5620	0.000	1	114.5154	2.969	107	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NC[5a])	C[6](C[6]C[6]C)(C[6]N[6]N)(H)	N(C[5a]C[5a,6a]N[5a])(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NC[5a]){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]N)(H){1|Ru<6>,1|C<3>,1|H<1>}	N(C[5a]C[5a,6a]N[5a])(C[6]C[6]N[6])	113.9740	0.117	2	113.9740	0.014	2	114.5154	2.969	107	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NC[5a])	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[5a]C[5a,6a]N[5a])(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NC[5a]){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<5>,1|C<3>,1|H<1>}	N(C[5a]C[5a,6a]N[5a])(C[6]C[6]N[6])	114.6930	0.482	6	114.4797	6.238	37	114.5154	2.969	107	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NC[5a])	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[5a]C[5a,6a]N[5a])(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NC[5a]){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<6>,1|C<3>,1|H<1>}	N(C[5a]C[5a,6a]N[5a])(C[6]C[6]N[6])	112.3815	1.389	4	114.4797	6.238	37	114.5154	2.969	107	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NC[5a])	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[5a]C[5a,6a]N[5a])(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NC[5a]){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<7>,1|C<3>,1|H<1>}	N(C[5a]C[5a,6a]N[5a])(C[6]C[6]N[6])	113.2743	1.694	6	114.4797	6.238	37	114.5154	2.969	107	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NC[5a])	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[5a]C[5a,6a]N[5a])(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NC[5a]){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<7>,1|C<4>,1|H<1>}	N(C[5a]C[5a,6a]N[5a])(C[6]C[6]N[6])	119.0515	0.537	2	114.4797	6.238	37	114.5154	2.969	107	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NC[5a])	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[5a]C[5a,6a]N[5a])(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NC[5a]){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<8>,1|C<3>,1|H<1>}	N(C[5a]C[5a,6a]N[5a])(C[6]C[6]N[6])	112.2945	2.013	2	114.4797	6.238	37	114.5154	2.969	107	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NC[5a])	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[5a]C[5a,6a]N[5a])(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NC[5a]){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<8>,1|C<4>,1|H<1>}	N(C[5a]C[5a,6a]N[5a])(C[6]C[6]N[6])	119.3930	1.039	2	114.4797	6.238	37	114.5154	2.969	107	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NC[5a])	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[5a]C[5a,6a]N[5a])(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NC[5a]){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<9>,1|C<3>,1|H<1>}	N(C[5a]C[5a,6a]N[5a])(C[6]C[6]N[6])	112.5550	0.000	1	114.4797	6.238	37	114.5154	2.969	107	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NC[5a])	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[5a]C[5a,6a]N[5a])(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NC[5a]){1|C<3>,1|C<5>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<9>,1|C<4>,1|H<1>}	N(C[5a]C[5a,6a]N[5a])(C[6]C[6]N[6])	118.6250	0.000	1	114.4797	6.238	37	114.5154	2.969	107	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NC[5a])	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[5a]C[5a,6a]N[5a])(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NC[5a]){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<6>,1|C<3>,1|H<1>}	N(C[5a]C[5a,6a]N[5a])(C[6]C[6]N[6])	114.6650	0.911	2	114.4797	6.238	37	114.5154	2.969	107	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NC[5a])	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[5a]C[5a,6a]N[5a])(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NC[5a]){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<7>,1|C<4>,1|H<1>}	N(C[5a]C[5a,6a]N[5a])(C[6]C[6]N[6])	120.6830	0.000	1	114.4797	6.238	37	114.5154	2.969	107	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NC[5a])	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[5a]C[5a,6a]N[5a])(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NC[5a]){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<6>,1|C<3>,1|H<1>}	N(C[5a]C[5a,6a]N[5a])(C[6]C[6]N[6])	113.5747	0.593	10	114.4797	6.238	37	114.5154	2.969	107	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NC[5a])	C[6](C[6]C[6]O)(C[6]N[6]N)(H)	N(C[5a]C[5a,6a]N[5a])(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NC[5a]){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]O)(C[6]N[6]N)(H){1|Ru<6>,1|C<3>,1|H<1>}	N(C[5a]C[5a,6a]N[5a])(C[6]C[6]N[6])	113.8640	0.798	2	113.8640	0.636	2	114.5154	2.969	107	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:	C[6](N[6]C[6]Sn)(C[6]C[6]H)(NC[5a])	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[5a]C[5a,6a]N[5a])(C[6]C[6]N[6])	C[6](N[6]C[6]Sn)(C[6]C[6]H)(NC[5a]){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Sn<6>,1|C<3>,1|H<1>}	N(C[5a]C[5a,6a]N[5a])(C[6]C[6]N[6])	112.9925	0.183	2	112.9925	0.034	2	114.5154	2.969	107	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(NC[5a])	C[6](C[6]C[6]O)(C[6]N[6]N)(H)	N(C[5a]C[5a,6a]N[5a])(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]H)(NC[5a]){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]O)(C[6]N[6]N)(H){1|Zn<6>,1|C<3>,1|H<1>}	N(C[5a]C[5a,6a]N[5a])(C[6]C[6]N[6])	114.4240	0.966	4	114.4240	0.934	4	114.5154	2.969	107	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C-3:	C[6](N[6]C[6]Al)(C[6]C[6]H)(NC)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(CNN)	C[6](N[6]C[6]Al)(C[6]C[6]H)(NC){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Al<4>,1|C<3>,1|H<1>}	N(C[6]C[6]N[6])(CNN)	117.1570	0.000	1	117.1570	0.000	1	119.7909	11.258	13	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(NC)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(CCO)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(NC){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cu<5>,1|C<3>,1|H<1>}	N(C[6]C[6]N[6])(CCO)	117.3430	0.000	1	117.3430	0.000	1	119.7909	11.258	13	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C-3:	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NC)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(CFeO)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NC){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Fe<6>,1|C<3>,1|H<1>}	N(C[6]C[6]N[6])(CFeO)	122.3130	0.000	1	122.3130	0.000	1	119.7909	11.258	13	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C-3:	C[6](N[6]C[6]Ir)(C[6]C[6]H)(NC)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(CIrC)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(NC){1|Br<1>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ir<8>,1|C<3>,1|H<1>}	N(C[6]C[6]N[6])(CIrC)	120.6740	0.000	1	120.6740	0.000	1	119.7909	11.258	13	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C-3:	C[6](N[6]C[6]Ir)(C[6]C[6]H)(NC)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(COO)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(NC){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ir<6>,1|C<3>,1|H<1>}	N(C[6]C[6]N[6])(COO)	117.7800	0.000	1	117.7800	0.000	1	119.7909	11.258	13	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C-3:	C[6](N[6]C[6]Mn)(C[6]C[6]H)(NC)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(CCO)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(NC){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Mn<6>,1|C<3>,1|H<1>}	N(C[6]C[6]N[6])(CCO)	115.4260	0.000	1	115.4260	0.000	1	119.7909	11.258	13	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C-3:	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NC)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(CCO)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NC){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<5>,1|C<3>,1|H<1>}	N(C[6]C[6]N[6])(CCO)	118.4000	0.000	1	118.4000	0.000	1	119.7909	11.258	13	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C-3:	C[6](N[6]C[6]Pt)(C[6]C[6]H)(NC)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(CC[6]O)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(NC){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Pt<5>,1|C<3>,1|H<1>}	N(C[6]C[6]N[6])(CC[6]O)	123.6750	0.000	1	123.6750	0.000	1	119.7909	11.258	13	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C-3:	C[6](N[6]C[6]Pt)(C[6]C[6]H)(NC)	C[6](C[6]N[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(CC[6a]N)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(NC){1|H<1>,1|N<3>,1|O<1>}	C[6](C[6]N[6]H)(C[6]N[6]N)(H){1|Pt<4>,1|C<3>,1|C<4>}	N(C[6]C[6]N[6])(CC[6a]N)	117.4390	0.000	1	117.4390	0.000	1	119.7909	11.258	13	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NC)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(CC[6]O)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NC){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<9>,1|C<3>,1|H<1>}	N(C[6]C[6]N[6])(CC[6]O)	116.6430	0.000	1	116.6430	0.000	1	119.7909	11.258	13	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C-3:	C[6](N[6]C[6]Yb)(C[6]C[6]H)(NC)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(CNN)	C[6](N[6]C[6]Yb)(C[6]C[6]H)(NC){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Yb<14>,1|C<4>,1|H<1>}	N(C[6]C[6]N[6])(CNN)	126.2090	0.000	1	126.2090	0.000	1	119.7909	11.258	13	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C-3:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(NC)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(CCO)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(NC){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Zn<4>,1|C<3>,1|H<1>}	N(C[6]C[6]N[6])(CCO)	124.0490	0.000	1	122.1115	7.508	2	119.7909	11.258	13	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C-3:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(NC)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(CCO)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(NC){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Zn<5>,1|C<3>,1|H<1>}	N(C[6]C[6]N[6])(CCO)	120.1740	0.000	1	122.1115	7.508	2	119.7909	11.258	13	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](N[6]C[6,6]Cu)(C[6]C[6]H)(NC[6])	C[6](C[6]C[6,6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])2	C[6](N[6]C[6,6]Cu)(C[6]C[6]H)(NC[6]){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]N)(H){1|Cu<3>,2|C<3>}	N(C[6]C[6]N[6])2	116.7750	0.000	1	116.7750	0.000	1	117.1708	1.252	25	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(NC[6])	C[6](C[6]C[6,6a]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])2	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(NC[6]){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6,6a]H)(C[6]N[6]N)(H){1|Cu<3>,2|C<3>}	N(C[6]C[6]N[6])2	116.3300	0.000	1	116.3300	0.000	1	117.1708	1.252	25	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](N[6]C[6,6a]Pt)(C[6]C[6]H)(NC[6])	C[6](C[6]C[6,6a]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])2	C[6](N[6]C[6,6a]Pt)(C[6]C[6]H)(NC[6]){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]N)(H){1|Pt<4>,2|C<3>}	N(C[6]C[6]N[6])2	116.2493	0.764	4	116.2493	0.584	4	117.1708	1.252	25	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]H)(NC[6])	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])2	C[6](N[6]C[6]Co)(C[6]C[6]H)(NC[6]){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Co<4>,1|C<3>,1|H<1>}	N(C[6]C[6]N[6])2	115.6380	0.000	1	117.7600	3.461	3	117.1708	1.252	25	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]H)(NC[6])	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])2	C[6](N[6]C[6]Co)(C[6]C[6]H)(NC[6]){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Co<7>,1|C<3>,1|H<1>}	N(C[6]C[6]N[6])2	118.8210	0.409	2	117.7600	3.461	3	117.1708	1.252	25	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(NC[6])	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])2	C[6](N[6]C[6]Cu)(C[6]C[6]H)(NC[6]){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cu<4>,1|C<3>,1|H<1>}	N(C[6]C[6]N[6])2	116.9585	0.190	2	117.8080	1.032	4	117.1708	1.252	25	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(NC[6])	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])2	C[6](N[6]C[6]Cu)(C[6]C[6]H)(NC[6]){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cu<5>,1|C<3>,1|H<1>}	N(C[6]C[6]N[6])2	118.6575	0.416	2	117.8080	1.032	4	117.1708	1.252	25	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]H)(NC[6])	C[6](C[6]C[6]C)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])2	C[6](N[6]C[6]Ir)(C[6]C[6]H)(NC[6]){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]N)(H){1|Ir<6>,1|C<3>,1|H<1>}	N(C[6]C[6]N[6])2	117.7405	0.192	2	117.7405	0.037	2	117.1708	1.252	25	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NC[6])	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])2	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NC[6]){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<6>,1|C<3>,1|H<1>}	N(C[6]C[6]N[6])2	117.8180	0.339	2	117.8180	0.115	2	117.1708	1.252	25	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NC[6])	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])2	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NC[6]){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<6>,1|C<3>,1|H<1>}	N(C[6]C[6]N[6])2	118.4975	0.504	2	118.4975	0.254	2	117.1708	1.252	25	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(NC[6])	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])2	C[6](N[6]C[6]Zn)(C[6]C[6]H)(NC[6]){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Zn<5>,1|C<3>,1|H<1>}	N(C[6]C[6]N[6])2	116.2790	0.000	1	116.4240	0.520	6	117.1708	1.252	25	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(NC[6])	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])2	C[6](N[6]C[6]Zn)(C[6]C[6]H)(NC[6]){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Zn<4>,1|C<3>,1|H<1>}	N(C[6]C[6]N[6])2	116.1395	0.451	4	116.4240	0.520	6	117.1708	1.252	25	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(NC[6])	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])2	C[6](N[6]C[6]Zn)(C[6]C[6]H)(NC[6]){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Zn<5>,1|C<3>,1|H<1>}	N(C[6]C[6]N[6])2	117.7070	0.000	1	116.4240	0.520	6	117.1708	1.252	25	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:N-3:	C[6](N[6]C[6,6a]Co)(C[6]C[6]H)(NN)	C[6](C[6]C[6,6a]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(NC[6a]Co)	C[6](N[6]C[6,6a]Co)(C[6]C[6]H)(NN){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]N)(H){1|Co<5>,2|C<3>}	N(C[6]C[6]N[6])(NC[6a]Co)	119.7270	0.000	1	119.7270	0.000	1	119.7783	2.440	116	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:N-3:	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(NN)	C[6](C[6]C[6,6a]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(NC[6a]Cu)	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(NN){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]N)(H){1|Cu<5>,2|C<3>}	N(C[6]C[6]N[6])(NC[6a]Cu)	120.8050	0.000	1	120.8050	0.000	1	119.7783	2.440	116	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:N-3:	C[6](N[6]C[6]Co)(C[6]C[6]H)(NN)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(NC[6a]Co)	C[6](N[6]C[6]Co)(C[6]C[6]H)(NN){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Co<6>,1|C<3>,1|H<1>}	N(C[6]C[6]N[6])(NC[6a]Co)	117.4723	0.175	4	117.4723	0.031	4	119.7783	2.440	116	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:N-3:	C[6](N[6]C[6]Cr)(C[6]C[6]H)(NN)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(NC[6a]Cr)	C[6](N[6]C[6]Cr)(C[6]C[6]H)(NN){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cr<6>,1|C<3>,1|H<1>}	N(C[6]C[6]N[6])(NC[6a]Cr)	120.3653	0.820	7	120.3653	0.673	7	119.7783	2.440	116	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:N-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(NN)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(NC[6a]Cu)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(NN){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cu<5>,1|C<3>,1|H<1>}	N(C[6]C[6]N[6])(NC[6a]Cu)	117.6520	0.000	1	117.6520	0.000	1	119.7783	2.440	116	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:N-3:	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NN)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(NC[6a]Fe)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NN){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Fe<6>,1|C<3>,1|H<1>}	N(C[6]C[6]N[6])(NC[6a]Fe)	125.1480	0.164	2	123.0025	6.222	4	119.7783	2.440	116	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:N-3:	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NN)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(NC[6a]Fe)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NN){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cl<1>,1|Fe<6>,1|C<3>}	N(C[6]C[6]N[6])(NC[6a]Fe)	120.8570	0.475	2	123.0025	6.222	4	119.7783	2.440	116	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:N-3:	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NN)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(NFeC)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NN){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Fe<6>,1|C<3>,1|H<1>}	N(C[6]C[6]N[6])(NFeC)	119.9175	0.499	2	119.9175	0.249	2	119.7783	2.440	116	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:N-3:	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NN)	C[6](C[6]N[6]N)2(H)	N(C[6]C[6]N[6])(NFeC)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NN){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]N[6]N)2(H){2|Fe<6>,1|C<3>}	N(C[6]C[6]N[6])(NFeC)	120.9350	0.221	2	120.9350	0.049	2	119.7783	2.440	116	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:N-3:	C[6](N[6]C[6]Ir)(C[6]C[6]H)(NN)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(NC[6a]Ir)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(NN){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ir<8>,1|C<3>,1|H<1>}	N(C[6]C[6]N[6])(NC[6a]Ir)	119.6788	0.303	5	119.6788	0.092	5	119.7783	2.440	116	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:N-3:	C[6](N[6]C[6]Mn)(C[6]C[6]H)(NN)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(NC[6a]Mn)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(NN){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Mn<6>,1|C<3>,1|H<1>}	N(C[6]C[6]N[6])(NC[6a]Mn)	118.1450	1.195	5	118.1450	1.428	5	119.7783	2.440	116	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:N-3:	C[6](N[6]C[6]Mo)(C[6]C[6]H)(NN)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(NC[6a]Mo)	C[6](N[6]C[6]Mo)(C[6]C[6]H)(NN){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Mo<6>,1|C<3>,1|H<1>}	N(C[6]C[6]N[6])(NC[6a]Mo)	120.6497	0.795	10	120.3705	0.946	12	119.7783	2.440	116	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:N-3:	C[6](N[6]C[6]Mo)(C[6]C[6]H)(NN)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(NC[6a]Mo)	C[6](N[6]C[6]Mo)(C[6]C[6]H)(NN){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Mo<8>,1|C<3>,1|H<1>}	N(C[6]C[6]N[6])(NC[6a]Mo)	118.9745	0.218	2	120.3705	0.946	12	119.7783	2.440	116	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:N-3:	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NN)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(NC[6a]Ni)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NN){1|C<2>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<6>,1|C<3>}	N(C[6]C[6]N[6])(NC[6a]Ni)	119.4050	0.000	1	119.1803	2.715	20	119.7783	2.440	116	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:N-3:	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NN)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(NC[6a]Ni)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NN){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<5>,1|C<3>,1|H<1>}	N(C[6]C[6]N[6])(NC[6a]Ni)	119.6680	0.263	2	119.1803	2.715	20	119.7783	2.440	116	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:N-3:	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NN)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(NC[6a]Ni)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NN){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<6>,1|C<3>,1|H<1>}	N(C[6]C[6]N[6])(NC[6a]Ni)	120.4610	0.000	1	119.1803	2.715	20	119.7783	2.440	116	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:N-3:	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NN)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(NC[6a]Ni)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NN){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<6>,1|C<3>,1|H<1>}	N(C[6]C[6]N[6])(NC[6a]Ni)	119.3590	0.000	1	119.1803	2.715	20	119.7783	2.440	116	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:N-3:	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NN)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(NC[6a]Ni)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NN){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<6>,1|C<3>,1|H<1>}	N(C[6]C[6]N[6])(NC[6a]Ni)	117.7648	0.637	9	119.1803	2.715	20	119.7783	2.440	116	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:N-3:	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NN)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(NC[6a]Ni)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NN){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<5>,1|C<3>,1|H<1>}	N(C[6]C[6]N[6])(NC[6a]Ni)	120.9988	1.622	5	119.1803	2.715	20	119.7783	2.440	116	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:N-3:	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NN)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(NC[6a]Ni)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NN){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<6>,1|C<3>,1|H<1>}	N(C[6]C[6]N[6])(NC[6a]Ni)	120.1670	0.000	1	119.1803	2.715	20	119.7783	2.440	116	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:N-3:	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NN)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(NNiC)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NN){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<6>,1|C<3>,1|H<1>}	N(C[6]C[6]N[6])(NNiC)	117.9095	0.455	2	117.9095	0.207	2	119.7783	2.440	116	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:N-3:	C[6](N[6]C[6]Os)(C[6]C[6]H)(NN)	C[6](C[6]C[6]Cl)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(NC[6a]Os)	C[6](N[6]C[6]Os)(C[6]C[6]H)(NN){1|Cl<1>,1|C<3>,1|H<1>}	C[6](C[6]C[6]Cl)(C[6]N[6]N)(H){1|Os<9>,1|C<3>,1|H<1>}	N(C[6]C[6]N[6])(NC[6a]Os)	119.8060	0.000	1	119.8060	0.000	1	119.7783	2.440	116	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:N-3:	C[6](N[6]C[6]Os)(C[6]C[6]H)(NN)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(NC[6a]Os)	C[6](N[6]C[6]Os)(C[6]C[6]H)(NN){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Br<1>,1|Os<9>,1|C<3>}	N(C[6]C[6]N[6])(NC[6a]Os)	120.5963	0.098	3	120.3440	0.358	19	119.7783	2.440	116	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:N-3:	C[6](N[6]C[6]Os)(C[6]C[6]H)(NN)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(NC[6a]Os)	C[6](N[6]C[6]Os)(C[6]C[6]H)(NN){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cl<1>,1|Os<9>,1|C<3>}	N(C[6]C[6]N[6])(NC[6a]Os)	119.9860	0.280	2	120.3440	0.358	19	119.7783	2.440	116	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:N-3:	C[6](N[6]C[6]Os)(C[6]C[6]H)(NN)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(NC[6a]Os)	C[6](N[6]C[6]Os)(C[6]C[6]H)(NN){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Os<6>,1|C<3>,1|H<1>}	N(C[6]C[6]N[6])(NC[6a]Os)	120.3573	0.763	10	120.3440	0.358	19	119.7783	2.440	116	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:N-3:	C[6](N[6]C[6]Os)(C[6]C[6]H)(NN)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(NC[6a]Os)	C[6](N[6]C[6]Os)(C[6]C[6]H)(NN){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Os<9>,1|C<3>,1|F<1>}	N(C[6]C[6]N[6])(NC[6a]Os)	120.7800	0.000	1	120.3440	0.358	19	119.7783	2.440	116	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:N-3:	C[6](N[6]C[6]Os)(C[6]C[6]H)(NN)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(NC[6a]Os)	C[6](N[6]C[6]Os)(C[6]C[6]H)(NN){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Os<9>,1|C<3>,1|H<1>}	N(C[6]C[6]N[6])(NC[6a]Os)	119.9310	0.270	2	120.3440	0.358	19	119.7783	2.440	116	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:N-3:	C[6](N[6]C[6]Os)(C[6]C[6]H)(NN)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(NC[6a]Os)	C[6](N[6]C[6]Os)(C[6]C[6]H)(NN){1|Cl<1>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Os<9>,1|C<3>,1|H<1>}	N(C[6]C[6]N[6])(NC[6a]Os)	120.5600	0.000	1	120.3440	0.358	19	119.7783	2.440	116	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:N-3:	C[6](N[6]C[6]Pd)(C[6]C[6]H)(NN)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(NC[6a]Pd)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(NN){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Pd<4>,1|C<3>,1|H<1>}	N(C[6]C[6]N[6])(NC[6a]Pd)	115.7250	0.000	1	118.6644	5.444	5	119.7783	2.440	116	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:N-3:	C[6](N[6]C[6]Pd)(C[6]C[6]H)(NN)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(NC[6a]Pd)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(NN){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Pd<4>,1|C<3>,1|H<1>}	N(C[6]C[6]N[6])(NC[6a]Pd)	120.3313	0.525	3	118.6644	5.444	5	119.7783	2.440	116	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:N-3:	C[6](N[6]C[6]Pd)(C[6]C[6]H)(NN)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(NC[6a]Pd)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(NN){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Pd<4>,1|C<3>,1|H<1>}	N(C[6]C[6]N[6])(NC[6a]Pd)	116.6030	0.000	1	118.6644	5.444	5	119.7783	2.440	116	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:N-3:	C[6](N[6]C[6]Pd)(C[6]C[6]H)(NN)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(NPdC)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(NN){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Pd<4>,1|C<3>,1|H<1>}	N(C[6]C[6]N[6])(NPdC)	120.2555	0.001	2	120.2555	0.000	2	119.7783	2.440	116	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:N-3:	C[6](N[6]C[6]Re)(C[6]C[6]H)(NN)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(NC[6a]Re)	C[6](N[6]C[6]Re)(C[6]C[6]H)(NN){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Re<6>,1|C<3>,1|H<1>}	N(C[6]C[6]N[6])(NC[6a]Re)	119.4527	1.467	3	119.4527	2.152	3	119.7783	2.440	116	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:N-3:	C[6](N[6]C[6]Re)(C[6]C[6]H)(NN)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(NReC)	C[6](N[6]C[6]Re)(C[6]C[6]H)(NN){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Re<6>,1|C<3>,1|H<1>}	N(C[6]C[6]N[6])(NReC)	119.8280	1.601	4	119.8280	2.563	4	119.7783	2.440	116	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:N-3:	C[6](N[6]C[6]Re)(C[6]C[6]H)(NN)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(NReH)	C[6](N[6]C[6]Re)(C[6]C[6]H)(NN){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Re<6>,1|C<2>,1|H<1>}	N(C[6]C[6]N[6])(NReH)	123.1190	0.000	1	121.1848	1.013	6	119.7783	2.440	116	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:N-3:	C[6](N[6]C[6]Re)(C[6]C[6]H)(NN)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(NReH)	C[6](N[6]C[6]Re)(C[6]C[6]H)(NN){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Re<6>,1|C<3>,1|H<1>}	N(C[6]C[6]N[6])(NReH)	120.7980	0.379	5	121.1848	1.013	6	119.7783	2.440	116	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:N-3:	C[6](N[6]C[6]Rh)(C[6]C[6]H)(NN)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(NC[6a]Rh)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(NN){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Rh<6>,1|C<3>,1|H<1>}	N(C[6]C[6]N[6])(NC[6a]Rh)	120.2063	1.056	3	119.6068	2.182	4	119.7783	2.440	116	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:N-3:	C[6](N[6]C[6]Rh)(C[6]C[6]H)(NN)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(NC[6a]Rh)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(NN){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Rh<8>,1|C<3>,1|H<1>}	N(C[6]C[6]N[6])(NC[6a]Rh)	117.8080	0.000	1	119.6068	2.182	4	119.7783	2.440	116	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:N-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NN)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(NC[6a]Ru)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NN){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<6>,1|C<3>,1|H<1>}	N(C[6]C[6]N[6])(NC[6a]Ru)	118.6435	1.044	2	119.1107	1.200	3	119.7783	2.440	116	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:N-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NN)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(NC[6a]Ru)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NN){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<9>,1|C<3>,1|H<1>}	N(C[6]C[6]N[6])(NC[6a]Ru)	120.0450	0.000	1	119.1107	1.200	3	119.7783	2.440	116	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:N-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NN)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(NRuC)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NN){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<9>,1|C<3>,1|H<1>}	N(C[6]C[6]N[6])(NRuC)	118.9870	0.000	1	118.9870	0.000	1	119.7783	2.440	116	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:N-3:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(NN)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(NC[6a]Zn)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(NN){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Zn<5>,1|C<3>,1|H<1>}	N(C[6]C[6]N[6])(NC[6a]Zn)	118.4860	0.000	1	118.4860	0.000	1	119.7783	2.440	116	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:N-3:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(NN)	C[6](C[6]N[6]N)2(H)	N(C[6]C[6]N[6])(NZnC)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(NN){1|C<3>,2|N<3>}	C[6](C[6]N[6]N)2(H){2|Zn<6>,1|C<3>}	N(C[6]C[6]N[6])(NZnC)	118.7580	0.000	1	118.7580	0.000	1	119.7783	2.440	116	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:	C[6](N[6]C[6]Mo)(C[6]C[6]H)(NC[6a])	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6a]C[6a]N[6a])(C[6]C[6]N[6])	C[6](N[6]C[6]Mo)(C[6]C[6]H)(NC[6a]){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Mo<6>,1|C<3>,1|H<1>}	N(C[6a]C[6a]N[6a])(C[6]C[6]N[6])	123.5350	0.600	2	123.5350	0.360	2	123.8657	0.508	3	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NC[6a])	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6a]C[6a]N[6a])(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NC[6a]){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<6>,1|C<3>,1|H<1>}	N(C[6a]C[6a]N[6a])(C[6]C[6]N[6])	124.5270	0.000	1	124.5270	0.000	1	123.8657	0.508	3	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:I-1:	C[6]-3:C-3:	C[6](N[6]C[6]Pd)(C[6]C[6]I)(NC)	C[6](C[6]N[6]C)(C[6]N[6]N)(I)	N(C[6]C[6]N[6])(CPdN)	C[6](N[6]C[6]Pd)(C[6]C[6]I)(NC){1|N<2>,2|C<4>}	C[6](C[6]N[6]C)(C[6]N[6]N)(I){1|Pd<4>,1|C<3>}	N(C[6]C[6]N[6])(CPdN)	121.4780	0.000	1	121.4780	0.000	1	121.4780	0.000	1	119.6698	20.244	432	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:4:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C-4:	C[6](C[6]C[6]H)(C[6]C[6]O)(NC)	C[6](C[6]C[6]C)(C[6]C[6]N)(H)	N(C[6]C[6]2)(CC3)	C[6](C[6]C[6]H)(C[6]C[6]O)(NC){1|C<3>,2|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<1>}	N(C[6]C[6]2)(CC3)	129.3755	0.353	2	129.3755	0.125	2	124.6700	13.374	7	124.6155	24.957	118	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:4:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C-4:	C[6](C[6]C[6]H)(C[6]C[6]O)(NC)	C[6](C[6]C[6]N)2(H)	N(C[6]C[6]2)(CCHH)	C[6](C[6]C[6]H)(C[6]C[6]O)(NC){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)2(H){1|C<3>,1|O<1>,1|O<2>}	N(C[6]C[6]2)(CCHH)	125.1100	0.000	1	124.2837	0.577	3	124.6700	13.374	7	124.6155	24.957	118	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:4:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C-4:	C[6](C[6]C[6]H)(C[6]C[6]O)(NC)	C[6](C[6]C[6]N)2(H)	N(C[6]C[6]2)(CCHH)	C[6](C[6]C[6]H)(C[6]C[6]O)(NC){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)2(H){1|C<3>,2|O<1>}	N(C[6]C[6]2)(CCHH)	123.8705	0.361	2	124.2837	0.577	3	124.6700	13.374	7	124.6155	24.957	118	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:4:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C-4:	C[6](C[6]C[6]H)2(NC)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	N(C[6]C[6]2)(CCHH)	C[6](C[6]C[6]H)2(NC){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|H<1>,2|C<3>}	N(C[6]C[6]2)(CCHH)	120.2380	0.000	1	120.2380	0.000	1	124.6700	13.374	7	124.6155	24.957	118	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:4:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C-4:	C[6](C[6]C[6]H)2(NC)	C[6](C[6]C[6]N)(C[6]C[6]O)(H)	N(C[6]C[6]2)(CCHH)	C[6](C[6]C[6]H)2(NC){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]N)(C[6]C[6]O)(H){1|H<1>,2|C<3>}	N(C[6]C[6]2)(CCHH)	120.8500	0.000	1	120.8500	0.000	1	124.6700	13.374	7	124.6155	24.957	118	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:4:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:S-4:	C[6](C[6]C[6]H)(C[6]C[6]O)(NS)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	N(C[6]C[6]2)(SCOO)	C[6](C[6]C[6]H)(C[6]C[6]O)(NS){1|N<3>,2|H<1>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	N(C[6]C[6]2)(SCOO)	128.3250	0.000	1	128.3250	0.000	1	121.9602	28.133	21	124.6155	24.957	118	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:4:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:S-4:	C[6](C[6]C[6]H)2(NS)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	N(C[6]C[6]2)(SCOO)	C[6](C[6]C[6]H)2(NS){1|N<3>,2|H<1>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	N(C[6]C[6]2)(SCOO)	121.5100	8.012	2	121.5100	64.184	2	121.9602	28.133	21	124.6155	24.957	118	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:4:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:S-4:	C[6](C[6]C[6]H)2(NS)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	N(C[6]C[6]2)(SC[6a]OO)	C[6](C[6]C[6]H)2(NS){1|N<3>,2|H<1>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	N(C[6]C[6]2)(SC[6a]OO)	121.6566	5.179	18	121.6566	26.817	18	121.9602	28.133	21	124.6155	24.957	118	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:4:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:O-1:	C[6]-3:C-4:	C[6](C[6]C[6]H)(C[6]C[6]O)(NC)	C[6](C[6]C[6]C)(C[6]C[6]N)(O)	N(C[6]C[6]2)(CC3)	C[6](C[6]C[6]H)(C[6]C[6]O)(NC){1|C<3>,2|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]N)(O){1|C<3>,2|H<1>}	N(C[6]C[6]2)(CC3)	113.6765	0.248	2	113.6765	0.062	2	114.0812	0.491	5	124.6155	24.957	118	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:4:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:O-1:	C[6]-3:C-4:	C[6](C[6]C[6]H)(C[6]C[6]O)(NC)	C[6](C[6]C[6]H)(C[6]C[6]N)(O)	N(C[6]C[6]2)(CCHH)	C[6](C[6]C[6]H)(C[6]C[6]O)(NC){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(O){1|C<3>,1|H<1>,1|O<1>}	N(C[6]C[6]2)(CCHH)	114.8175	0.227	2	114.3510	0.679	3	114.0812	0.491	5	124.6155	24.957	118	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:4:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:O-1:	C[6]-3:C-4:	C[6](C[6]C[6]H)(C[6]C[6]O)(NC)	C[6](C[6]C[6]H)(C[6]C[6]N)(O)	N(C[6]C[6]2)(CCHH)	C[6](C[6]C[6]H)(C[6]C[6]O)(NC){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(O){1|C<3>,1|H<1>,1|O<2>}	N(C[6]C[6]2)(CCHH)	113.4180	0.000	1	114.3510	0.679	3	114.0812	0.491	5	124.6155	24.957	118	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:4:	C[6]-3:N[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C-4:	C[6](C[6]C[6]H)(N[6]C[6]C)(NC)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(CCHH)	C[6](C[6]C[6]H)(N[6]C[6]C)(NC){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,1|C<4>,1|H<1>}	N(C[6]C[6]N[6])(CCHH)	127.8690	0.000	1	127.8690	0.000	1	127.2095	0.870	2	124.6155	24.957	118	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:4:	C[6]-3:N[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C-4:	C[6](C[6]C[6]H)(N[6]C[6]O)(NC)	C[6](C[6]C[6]N)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(CCHH)	C[6](C[6]C[6]H)(N[6]C[6]O)(NC){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]N)(H){1|C<3>,1|C<4>,1|O<1>}	N(C[6]C[6]N[6])(CCHH)	126.5500	0.000	1	126.5500	0.000	1	127.2095	0.870	2	124.6155	24.957	118	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:4:	C[6]-3:N[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:P-4:	C[6](C[6]C[6]H)(N[6]C[6]H)(NP)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(PC[6a]2P)	C[6](C[6]C[6]H)(N[6]C[6]H)(NP){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,2|H<1>}	N(C[6]C[6]N[6])(PC[6a]2P)	128.7550	0.000	1	128.7550	0.000	1	128.7550	0.000	1	124.6155	24.957	118	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:4:	C[6]-3:N[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:P[6]-4:	C[6](C[6]C[6]H)(N[6]C[6]H)(NP[6])	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(P[6]N[6]2Cl)	C[6](C[6]C[6]H)(N[6]C[6]H)(NP[6]){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,2|H<1>}	N(C[6]C[6]N[6])(P[6]N[6]2Cl)	128.0020	0.000	1	128.0020	0.000	1	128.0020	0.000	1	124.6155	24.957	118	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:4:	C[6]-3:N[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:S-4:	C[6](C[6]C[6]H)(N[6]C[6]C)(NS)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(SC[6a]OO)	C[6](C[6]C[6]H)(N[6]C[6]C)(NS){1|C<4>,3|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,3|C<4>}	N(C[6]C[6]N[6])(SC[6a]OO)	126.1245	0.394	2	126.1245	0.155	2	129.4785	4.258	41	124.6155	24.957	118	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:4:	C[6]-3:N[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:S-4:	C[6](C[6]C[6]H)(N[6]C[6]H)(NS)	C[6](C[6]C[6]C)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(SC[6a]OO)	C[6](C[6]C[6]H)(N[6]C[6]H)(NS){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]N)(H){1|C<3>,2|H<1>}	N(C[6]C[6]N[6])(SC[6a]OO)	130.2900	0.191	2	130.2900	0.036	2	129.4785	4.258	41	124.6155	24.957	118	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:4:	C[6]-3:N[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:S-4:	C[6](C[6]C[6]H)(N[6]C[6]H)(NS)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(SC[6a]OO)	C[6](C[6]C[6]H)(N[6]C[6]H)(NS){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,2|H<1>}	N(C[6]C[6]N[6])(SC[6a]OO)	130.2460	3.452	3	129.6033	4.154	36	129.4785	4.258	41	124.6155	24.957	118	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:4:	C[6]-3:N[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:S-4:	C[6](C[6]C[6]H)(N[6]C[6]H)(NS)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(SC[6a]OO)	C[6](C[6]C[6]H)(N[6]C[6]H)(NS){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,2|H<1>}	N(C[6]C[6]N[6])(SC[6a]OO)	130.8690	0.823	2	129.6033	4.154	36	129.4785	4.258	41	124.6155	24.957	118	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:4:	C[6]-3:N[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:S-4:	C[6](C[6]C[6]H)(N[6]C[6]H)(NS)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(SC[6a]OO)	C[6](C[6]C[6]H)(N[6]C[6]H)(NS){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,2|H<1>}	N(C[6]C[6]N[6])(SC[6a]OO)	130.0898	0.613	8	129.6033	4.154	36	129.4785	4.258	41	124.6155	24.957	118	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:4:	C[6]-3:N[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:S-4:	C[6](C[6]C[6]H)(N[6]C[6]H)(NS)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(SC[6a]OO)	C[6](C[6]C[6]H)(N[6]C[6]H)(NS){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,1|C<4>,1|H<1>}	N(C[6]C[6]N[6])(SC[6a]OO)	129.4919	0.771	7	129.6033	4.154	36	129.4785	4.258	41	124.6155	24.957	118	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:4:	C[6]-3:N[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:S-4:	C[6](C[6]C[6]H)(N[6]C[6]H)(NS)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(SC[6a]OO)	C[6](C[6]C[6]H)(N[6]C[6]H)(NS){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,1|H<1>,1|I<1>}	N(C[6]C[6]N[6])(SC[6a]OO)	129.1474	0.674	5	129.6033	4.154	36	129.4785	4.258	41	124.6155	24.957	118	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:4:	C[6]-3:N[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:S-4:	C[6](C[6]C[6]H)(N[6]C[6]H)(NS)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(SC[6a]OO)	C[6](C[6]C[6]H)(N[6]C[6]H)(NS){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,2|H<1>}	N(C[6]C[6]N[6])(SC[6a]OO)	129.1224	3.207	11	129.6033	4.154	36	129.4785	4.258	41	124.6155	24.957	118	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:4:	C[6]-3:N[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:S-4:	C[6](C[6]C[6]H)(N[6]C[6]S)(NS)	C[6](C[6]C[6]C)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(SC[6a]OO)	C[6](C[6]C[6]H)(N[6]C[6]S)(NS){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]N)(H){1|C<3>,1|H<1>,1|S<4>}	N(C[6]C[6]N[6])(SC[6a]OO)	130.0710	0.000	1	130.0710	0.000	1	129.4785	4.258	41	124.6155	24.957	118	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:4:	C[6]-3:N[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:Si-4:	C[6](C[6]C[6]H)(N[6]C[6]B)(NSi)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(SiC3)	C[6](C[6]C[6]H)(N[6]C[6]B)(NSi){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|B<4>,1|C<3>,1|H<1>}	N(C[6]C[6]N[6])(SiC3)	121.3730	0.197	2	121.3730	0.039	2	121.3730	0.039	2	124.6155	24.957	118	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:4:	N[6]-3:C[6]-3:N-2:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:S-4:	C[6](N[6]C[6a]C[6])(C[6]C[6,6a]H)(NS)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(SC[6a]OO)	C[6](N[6]C[6a]C[6])(C[6]C[6,6a]H)(NS){1|H<1>,1|N<2>,3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]N)(H){1|H<1>,4|C<3>}	N(C[6]C[6]N[6])(SC[6a]OO)	129.5460	0.000	1	129.5460	0.000	1	129.5460	0.000	1	124.6155	24.957	118	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:4:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C-4:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(NC)	C[6](C[6]C[6]C)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(CC3)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(NC){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]N)(H){1|Cu<4>,1|C<3>,1|H<1>}	N(C[6]C[6]N[6])(CC3)	124.2450	0.000	1	124.2450	0.000	1	122.5162	1.074	13	124.6155	24.957	118	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:4:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C-4:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(NC)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(CCHH)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(NC){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cu<5>,1|C<3>,1|H<1>}	N(C[6]C[6]N[6])(CCHH)	122.4275	0.657	4	122.4275	0.431	4	122.5162	1.074	13	124.6155	24.957	118	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:4:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C-4:	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NC)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(CCHH)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NC){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Fe<5>,1|C<3>,1|H<1>}	N(C[6]C[6]N[6])(CCHH)	120.7830	0.000	1	120.7830	0.000	1	122.5162	1.074	13	124.6155	24.957	118	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:4:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C-4:	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NC)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(CC[6a]HH)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NC){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<6>,1|C<3>,1|H<1>}	N(C[6]C[6]N[6])(CC[6a]HH)	121.4560	0.000	1	121.4560	0.000	1	122.5162	1.074	13	124.6155	24.957	118	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:4:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C-4:	C[6](N[6]C[6]Rh)(C[6]C[6]H)(NC)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(CCHH)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(NC){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Rh<5>,1|C<3>,1|H<1>}	N(C[6]C[6]N[6])(CCHH)	122.3443	0.355	3	122.3443	0.126	3	122.5162	1.074	13	124.6155	24.957	118	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:4:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C-4:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(NC)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(CCHH)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(NC){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Zn<5>,1|C<3>,1|H<1>}	N(C[6]C[6]N[6])(CCHH)	123.1613	1.194	3	123.1613	1.426	3	122.5162	1.074	13	124.6155	24.957	118	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:4:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:P-4:	C[6](N[6]C[6,6a]Ru)(C[6]C[6]H)(NP)	C[6](C[6]C[6,6a]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(PRuCC)	C[6](N[6]C[6,6a]Ru)(C[6]C[6]H)(NP){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]N)(H){1|Ru<6>,2|C<3>}	N(C[6]C[6]N[6])(PRuCC)	123.4810	0.000	1	123.4810	0.000	1	121.3643	1.788	21	124.6155	24.957	118	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:4:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:P-4:	C[6](N[6]C[6]Cr)(C[6]C[6]H)(NP)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(PCrCC)	C[6](N[6]C[6]Cr)(C[6]C[6]H)(NP){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cr<6>,1|C<3>,1|H<1>}	N(C[6]C[6]N[6])(PCrCC)	120.4570	0.008	2	120.8037	0.361	3	121.3643	1.788	21	124.6155	24.957	118	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:4:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:P-4:	C[6](N[6]C[6]Cr)(C[6]C[6]H)(NP)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(PCrCC)	C[6](N[6]C[6]Cr)(C[6]C[6]H)(NP){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cr<6>,1|C<3>,1|H<1>}	N(C[6]C[6]N[6])(PCrCC)	121.4970	0.000	1	120.8037	0.361	3	121.3643	1.788	21	124.6155	24.957	118	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:4:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:P-4:	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NP)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(PCCS)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NP){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Fe<4>,1|C<3>,1|H<1>}	N(C[6]C[6]N[6])(PCCS)	118.7050	0.000	1	118.7050	0.000	1	121.3643	1.788	21	124.6155	24.957	118	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:4:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:P-4:	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NP)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(PFeCC)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NP){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Fe<6>,1|C<3>,1|H<1>}	N(C[6]C[6]N[6])(PFeCC)	120.8875	2.478	2	120.8875	6.143	2	121.3643	1.788	21	124.6155	24.957	118	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:4:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:P-4:	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NP)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(PC[5]2Ni)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NP){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<4>,1|C<3>,1|H<1>}	N(C[6]C[6]N[6])(PC[5]2Ni)	121.7900	0.000	1	121.7900	0.000	1	121.3643	1.788	21	124.6155	24.957	118	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:4:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:P-4:	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NP)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(PNiCC)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NP){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<4>,1|C<3>,1|H<1>}	N(C[6]C[6]N[6])(PNiCC)	122.3160	0.000	1	122.6893	0.151	4	121.3643	1.788	21	124.6155	24.957	118	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:4:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:P-4:	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NP)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(PNiCC)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NP){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<4>,1|C<3>,1|H<1>}	N(C[6]C[6]N[6])(PNiCC)	122.8137	0.366	3	122.6893	0.151	4	121.3643	1.788	21	124.6155	24.957	118	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:4:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:P-4:	C[6](N[6]C[6]Pd)(C[6]C[6]H)(NP)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(PC[6a]2Pd)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(NP){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Pd<4>,1|C<3>,1|H<1>}	N(C[6]C[6]N[6])(PC[6a]2Pd)	121.9580	0.000	1	121.9580	0.000	1	121.3643	1.788	21	124.6155	24.957	118	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:4:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:P-4:	C[6](N[6]C[6]Pt)(C[6]C[6]H)(NP)	C[6](C[6]C[6]C)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(PC[6a]2Pt)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(NP){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]N)(H){1|Pt<4>,1|C<3>,1|H<1>}	N(C[6]C[6]N[6])(PC[6a]2Pt)	120.4560	0.000	1	120.4560	0.000	1	121.3643	1.788	21	124.6155	24.957	118	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:4:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:P-4:	C[6](N[6]C[6]Rh)(C[6]C[6]H)(NP)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(PRhCC)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(NP){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Rh<4>,1|C<3>,1|H<1>}	N(C[6]C[6]N[6])(PRhCC)	121.3730	0.000	1	121.3730	0.000	1	121.3643	1.788	21	124.6155	24.957	118	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:4:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:P-4:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NP)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(PC[6a]2Ru)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NP){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<6>,1|C<3>,1|H<1>}	N(C[6]C[6]N[6])(PC[6a]2Ru)	121.6415	0.576	2	121.6415	0.332	2	121.3643	1.788	21	124.6155	24.957	118	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:4:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:P-4:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NP)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(PRuCC)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NP){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<8>,1|C<3>,1|H<1>}	N(C[6]C[6]N[6])(PRuCC)	121.6460	0.076	2	121.6460	0.006	2	121.3643	1.788	21	124.6155	24.957	118	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:4:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:P-4:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(NP)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(PNOO)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(NP){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Zn<6>,1|C<3>,1|H<1>}	N(C[6]C[6]N[6])(PNOO)	119.6845	0.909	2	119.6845	0.826	2	121.3643	1.788	21	124.6155	24.957	118	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:4:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:Si-4:	C[6](N[6]C[6]Al)(C[6]C[6]H)(NSi)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(SiC3)	C[6](N[6]C[6]Al)(C[6]C[6]H)(NSi){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Al<5>,1|C<4>,1|H<1>}	N(C[6]C[6]N[6])(SiC3)	122.1590	0.000	1	122.3070	0.019	3	122.3070	0.019	3	124.6155	24.957	118	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	3:4:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:Si-4:	C[6](N[6]C[6]Al)(C[6]C[6]H)(NSi)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	N(C[6]C[6]N[6])(SiC3)	C[6](N[6]C[6]Al)(C[6]C[6]H)(NSi){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Al<7>,1|C<4>,1|H<1>}	N(C[6]C[6]N[6])(SiC3)	122.3810	0.068	2	122.3070	0.019	3	122.3070	0.019	3	124.6155	24.957	118	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	4:3:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:F-1:	C[6]-4:C[6]-3:	C[6](C[6]C[6]F)(C[6]C[6]O)(NC[6])	C[6](C[6]C[6]N)(C[6]C[6]O)(F)	N(C[6]C[6]2H)(C[6]C[6]2)	C[6](C[6]C[6]F)(C[6]C[6]O)(NC[6]){1|C<3>,1|F<1>,1|O<1>}	C[6](C[6]C[6]N)(C[6]C[6]O)(F){1|C<3>,1|N<3>,1|O<1>}	N(C[6]C[6]2H)(C[6]C[6]2)	129.2900	0.000	1	129.2900	0.000	1	129.2900	0.000	1	122.2848	59.070	4	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	4:3:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C-4:C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]S)(NC)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	N(CC[5]C[6]H)(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]S)(NC){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|O<1>,1|S<2>}	N(CC[5]C[6]H)(C[6]C[6]2)	127.6270	0.000	1	127.6270	0.000	1	127.6270	0.000	1	122.2848	59.070	4	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	4:3:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(NC[6])	C[6](C[6]C[6]C)(C[6]C[6]N)(H)	N(C[6]C[6]2H)(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(NC[6]){1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]N)(H){1|C<3>,1|C<4>,2|H<1>}	N(C[6]C[6]2H)(C[6]C[6]2)	119.5290	0.000	1	119.5290	0.000	1	119.5290	0.000	1	122.2848	59.070	4	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:1:	4:3:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:O-1:	C[6]-4:C[6]-3:	C[6](C[6]C[6]F)(C[6]C[6]O)(NC[6])	C[6](C[6]C[6]F)(C[6]C[6]N)(O)	N(C[6]C[6]2H)(C[6]C[6]2)	C[6](C[6]C[6]F)(C[6]C[6]O)(NC[6]){1|C<3>,1|F<1>,1|O<1>}	C[6](C[6]C[6]F)(C[6]C[6]N)(O){1|C<3>,1|F<1>,1|N<3>}	N(C[6]C[6]2H)(C[6]C[6]2)	112.6930	0.000	1	112.6930	0.000	1	112.6930	0.000	1	122.2848	59.070	4	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:2:	3:1:	C[6]-3:N[6]-3:N-2:	C[6]-3:C[6]-3:C-2:	C[6]-3:H-1:	C[6](C[6]C[6]C)(N[6]C[6]C)(NH)	C[6](C[6]C[6]C)(C[6]N[6]N)(CN)	N(C[6]C[6]N[6])(H)	C[6](C[6]C[6]C)(N[6]C[6]C)(NH){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]N)(CN){1|C<3>,1|C<4>,1|H<1>}	N(C[6]C[6]N[6])(H)	128.7460	0.000	1	128.7460	0.000	1	127.6283	0.703	6	126.6075	5.783	12	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:2:	3:1:	C[6]-3:N[6]-3:N-2:	C[6]-3:C[6]-3:C-2:	C[6]-3:H-1:	C[6](C[6]C[6]C)(N[6]C[6]C)(NH)	C[6](C[6]C[6a]C[6])(C[6]N[6]N)(CN)	N(C[6]C[6]N[6])(H)	C[6](C[6]C[6]C)(N[6]C[6]C)(NH){1|C<4>,2|C<3>}	C[6](C[6]C[6a]C[6])(C[6]N[6]N)(CN){2|C<4>,3|C<3>}	N(C[6]C[6]N[6])(H)	127.0918	0.134	4	127.4048	0.504	5	127.6283	0.703	6	126.6075	5.783	12	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:2:	3:1:	C[6]-3:N[6]-3:N-2:	C[6]-3:C[6]-3:C-2:	C[6]-3:H-1:	C[6](C[6]C[6]C)(N[6]C[6]C)(NH)	C[6](C[6]C[6a]C[6])(C[6]N[6]N)(CN)	N(C[6]C[6]N[6])(H)	C[6](C[6]C[6]C)(N[6]C[6]C)(NH){1|H<1>,2|C<3>}	C[6](C[6]C[6a]C[6])(C[6]N[6]N)(CN){1|C<4>,4|C<3>}	N(C[6]C[6]N[6])(H)	128.6570	0.000	1	127.4048	0.504	5	127.6283	0.703	6	126.6075	5.783	12	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:2:	3:1:	N[5,6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:C-2:	C[6]-3:H-1:	C[6](N[5,6]C[5,6a]C[5,6])(C[6]C[6]C)(NH)	C[6](C[6]N[5,6]N)(C[6]C[6]C)(CN)	N(C[6]N[5,6]C[6])(H)	C[6](N[5,6]C[5,6a]C[5,6])(C[6]C[6]C)(NH){1|C<2>,1|C<4>,3|C<3>}	C[6](C[6]N[5,6]N)(C[6]C[6]C)(CN){1|H<1>,2|C<3>}	N(C[6]N[5,6]C[6])(H)	127.4270	0.000	1	127.4270	0.000	1	127.4270	0.000	1	126.6075	5.783	12	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:2:	3:1:	N[6,6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:C-2:	C[6]-3:H-1:	C[6](N[6,6]C[5,6,6]C[6,6a])(C[6]C[6]C)(NH)	C[6](C[6]C[5,6]C[6a])(C[6]N[6,6]N)(CN)	N(C[6]N[6,6]C[6])(H)	C[6](N[6,6]C[5,6,6]C[6,6a])(C[6]C[6]C)(NH){5|C<3>}	C[6](C[6]C[5,6]C[6a])(C[6]N[6,6]N)(CN){5|C<3>}	N(C[6]N[6,6]C[6])(H)	126.3767	0.538	3	126.3767	0.289	3	126.6668	0.529	4	126.6075	5.783	12	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:2:	3:1:	N[6,6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:C-2:	C[6]-3:H-1:	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]C)(NH)	C[6](C[6]C[6a]C[6])(C[6]N[6,6]N)(CN)	N(C[6]N[6,6]C[6])(H)	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]C)(NH){1|C<4>,2|H<1>,3|C<3>}	C[6](C[6]C[6a]C[6])(C[6]N[6,6]N)(CN){1|C<2>,1|C<4>,3|C<3>}	N(C[6]N[6,6]C[6])(H)	127.5370	0.000	1	127.5370	0.000	1	126.6668	0.529	4	126.6075	5.783	12	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:2:	3:1:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:C-2:	C[6]-3:H-1:	C[6](N[6]C[6a]C[6])(C[6]C[6]C)(NH)	C[6](C[6]C[5,6]C)(C[6]N[6]N)(CN)	N(C[6]C[6]N[6])(H)	C[6](N[6]C[6a]C[6])(C[6]C[6]C)(NH){1|O<1>,2|C<3>,2|C<4>}	C[6](C[6]C[5,6]C)(C[6]N[6]N)(CN){2|C<3>,2|C<4>}	N(C[6]C[6]N[6])(H)	119.4260	0.000	1	119.4260	0.000	1	119.4260	0.000	1	126.6075	5.783	12	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:2:	3:2:	C[6,6a]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:O-2:	C[6]-3:O-2:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]O)(NO)	C[6](C[6]C[6,6a]N)(C[6]C[6]Cl)(OH)	N(C[6]C[6,6a]C[6])(OH)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]O)(NO){1|Cl<1>,1|H<1>,3|C<3>}	C[6](C[6]C[6,6a]N)(C[6]C[6]Cl)(OH){1|O<1>,2|C<3>}	N(C[6]C[6,6a]C[6])(OH)	108.8290	1.171	2	108.8290	1.371	2	109.1293	0.956	3	112.3602	14.780	6	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:2:	3:2:	C[6,6a]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:O-2:	C[6]-3:O-2:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]O)(NO)	C[6](C[6]C[6,6a]N)(C[6]C[6]I)(OH)	N(C[6]C[6,6a]C[6])(OH)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]O)(NO){1|H<1>,1|I<1>,3|C<3>}	C[6](C[6]C[6,6a]N)(C[6]C[6]I)(OH){1|O<1>,2|C<3>}	N(C[6]C[6,6a]C[6])(OH)	109.7300	0.000	1	109.7300	0.000	1	109.1293	0.956	3	112.3602	14.780	6	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:2:	3:2:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:O-2:	C[6]-3:O-2:	C[6](C[6]C[6]O)2(NO)	C[6](C[6]C[6]N)2(OBa)	N(C[6]C[6]2)(OH)	C[6](C[6]C[6]O)2(NO){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]N)2(OBa){1|C<3>,2|O<1>}	N(C[6]C[6]2)(OH)	113.5960	0.000	1	113.5960	0.000	1	113.5960	0.000	1	112.3602	14.780	6	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:2:	3:2:	C[6]-3:C[6]-3:N-2:	C[6a]-3:C[6]-3:O[6]-2:	C[6]-3:N-2:	C[6](C[6]C[6a]O[6])(C[6]N[6]C)(NN)	C[6](C[6a]C[6a]2)(C[6]C[6]N)(O[6]B[6])	N(C[6]C[6]2)(NC[6a])	C[6](C[6]C[6a]O[6])(C[6]N[6]C)(NN){1|B<4>,1|C<4>,2|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]N)(O[6]B[6]){1|C<4>,1|N<3>,2|H<1>,4|C<3>}	N(C[6]C[6]2)(NC[6a])	115.2870	0.000	1	115.2870	0.000	1	115.2870	0.000	1	112.3602	14.780	6	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:2:	3:2:	N[6]-3:C[6]-3:N-2:	N[6]-3:C[6]-3:N-2:	C[6]-3:O-2:	C[6](N[6]C[6,6a]H)(C[6]N[6]N)(NO)	C[6](N[6]C[6,6a]H)(C[6]N[6]N)(NO)	N(C[6]C[6]N[6])(OH)	C[6](N[6]C[6,6a]H)(C[6]N[6]N)(NO){1|H<1>,2|C<3>}	C[6](N[6]C[6,6a]H)(C[6]N[6]N)(NO){1|H<1>,2|C<3>}	N(C[6]C[6]N[6])(OH)	117.8900	0.000	1	117.8900	0.000	1	117.8900	0.000	1	112.3602	14.780	6	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:2:	3:4:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:O-2:	C[6]-3:S-4:	C[6](C[6]C[6]H)(C[6]C[6]O)(NS)	C[6](C[6]C[6]N)(C[6]N[6]H)(OC[6a])	N(C[6]C[6]2)(SCOO)	C[6](C[6]C[6]H)(C[6]C[6]O)(NS){1|N<3>,2|H<1>}	C[6](C[6]C[6]N)(C[6]N[6]H)(OC[6a]){1|C<3>,2|H<1>}	N(C[6]C[6]2)(SCOO)	117.2460	0.000	1	117.2460	0.000	1	117.2460	0.000	1	117.2460	0.000	1	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:2:	4:3:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:S-2:	C-4:C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]S)(NC)	C[6](C[6]C[6]H)(C[6]C[6]N)(SC)	N(CC[5]C[6]H)(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]S)(NC){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]C[6]N)(SC){1|C<3>,1|H<1>,1|O<1>}	N(CC[5]C[6]H)(C[6]C[6]2)	115.7300	0.000	1	115.7300	0.000	1	115.7300	0.000	1	115.7300	0.000	1	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:3:	3:1:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:N-3:	C[6]-3:H-1:	C[6](C[6]C[6]N)(C[6]N[6]H)(NH)	C[6](C[6]C[6]H)(C[6]C[6]N)(NHH)	N(C[6]C[6]2)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(NH){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]C[6]N)(NHH){1|N<3>,2|H<1>}	N(C[6]C[6]2)(H)	121.3330	0.000	1	121.3330	0.000	1	121.3330	0.000	1	122.9900	8.884	3	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:3:	3:1:	C[6]-3:C[6]-3:N-2:	N[6]-3:C[6]-3:N-3:	C[6]-3:O-1:	C[6](C[6]N[6]N)(C[6]N[6]O)(NO)	C[6](N[6]C[6]Sr)(C[6]C[6]N)(NHH)	N(C[6]C[6]2)(O)	C[6](C[6]N[6]N)(C[6]N[6]O)(NO){1|Sr<10>,2|C<4>}	C[6](N[6]C[6]Sr)(C[6]C[6]N)(NHH){1|N<3>,1|O<1>,1|O<2>}	N(C[6]C[6]2)(O)	126.4310	0.000	1	126.4310	0.000	1	126.4310	0.000	1	122.9900	8.884	3	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:3:	3:1:	C[6]-3:N[6]-3:N-2:	C[6]-3:C[6]-3:N-3:	C[6]-3:H-1:	C[6](C[6]C[6]N)(N[6]C[6]O)(NH)	C[6](C[6]N[6]C)(C[6]N[6]N)(NHH)	N(C[6]C[6]N[6])(H)	C[6](C[6]C[6]N)(N[6]C[6]O)(NH){1|C<2>,1|H<1>,1|N<2>}	C[6](C[6]N[6]C)(C[6]N[6]N)(NHH){1|C<3>,1|O<2>}	N(C[6]C[6]N[6])(H)	121.2060	0.000	1	121.2060	0.000	1	121.2060	0.000	1	122.9900	8.884	3	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:3:	3:2:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:N-3:	C[6]-3:O-2:	C[6](C[6]C[6]H)(C[6]C[6]N)(NO)	C[6](C[6]C[6]H)(C[6]C[6]N)(NCH)	N(C[6]C[6]2)(OH)	C[6](C[6]C[6]H)(C[6]C[6]N)(NO){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]C[6]N)(NCH){1|C<3>,1|H<1>,1|O<1>}	N(C[6]C[6]2)(OH)	116.0790	0.000	1	116.0790	0.000	1	116.0790	0.000	1	122.6378	29.337	6	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:3:	3:2:	C[6]-3:C[6]-3:N-2:	C[6]-3:N[6]-3:N-3:	C[6]-3:N-2:	C[6](C[6]C[6]H)(C[6]N[6]N)(NN)	C[6](C[6]C[6]N)(N[6]C[6]H)(NHH)	N(C[6]C[6]2)(NC[6a])	C[6](C[6]C[6]H)(C[6]N[6]N)(NN){1|C<3>,2|H<1>}	C[6](C[6]C[6]N)(N[6]C[6]H)(NHH){1|C<3>,1|H<1>,1|N<3>}	N(C[6]C[6]2)(NC[6a])	123.9496	4.875	5	123.9496	23.765	5	123.9496	23.765	5	122.6378	29.337	6	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:3:	3:3:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:C-3:	C[6a]-3:C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(NC[6a])	C[6](C[6]C[6]H)(C[6]C[6]N)(CCH)	N(C[6a]C[6a]2)(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(NC[6a]){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]C[6]N)(CCH){1|C<3>,1|H<1>,1|O<1>}	N(C[6a]C[6a]2)(C[6]C[6]2)	130.5700	0.000	1	130.5700	0.000	1	121.5782	26.106	5	121.7932	35.019	11	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:3:	3:3:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:C-3:	C[6a]-3:C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(NC[6a])	C[6](C[6]C[6]N)2(CCO)	N(C[6a]C[6a]2)(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(NC[6a]){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)2(CCO){1|C<3>,1|H<1>,1|O<1>}	N(C[6a]C[6a]2)(C[6]C[6]2)	120.8260	0.000	1	120.8260	0.000	1	121.5782	26.106	5	121.7932	35.019	11	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:3:	3:3:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:C-3:	C[6a]-3:C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(NC[6a])	C[6](C[6]C[6]N)2(CC[6a]O)	N(C[6a]C[6a]2)(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(NC[6a]){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)2(CC[6a]O){1|C<3>,1|H<1>,1|O<1>}	N(C[6a]C[6a]2)(C[6]C[6]2)	118.9770	0.000	1	118.9770	0.000	1	121.5782	26.106	5	121.7932	35.019	11	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:3:	3:3:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:C-3:	C[6a]-3:C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(NC[6a])	C[6](C[6]C[6]N)2(CHO)	N(C[6a]C[6a]2)(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(NC[6a]){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)2(CHO){1|C<3>,1|H<1>,1|O<1>}	N(C[6a]C[6a]2)(C[6]C[6]2)	118.7590	0.585	2	118.7590	0.343	2	121.5782	26.106	5	121.7932	35.019	11	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:3:	3:3:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:N-3:	C[6a]-3:C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(NC[6a])	C[6](C[6]C[6]H)(C[6]C[6]N)(NC[6a]H)	N(C[6a]C[6a]2)(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(NC[6a]){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(NC[6a]H){1|C<3>,1|H<1>,1|O<1>}	N(C[6a]C[6a]2)(C[6]C[6]2)	114.7910	0.000	1	114.7910	0.000	1	115.1865	0.313	2	121.7932	35.019	11	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:3:	3:3:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:N-3:	C[6a]-3:C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(NC[6a])	C[6](C[6]C[6]H)(C[6]C[6]N)(NHH)	N(C[6a]C[6a]2)(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(NC[6a]){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6]N)(NHH){1|C<3>,1|H<1>,1|O<1>}	N(C[6a]C[6a]2)(C[6]C[6]2)	115.5820	0.000	1	115.5820	0.000	1	115.1865	0.313	2	121.7932	35.019	11	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:3:	3:3:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:P-3:	C[6]-3:C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(NC[6])	C[6](C[6]C[6]H)(C[6]C[6]N)(PCC)	N(C[6]C[6]2)2	C[6](C[6]C[6]H)(C[6]C[6]P)(NC[6]){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]C[6]N)(PCC){1|H<1>,2|C<3>}	N(C[6]C[6]2)2	121.2935	0.136	2	121.2935	0.019	2	121.2935	0.019	2	121.7932	35.019	11	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:3:	3:3:	C[6]-3:C[6]-3:N-2:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:C-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(NC)	C[6](C[6]C[6]N[6])(N[6]C[6]Zn)(C[6]C[6]N)	N(C[6]C[6]2)(CC[6a]N)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(NC){1|Zn<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Zn)(C[6]C[6]N){1|N<3>,2|H<1>,3|C<3>}	N(C[6]C[6]2)(CC[6a]N)	124.9340	0.000	1	124.9340	0.000	1	124.9340	0.000	1	121.7932	35.019	11	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:3:	3:3:	N[6,6a]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:C-3:	C[6]-3:C[6a]-3:	C[6](N[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(NC[6a])	C[6](C[6]N[6,6a]N)(C[6]N[6]H)(CCO)	N(C[6]N[6,6a]C[6])(C[6a]C[6a]2)	C[6](N[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(NC[6a]){1|N<2>,2|C<3>,2|H<1>}	C[6](C[6]N[6,6a]N)(C[6]N[6]H)(CCO){2|C<3>}	N(C[6]N[6,6a]C[6])(C[6a]C[6a]2)	133.9400	0.000	1	133.9400	0.000	1	133.9400	0.000	1	121.7932	35.019	11	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:3:	3:4:	C[6]-3:N[6]-3:N-2:	C[6]-3:C[6a]-3:C[6]-3:	C[6]-3:C-4:	C[6](C[6]C[6a]C[6])(N[6]C[6,6a]C)(NC)	C[6](C[6]C[6,6a]C[6a])(C[6a]C[6a]2)(C[6]N[6]N)	N(C[6]C[6]N[6])(CCCH)	C[6](C[6]C[6a]C[6])(N[6]C[6,6a]C)(NC){5|C<3>}	C[6](C[6]C[6,6a]C[6a])(C[6a]C[6a]2)(C[6]N[6]N){1|C<4>,2|H<1>,6|C<3>}	N(C[6]C[6]N[6])(CCCH)	130.3790	0.000	1	130.3790	0.000	1	130.3790	0.000	1	124.3293	46.831	4	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:3:	3:4:	C[6]-3:N[6]-3:N-2:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:S-4:	C[6](C[6]C[6a]C[6])(N[6]C[6,6]H)(NS)	C[6](C[6a]C[6a]2)(C[6]N[6]H)(C[6]N[6]N)	N(C[6]C[6]N[6])(SC[6a]OO)	C[6](C[6]C[6a]C[6])(N[6]C[6,6]H)(NS){1|H<1>,1|N<3>,2|C<3>,2|C<4>}	C[6](C[6a]C[6a]2)(C[6]N[6]H)(C[6]N[6]N){2|C<3>,2|C<4>,3|H<1>}	N(C[6]C[6]N[6])(SC[6a]OO)	119.4170	0.000	1	119.4170	0.000	1	124.7335	56.530	2	124.3293	46.831	4	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:3:	3:4:	C[6]-3:N[6]-3:N-2:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:S-4:	C[6](C[6]C[6a]C[6])(N[6]C[6a]C[6])(NS)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]N)	N(C[6]C[6]N[6])(SC[6a]OO)	C[6](C[6]C[6a]C[6])(N[6]C[6a]C[6])(NS){1|H<1>,1|N<3>,5|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]N){1|C<2>,2|H<1>,4|C<3>}	N(C[6]C[6]N[6])(SC[6a]OO)	130.0500	0.000	1	130.0500	0.000	1	124.7335	56.530	2	124.3293	46.831	4	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:3:	3:4:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:C-3:	C[6]-3:S-4:	C[6](N[6]C[6,6a]H)(C[6]C[6]C)(NS)	C[6](C[6]C[6,6a]C)(C[6]N[6]N)(COO)	N(C[6]C[6]N[6])(SC[6a]OO)	C[6](N[6]C[6,6a]H)(C[6]C[6]C)(NS){1|C<4>,2|C<3>}	C[6](C[6]C[6,6a]C)(C[6]N[6]N)(COO){1|H<1>,2|C<3>}	N(C[6]C[6]N[6])(SC[6a]OO)	117.4710	0.000	1	117.4710	0.000	1	117.4710	0.000	1	124.3293	46.831	4	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:4:	3:1:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:C-4:	C[6]-3:O-1:	C[6](C[6]C[6]C)(C[6]C[6]H)(NO)	C[6](C[6]C[6]H)(C[6]C[6]N)(CC[6a]HH)	N(C[6]C[6]2)(O)	C[6](C[6]C[6]C)(C[6]C[6]H)(NO){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6]N)(CC[6a]HH){1|C<3>,1|H<1>,1|O<1>}	N(C[6]C[6]2)(O)	115.7880	0.000	1	115.7880	0.000	1	115.7880	0.000	1	115.7880	0.000	1	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:4:	3:2:	C[6]-3:C[6]-3:N-2:	C[6,6]-3:C[6]-3:C-4:	C[6]-3:O-2:	C[6](C[6]C[6,6]C)(C[6]C[6]H)(NO)	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6]N)(CC[6a]HH)	N(C[6]C[6]2)(OC)	C[6](C[6]C[6,6]C)(C[6]C[6]H)(NO){1|H<1>,2|C<4>}	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6]N)(CC[6a]HH){1|C<3>,1|O<2>,2|H<1>,3|C<4>}	N(C[6]C[6]2)(OC)	116.4980	0.137	2	116.4980	0.019	2	116.4980	0.019	2	117.5270	19.835	7	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:4:	3:2:	C[6]-3:C[6]-3:N-2:	C[6]-3:N[6]-3:C-4:	C[6]-3:N-2:	C[6](C[6]C[6a]O[6])(C[6]N[6]C)(NN)	C[6](C[6]C[6]N)(N[6]B[6]C)(CH3)	N(C[6]C[6]2)(NC[6a])	C[6](C[6]C[6a]O[6])(C[6]N[6]C)(NN){1|B<4>,1|C<4>,2|C<3>}	C[6](C[6]C[6]N)(N[6]B[6]C)(CH3){1|O<2>,3|C<3>}	N(C[6]C[6]2)(NC[6a])	127.3050	0.000	1	127.3050	0.000	1	119.4413	46.381	3	117.5270	19.835	7	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:4:	3:2:	C[6]-3:C[6]-3:N-2:	C[6]-3:N[6]-3:C-4:	C[6]-3:N-2:	C[6](C[6]N[6]C)(C[6]O[6]C)(NN)	C[6](C[6]C[6]N)(N[6]B[6]C)(CH3)	N(C[6]C[6]2)(NC[6a])	C[6](C[6]N[6]C)(C[6]O[6]C)(NN){1|B<4>,1|C<4>}	C[6](C[6]C[6]N)(N[6]B[6]C)(CH3){1|C<4>,1|O<2>,2|C<3>}	N(C[6]C[6]2)(NC[6a])	115.5095	0.081	2	115.5095	0.007	2	119.4413	46.381	3	117.5270	19.835	7	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:4:	3:2:	C[6]-3:C[6]-3:N-2:	N[6]-3:C[6]-3:C-4:	C[6]-3:N-2:	C[6](C[6]N[6]C)(C[6]O[6]C)(NN)	C[6](N[6]C[6a]B[6])(C[6]C[6]N)(CH3)	N(C[6]C[6]2)(NC[6a])	C[6](C[6]N[6]C)(C[6]O[6]C)(NN){1|B<4>,1|C<3>}	C[6](N[6]C[6a]B[6])(C[6]C[6]N)(CH3){1|C<4>,1|O<2>,4|C<3>}	N(C[6]C[6]2)(NC[6a])	113.9060	0.000	1	113.9060	0.000	1	113.9060	0.000	1	117.5270	19.835	7	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:4:	3:2:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:C-4:	C[6]-3:N-2:	C[6](N[6]C[6,6a]O)(C[6]C[6]C)(NN)	C[6](C[6]C[6,6a]H)(C[6]N[6]N)(CH3)	N(C[6]C[6]N[6])(NN)	C[6](N[6]C[6,6a]O)(C[6]C[6]C)(NN){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]N)(CH3){1|O<1>,2|C<3>}	N(C[6]C[6]N[6])(NN)	117.4630	0.000	1	117.4630	0.000	1	117.4630	0.000	1	117.5270	19.835	7	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:4:	3:3:	C[6]-3:C[6]-3:N-2:	C[6,6]-3:C[6]-3:C-4:	C[6]-3:N-3:	C[6](C[6]C[6,6]C)(C[6]C[6]H)(NN)	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6]N)(CH3)	N(C[6]C[6]2)(NC[6a]H)	C[6](C[6]C[6,6]C)(C[6]C[6]H)(NN){1|H<1>,2|C<4>}	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6]N)(CH3){1|C<3>,1|O<2>,2|H<1>,3|C<4>}	N(C[6]C[6]2)(NC[6a]H)	117.1220	0.000	1	117.1220	0.000	1	117.1220	0.000	1	117.0599	2.367	18	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:4:	3:3:	C[6]-3:C[6]-3:N-2:	C[6,6]-3:C[6]-3:C-4:	C[6a]-3:C[6]-3:	C[6](C[6]C[6,6]C)(C[6]C[6]H)(NC[6a])	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6]N)(CH3)	N(C[6a]C[6a]2)(C[6]C[6]2)	C[6](C[6]C[6,6]C)(C[6]C[6]H)(NC[6a]){1|H<1>,2|C<4>}	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6]N)(CH3){1|C<3>,1|O<2>,2|H<1>,3|C<4>}	N(C[6a]C[6a]2)(C[6]C[6]2)	117.6500	0.000	1	117.6500	0.000	1	117.6500	0.000	1	117.0599	2.367	18	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:4:	3:3:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:C-4:	C[6]-3:C-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(NC)	C[6](C[6]C[6]H)(C[6]C[6]N)(CCHH)	N(C[6]C[6]2)(CCH)	C[6](C[6]C[6]C)(C[6]C[6]H)(NC){1|C<2>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6]N)(CCHH){1|C<3>,1|H<1>}	N(C[6]C[6]2)(CCH)	118.9150	0.000	1	118.9150	0.000	1	119.0393	5.134	4	117.0599	2.367	18	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:4:	3:3:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:C-4:	C[6]-3:C-3:	C[6](C[6]C[6]C)2(NC)	C[6](C[6]C[6]H)(C[6]C[6]N)(CCCH)	N(C[6]C[6]2)(CC[6]H)	C[6](C[6]C[6]C)2(NC){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6]N)(CCCH){1|C<2>,2|C<4>}	N(C[6]C[6]2)(CC[6]H)	117.7900	0.000	1	117.7900	0.000	1	119.0393	5.134	4	117.0599	2.367	18	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:4:	3:3:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:C-4:	C[6]-3:C-3:	C[6](C[6]C[6]C)2(NC)	C[6](C[6]C[6]H)(C[6]C[6]N)(CH3)	N(C[6]C[6]2)(CCH)	C[6](C[6]C[6]C)2(NC){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]C[6]N)(CH3){1|C<4>,2|C<3>}	N(C[6]C[6]2)(CCH)	119.7260	3.589	2	119.7260	12.883	2	119.0393	5.134	4	117.0599	2.367	18	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:4:	3:3:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:C-4:	C[6]-3:N-3:	C[6](C[6]C[6]C)(C[6]N[6]O)(NN)	C[6](C[6]C[6]C)(C[6]C[6]N)(CH3)	N(C[6]C[6]2)(NC[6a]H)	C[6](C[6]C[6]C)(C[6]N[6]O)(NN){1|C<2>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]N)(CH3){1|N<3>,2|O<1>}	N(C[6]C[6]2)(NC[6a]H)	116.1792	0.334	10	116.1792	0.112	10	116.1792	0.112	10	117.0599	2.367	18	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:4:	3:3:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:C-4:	C[6]-3:C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]C)(NC[6])	C[6](C[6]C[6]H)(C[6]N[6]N)(CH3)	N(C[6]C[6]N[6])2	C[6](N[6]C[6]Cu)(C[6]C[6]C)(NC[6]){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(CH3){1|Cu<3>,1|C<3>,1|H<1>}	N(C[6]C[6]N[6])2	117.1785	0.158	2	117.1785	0.025	2	117.1785	0.025	2	117.0599	2.367	18	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:4:	3:4:	C[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:C-4:	C[6]-3:Si-4:	C[6](C[6]C[6]C)2(NSi)	C[6](C[6]C[6]H)(C[6]C[6]N)(CC3)	N(C[6]C[6]2)(SiC3)	C[6](C[6]C[6]C)2(NSi){1|C<4>,2|H<1>}	C[6](C[6]C[6]H)(C[6]C[6]N)(CC3){1|C<3>,3|C<4>}	N(C[6]C[6]2)(SiC3)	122.8340	1.178	2	122.8340	1.388	2	122.8340	1.388	2	119.2247	3.182	20	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:4:	3:4:	C[6]-3:N[6]-3:N-2:	C[6]-3:C[6]-3:C-4:	C[6]-3:S-4:	C[6](C[6]C[6]C)(N[6]C[6]H)(NS)	C[6](C[6]C[6]H)(C[6]N[6]N)(CH3)	N(C[6]C[6]N[6])(SC[6a]OO)	C[6](C[6]C[6]C)(N[6]C[6]H)(NS){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(CH3){1|C<3>,2|H<1>}	N(C[6]C[6]N[6])(SC[6a]OO)	118.8897	0.133	3	118.8897	0.018	3	118.8897	0.018	3	119.2247	3.182	20	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:4:	3:4:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:C-4:	C[6]-3:P-4:	C[6](N[6]C[6]Ni)(C[6]C[6]C)(NP)	C[6](C[6]C[6]H)(C[6]N[6]N)(CCCH)	N(C[6]C[6]N[6])(PNiCC)	C[6](N[6]C[6]Ni)(C[6]C[6]C)(NP){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(CCCH){1|Ni<4>,1|C<3>,2|C<4>}	N(C[6]C[6]N[6])(PNiCC)	121.4790	0.000	1	121.4790	0.000	1	118.8105	2.148	15	119.2247	3.182	20	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:4:	3:4:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:C-4:	C[6]-3:P-4:	C[6](N[6]C[6]Ni)(C[6]C[6]C)(NP)	C[6](C[6]C[6]H)(C[6]N[6]N)(CCHH)	N(C[6]C[6]N[6])(PNiCC)	C[6](N[6]C[6]Ni)(C[6]C[6]C)(NP){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]N)(CCHH){1|Ni<4>,1|C<3>,1|C<4>}	N(C[6]C[6]N[6])(PNiCC)	117.1205	0.467	2	118.4665	1.513	13	118.8105	2.148	15	119.2247	3.182	20	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:4:	3:4:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:C-4:	C[6]-3:P-4:	C[6](N[6]C[6]Ni)(C[6]C[6]C)(NP)	C[6](C[6]C[6]H)(C[6]N[6]N)(CCHH)	N(C[6]C[6]N[6])(PNiCC)	C[6](N[6]C[6]Ni)(C[6]C[6]C)(NP){1|C<4>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]N)(CCHH){1|Ni<4>,1|C<3>,2|C<4>}	N(C[6]C[6]N[6])(PNiCC)	118.2390	0.572	9	118.4665	1.513	13	118.8105	2.148	15	119.2247	3.182	20	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:4:	3:4:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:C-4:	C[6]-3:P-4:	C[6](N[6]C[6]Ni)(C[6]C[6]C)(NP)	C[6](C[6]C[6]H)(C[6]N[6]N)(CCHH)	N(C[6]C[6]N[6])(PNiCC)	C[6](N[6]C[6]Ni)(C[6]C[6]C)(NP){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(CCHH){1|Ni<4>,1|C<3>,2|C<4>}	N(C[6]C[6]N[6])(PNiCC)	120.8365	0.052	2	118.4665	1.513	13	118.8105	2.148	15	119.2247	3.182	20	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:3:4:	3:4:	N[6]-3:C[6]-3:N-2:	C[6]-3:C[6]-3:C-4:	C[6]-3:P-4:	C[6](N[6]C[6]Ni)(C[6]C[6]C)(NP)	C[6](C[6]C[6]H)(C[6]N[6]N)(CH3)	N(C[6]C[6]N[6])(PNiCC)	C[6](N[6]C[6]Ni)(C[6]C[6]C)(NP){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(CH3){1|Ni<4>,1|C<3>,2|C<4>}	N(C[6]C[6]N[6])(PNiCC)	120.6130	0.000	1	120.6130	0.000	1	118.8105	2.148	15	119.2247	3.182	20	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	3:4:3:	3:1:	N[5,6]-3:C[6]-3:N-2:	C[6]-3:C[6]-4:N-3:	C[6]-3:H-1:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]N)(NH)	C[6](C[6]N[5,6]N)(C[6]C[6]CC)(NOO)	N(C[6]N[5,6]C[6])(H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]N)(NH){1|N<3>,2|H<1>,5|C<4>}	C[6](C[6]N[5,6]N)(C[6]C[6]CC)(NOO){2|C<4>,2|H<1>}	N(C[6]N[5,6]C[6])(H)	122.6430	0.000	1	122.6430	0.000	1	122.6430	0.000	1	122.6430	0.000	1	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	4:3:1:	3:1:	C[6]-3:C[6]-3:N-2:	C[6]-4:C[6]-3:O-1:	C[6]-3:O-1:	C[6](C[6]C[6]N)(C[6]C[6]O)(NO)	C[6](C[6]C[6]HH)(C[6]C[6]N)(O)	N(C[6]C[6]2)(O)	C[6](C[6]C[6]N)(C[6]C[6]O)(NO){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]N)(O){1|N<3>,3|C<4>}	N(C[6]C[6]2)(O)	113.9450	0.000	1	113.9450	0.000	1	113.9450	0.000	1	113.9450	0.000	1	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	4:3:1:	3:2:	C[6]-3:C[6]-3:N-2:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:N-2:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(NN)	C[6](C[6,6]C[6,6]C[6]Cr)(C[6]C[6]N)(H)	N(C[6]C[6]2)(NC[6a])	C[6](C[6]C[6,6]H)(C[6]C[6]H)(NN){1|Cr<9>,1|H<1>,2|C<4>}	C[6](C[6,6]C[6,6]C[6]Cr)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<2>,2|C<4>}	N(C[6]C[6]2)(NC[6a])	114.7470	0.000	1	114.7470	0.000	1	116.9370	9.592	2	116.9370	9.592	2	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	4:3:1:	3:2:	C[6]-3:C[6]-3:N-2:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:N-2:	C[6](C[6]C[6,6]H)(C[6]C[6]O)(NN)	C[6](C[6,6]C[6,6]2N)(C[6]C[6]N)(H)	N(C[6]C[6]2)(NN)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(NN){1|C<3>,1|C<4>,2|N<2>}	C[6](C[6,6]C[6,6]2N)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<1>,3|C<4>}	N(C[6]C[6]2)(NN)	119.1270	0.000	1	119.1270	0.000	1	116.9370	9.592	2	116.9370	9.592	2	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	4:3:1:	3:3:	C[6]-3:C[6]-3:N-2:	C[6]-4:C[6]-3:O-1:	C[6]-3:N-3:	C[6](C[6]C[6]O)2(NN)	C[6](C[6]C[6]HH)(C[6]C[6]N)(O)	N(C[6]C[6]2)(NC[6a]Cu)	C[6](C[6]C[6]O)2(NN){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]N)(O){1|O<2>,3|C<4>}	N(C[6]C[6]2)(NC[6a]Cu)	113.1160	0.000	1	113.1160	0.000	1	119.1908	28.253	13	119.1908	28.253	13	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	4:3:1:	3:3:	C[6]-3:C[6]-3:N-2:	C[6]-4:C[6]-3:O-1:	C[6]-3:N-3:	C[6](C[6]C[6]O)2(NN)	C[6](C[6]C[6]HH)(C[6]C[6]N)(O)	N(C[6]C[6]2)(NC[6a]H)	C[6](C[6]C[6]O)2(NN){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]N)(O){1|O<1>,3|C<4>}	N(C[6]C[6]2)(NC[6a]H)	119.6970	5.214	12	119.6970	27.187	12	119.1908	28.253	13	119.1908	28.253	13	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	4:3:2:	3:3:	C[6]-3:C[6]-3:N-2:	C[6]-4:C[6]-3:O-2:	C[6]-3:N-3:	C[6](C[6]C[6]O)2(NN)	C[6](C[6]C[6]HH)(C[6]C[6]N)(OCu)	N(C[6]C[6]2)(NC[6a]Cu)	C[6](C[6]C[6]O)2(NN){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]N)(OCu){1|O<1>,3|C<4>}	N(C[6]C[6]2)(NC[6a]Cu)	127.2300	0.000	1	127.2300	0.000	1	127.2300	0.000	1	127.2300	0.000	1	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	4:3:3:	3:1:	C[6]-3:C[6]-3:N-2:	C[6]-4:C[6]-3:N-3:	C[6]-3:O-1:	C[6](C[6]C[6]N)(C[6]C[6]O)(NO)	C[6](C[6]C[6]HH)(C[6]C[6]N)(NC[6a]H)	N(C[6]C[6]2)(O)	C[6](C[6]C[6]N)(C[6]C[6]O)(NO){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]N)(NC[6a]H){1|O<1>,3|C<4>}	N(C[6]C[6]2)(O)	125.8150	0.000	1	125.8150	0.000	1	125.8150	0.000	1	125.8150	0.000	1	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:3:2:	4:3:3:	4:3:	C[6]-3:C[6]-3:N-2:	C[6]-4:C[6]-3:C-3:	C[6]-4:C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(NC[6])	C[6](C[6]C[6a]C[6]H)(C[6]C[6]N)(COO)	N(C[6]C[6]2H)(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(NC[6]){1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[6a]C[6]H)(C[6]C[6]N)(COO){3|C<3>,3|H<1>}	N(C[6]C[6]2H)(C[6]C[6]2)	121.9390	0.000	1	121.9390	0.000	1	121.9390	0.000	1	121.9390	0.000	1	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:4:2:	3:3:1:	3:2:	C[6]-3:C[6]-4:N-2:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:N-2:	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(NN)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]N)(H)	N(C[6]C[6]2)(NC[6])	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(NN){2|C<4>,2|H<1>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]N)(H){4|C<4>,4|H<1>}	N(C[6]C[6]2)(NC[6])	117.4470	0.284	2	117.4470	0.081	2	117.4470	0.081	2	120.0817	20.865	3	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:4:2:	3:3:1:	3:2:	C[6]-3:C[6]-4:N-2:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:O-2:	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(NO)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]N)(H)	N(C[6]C[6]2)(OC)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(NO){2|C<4>,2|H<1>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]N)(H){4|C<4>,4|H<1>}	N(C[6]C[6]2)(OC)	125.3510	0.000	1	125.3510	0.000	1	125.3510	0.000	1	120.0817	20.865	3	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:4:2:	3:3:1:	3:3:	C[6]-3:C[6]-4:N-2:	C[6,6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(NC[6a])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]N)(H)	N(C[6a]C[6a]2)(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(NC[6a]){1|C<3>,1|C<4>,2|H<1>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]N)(H){1|O<1>,2|H<1>,4|C<4>}	N(C[6a]C[6a]2)(C[6]C[6]2)	115.8350	0.762	2	115.8350	0.581	2	115.8350	0.581	2	115.8350	0.581	2	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:4:2:	3:3:3:	3:2:	C[6]-3:C[6]-4:N-2:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:O-2:	C[6](C[6]C[6a]C[6])(C[6]C[6]HH)(NO)	C[6](C[6a]C[6a]2)(C[6]C[6]C)(C[6]C[6]N)	N(C[6]C[6]2)(OH)	C[6](C[6]C[6a]C[6])(C[6]C[6]HH)(NO){1|C<4>,2|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]C)(C[6]C[6]N){1|C<4>,2|C<3>,6|H<1>}	N(C[6]C[6]2)(OH)	116.4900	0.000	1	116.4900	0.000	1	116.4900	0.000	1	116.4900	0.000	1	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:4:2:	3:3:4:	3:2:	C[6]-3:C[6]-4:N-2:	C[6,6]-3:C[6]-3:C-4:	C[6]-3:O-2:	C[6](C[6]C[6,6]C)(C[6]C[6]HH)(NO)	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6]N)(CHHN)	N(C[6]C[6]2)(OC)	C[6](C[6]C[6,6]C)(C[6]C[6]HH)(NO){2|C<4>,2|H<1>}	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6]N)(CHHN){1|O<2>,3|H<1>,4|C<4>}	N(C[6]C[6]2)(OC)	115.6380	0.000	1	115.6380	0.000	1	115.6380	0.000	1	115.6380	0.000	1	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	3:4:2:	4:3:3:	3:2:	C[6]-3:C[6]-4:N-2:	C[6,6]-4:C[6a]-3:C[6]-3:	C[6]-3:N-2:	C[6](C[6]C[6,6]C[6a])(C[6]O[6]HH)(NN)	C[6](C[6,6]C[6,6]C[6]H)(C[6a]C[6a]2)(C[6]C[6]N)	N(C[6]C[6]2)(NN)	C[6](C[6]C[6,6]C[6a])(C[6]O[6]HH)(NN){1|H<1>,2|C<3>,2|C<4>}	C[6](C[6,6]C[6,6]C[6]H)(C[6a]C[6a]2)(C[6]C[6]N){1|C<4>,2|O<2>,4|C<3>,5|H<1>}	N(C[6]C[6]2)(NN)	120.4610	0.000	1	120.4610	0.000	1	120.4610	0.000	1	120.4610	0.000	1	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	4:3:2:	2:3:2:	4:3:	C[6]-4:C[6]-3:N-2:	O[6]-2:C[6]-3:N-2:	C[6]-4:C[6]-3:	C[6](C[6]C[5,6]CC)(C[6]O[6]N)(NC[6])	C[6](O[6]C[5,6])(C[6]C[6]N)(NC[6])	N(C[6]C[6]2H)(C[6]C[6]2)	C[6](C[6]C[5,6]CC)(C[6]O[6]N)(NC[6]){2|C<3>}	C[6](O[6]C[5,6])(C[6]C[6]N)(NC[6]){2|C<3>,2|C<4>}	N(C[6]C[6]2H)(C[6]C[6]2)	124.0940	0.000	1	124.0940	0.000	1	124.0940	0.000	1	124.0940	0.000	1	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	4:3:2:	3:2:3:	3:2:	C[6]-4:C[6]-3:N-2:	C[6]-3:O[6]-2:C-3:	C[6]-3:O-2:	C[6](C[6]C[6]HH)(C[6]O[6]C)(NO)	C[6](C[6]C[6]N)(O[6]C[6])(CC[6a]2)	N(C[6]C[6]2)(OH)	C[6](C[6]C[6]HH)(C[6]O[6]C)(NO){1|C<4>,2|H<1>}	C[6](C[6]C[6]N)(O[6]C[6])(CC[6a]2){1|C<4>,4|H<1>}	N(C[6]C[6]2)(OH)	117.6112	0.270	4	117.6112	0.073	4	117.6112	0.073	4	117.6112	0.073	4	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	4:3:2:	3:3:1:	3:2:	C[6]-4:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:O-2:	C[6](C[6]C[6]HH)(C[6]C[6]H)(NO)	C[6](C[6]C[5,6]H)(C[6]C[6]N)(H)	N(C[6]C[6]2)(OH)	C[6](C[6]C[6]HH)(C[6]C[6]H)(NO){1|C<4>,1|S<2>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]N)(H){1|C<4>,2|C<3>,2|H<1>}	N(C[6]C[6]2)(OH)	117.1020	0.000	1	117.1020	0.000	1	117.1020	0.000	1	116.1150	1.948	2	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	4:3:2:	3:3:1:	3:2:	C[6]-4:C[6]-3:N-2:	C[6]-3:N[6]-3:H-1:	C[6]-3:N-2:	C[6](C[6]C[6]HH)(C[6]N[6]H)(NN)	C[6](C[6]C[6]N)(N[6]C[6]C)(H)	N(C[6]C[6]2)(NC[6a])	C[6](C[6]C[6]HH)(C[6]N[6]H)(NN){2|C<4>,2|H<1>}	C[6](C[6]C[6]N)(N[6]C[6]C)(H){1|C<4>,4|H<1>}	N(C[6]C[6]2)(NC[6a])	115.1280	0.000	1	115.1280	0.000	1	115.1280	0.000	1	116.1150	1.948	2	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	4:3:2:	3:3:1:	3:3:	C[4,6]-4:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:N-3:	C[6](C[4,6]C[4]2O[6])(C[6]C[6]H)(NN)	C[6](C[6]C[4,6]N)(C[6]C[5,6]H)(H)	N(C[6]C[4,6]C[6])(NC[6a]H)	C[6](C[4,6]C[4]2O[6])(C[6]C[6]H)(NN){2|C<4>,5|H<1>}	C[6](C[6]C[4,6]N)(C[6]C[5,6]H)(H){2|O<2>,3|C<4>}	N(C[6]C[4,6]C[6])(NC[6a]H)	127.0735	0.070	2	127.0735	0.005	2	127.0735	0.005	2	120.7859	21.087	22	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	4:3:2:	3:3:1:	3:3:	C[5,6]-4:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C-3:	C[6](C[5,6]C[5]2C[6])(C[6]C[6]H)(NC)	C[6](C[6]C[5,6]N)(C[6]C[6]H)(H)	N(C[6]C[5,6]C[6])(CNO)	C[6](C[5,6]C[5]2C[6])(C[6]C[6]H)(NC){2|H<1>,5|C<3>}	C[6](C[6]C[5,6]N)(C[6]C[6]H)(H){1|H<1>,3|C<3>}	N(C[6]C[5,6]C[6])(CNO)	125.3020	0.544	2	125.3020	0.296	2	124.9907	0.439	3	120.7859	21.087	22	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	4:3:2:	3:3:1:	3:3:	C[5,6]-4:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:C-3:	C[6](C[5,6]C[6,6a]C[5]2)(C[6]C[6]H)(NC)	C[6](C[6]C[6,6a]H)(C[6]C[5,6]N)(H)	N(C[6]C[5,6]C[6])(CNO)	C[6](C[5,6]C[6,6a]C[5]2)(C[6]C[6]H)(NC){1|H<1>,6|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[5,6]N)(H){4|C<3>}	N(C[6]C[5,6]C[6])(CNO)	124.3680	0.000	1	124.3680	0.000	1	124.9907	0.439	3	120.7859	21.087	22	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	4:3:2:	3:3:1:	3:3:	C[6]-4:C[6]-3:N-2:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:N[5]-3:	C[6](C[6]C[5,6]HH)(C[6]C[5,6]H)(NN[5])	C[6](C[5,6]C[5,5,6]N[5])(C[6]C[6]N)(H)	N(C[6]C[6]2)(N[5]C[5]2)	C[6](C[6]C[5,6]HH)(C[6]C[5,6]H)(NN[5]){1|C<4>,1|H<1>,2|N<3>}	C[6](C[5,6]C[5,5,6]N[5])(C[6]C[6]N)(H){1|C<3>,1|S<4>,2|H<1>,3|C<4>}	N(C[6]C[6]2)(N[5]C[5]2)	115.5240	0.832	2	115.5240	0.691	2	115.5240	0.691	2	120.7859	21.087	22	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	4:3:2:	3:3:1:	3:3:	C[6]-4:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[5]-3:C[6]-3:	C[6](C[6]C[6]FeH)(C[6]C[6]H)(NC[5])	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	N(C[5]C[5,6a]N[5])(C[6]C[6]2)	C[6](C[6]C[6]FeH)(C[6]C[6]H)(NC[5]){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|Fe<5>,1|C<3>,2|H<1>}	N(C[5]C[5,6a]N[5])(C[6]C[6]2)	119.6610	0.000	1	119.6610	0.000	1	119.6610	0.000	1	120.7859	21.087	22	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	4:3:2:	3:3:1:	3:3:	C[6]-4:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:	C[6](C[6]C[6]CoH)(C[6]C[6]H)(NC[5a])	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	N(C[5a]C[5a,6a]N[5a])(C[6]C[6]2)	C[6](C[6]C[6]CoH)(C[6]C[6]H)(NC[5a]){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|Co<5>,1|C<3>,2|H<1>}	N(C[5a]C[5a,6a]N[5a])(C[6]C[6]2)	119.5542	0.523	4	119.5542	0.273	4	118.4635	3.411	8	120.7859	21.087	22	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	4:3:2:	3:3:1:	3:3:	C[6]-4:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:	C[6](C[6]C[6]FeH)(C[6]C[6]H)(NC[5a])	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	N(C[5a]C[5a,6a]N[5a])(C[6]C[6]2)	C[6](C[6]C[6]FeH)(C[6]C[6]H)(NC[5a]){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|Fe<5>,1|C<3>,2|H<1>}	N(C[5a]C[5a,6a]N[5a])(C[6]C[6]2)	119.1405	0.404	2	119.1405	0.163	2	118.4635	3.411	8	120.7859	21.087	22	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	4:3:2:	3:3:1:	3:3:	C[6]-4:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:	C[6](C[6]C[6]LiH)(C[6]C[6]H)(NC[5a])	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	N(C[5a]C[5a,6a]N[5a])(C[6]C[6]2)	C[6](C[6]C[6]LiH)(C[6]C[6]H)(NC[5a]){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|Li<5>,1|C<3>,2|H<1>}	N(C[5a]C[5a,6a]N[5a])(C[6]C[6]2)	115.6050	0.936	2	115.6050	0.876	2	118.4635	3.411	8	120.7859	21.087	22	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	4:3:2:	3:3:1:	3:3:	C[6]-4:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:N-3:	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(NN)	C[6](C[6]C[6,6]H)(C[6]C[6]N)(H)	N(C[6]C[6]2)(NCH)	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(NN){2|C<4>,2|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]N)(H){2|H<1>,3|C<4>}	N(C[6]C[6]2)(NCH)	116.1150	0.000	1	116.1150	0.000	1	121.6257	36.250	6	120.7859	21.087	22	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	4:3:2:	3:3:1:	3:3:	C[6]-4:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:N-3:	C[6](C[6]C[6]CC)(C[6]C[6]H)(NN)	C[6](C[6]C[6]C)(C[6]C[6]N)(H)	N(C[6]C[6]2)(NCH)	C[6](C[6]C[6]CC)(C[6]C[6]H)(NN){2|C<4>,2|H<1>}	C[6](C[6]C[6]C)(C[6]C[6]N)(H){1|C<3>,2|C<4>,2|H<1>}	N(C[6]C[6]2)(NCH)	126.7195	0.853	2	126.7195	0.728	2	121.6257	36.250	6	120.7859	21.087	22	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	4:3:2:	3:3:1:	3:3:	C[6]-4:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:N-3:	C[6](C[6]C[6]CH)(C[6]C[6]H)(NN)	C[6](C[6]C[6]C)(C[6]C[6]N)(H)	N(C[6]C[6]2)(NC[6a]H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(NN){1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]N)(H){1|C<4>,2|C<3>,2|H<1>}	N(C[6]C[6]2)(NC[6a]H)	127.8530	0.000	1	127.8530	0.000	1	121.6257	36.250	6	120.7859	21.087	22	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	4:3:2:	3:3:1:	3:3:	C[6]-4:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:N-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(NN)	C[6](C[6]C[6]C)(C[6]C[6]N)(H)	N(C[6]C[6]2)(NCH)	C[6](C[6]C[6]HH)(C[6]C[6]H)(NN){2|C<4>,2|H<1>}	C[6](C[6]C[6]C)(C[6]C[6]N)(H){2|H<1>,3|C<4>}	N(C[6]C[6]2)(NCH)	116.0580	0.000	1	116.0580	0.000	1	121.6257	36.250	6	120.7859	21.087	22	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	4:3:2:	3:3:1:	3:3:	C[6]-4:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:N-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(NN)	C[6](C[6]C[6a]N[6])(C[6]C[6]N)(H)	N(C[6]C[6]2)(NC[6a]H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(NN){1|N<3>,3|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]N)(H){1|C<4>,2|H<1>,3|C<3>}	N(C[6]C[6]2)(NC[6a]H)	116.2890	0.000	1	116.2890	0.000	1	121.6257	36.250	6	120.7859	21.087	22	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	4:3:2:	3:3:1:	3:4:	C[3,6]-4:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[6]-3:S-4:	C[6](C[3,6]C[3,6]C[3]H)(C[6]C[6]H)(NS)	C[6](C[6]C[3,6]N)(C[6]C[6]H)(H)	N(C[6]C[3,6]C[6])(SC[6a]OO)	C[6](C[3,6]C[3,6]C[3]H)(C[6]C[6]H)(NS){2|H<1>,3|C<3>}	C[6](C[6]C[3,6]N)(C[6]C[6]H)(H){1|H<1>,1|N<2>,2|C<4>}	N(C[6]C[3,6]C[6])(SC[6a]OO)	114.8930	0.035	2	114.8930	0.001	2	114.8930	0.001	2	114.8930	0.001	2	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	4:3:2:	3:3:1:	4:3:	C[6]-4:C[6]-3:N-2:	C[6]-3:C[6]-3:H-1:	C[5]-4:C[6]-3:	C[6](C[6]C[6]FeH)(C[6]C[6]H)(NC[5])	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	N(C[5]C[5,6a]N[5]H)(C[6]C[6]2)	C[6](C[6]C[6]FeH)(C[6]C[6]H)(NC[5]){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|Fe<5>,1|C<3>,2|H<1>}	N(C[5]C[5,6a]N[5]H)(C[6]C[6]2)	120.8620	0.000	1	120.8620	0.000	1	120.8620	0.000	1	120.8620	0.000	1	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	4:3:2:	3:3:2:	3:1:	C[5,6]-4:C[6]-3:N-2:	C[6,6]-3:C[6]-3:C-2:	C[6]-3:H-1:	C[6](C[5,6]C[5,6a]C[5]C[6])(C[6]C[6,6]C)(NH)	C[6](C[6,6]C[6,6a]C[6,6])(C[6]C[5,6]N)(CN)	N(C[6]C[5,6]C[6])(H)	C[6](C[5,6]C[5,6a]C[5]C[6])(C[6]C[6,6]C)(NH){1|C<4>,1|H<1>,1|N<3>,1|O<1>,4|C<3>}	C[6](C[6,6]C[6,6a]C[6,6])(C[6]C[5,6]N)(CN){1|H<1>,2|C<4>,4|C<3>}	N(C[6]C[5,6]C[6])(H)	124.6980	2.827	7	124.6980	7.992	7	124.6980	7.992	7	125.1564	8.531	8	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	4:3:2:	3:3:2:	3:1:	C[6]-4:C[6]-3:N-2:	C[6]-3:C[6]-3:C-2:	C[6]-3:H-1:	C[6](C[6]C[6]CC)(C[6]C[6]C)(NH)	C[6](C[6]C[6]C)(C[6]C[6]N)(CN)	N(C[6]C[6]2)(H)	C[6](C[6]C[6]CC)(C[6]C[6]C)(NH){1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]N)(CN){1|C<3>,1|C<4>,1|H<1>,2|C<2>}	N(C[6]C[6]2)(H)	128.3650	0.000	1	128.3650	0.000	1	128.3650	0.000	1	125.1564	8.531	8	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	4:3:2:	3:3:3:	3:2:	C[6]-4:C[6]-3:N-2:	C[6]-3:C[6]-3:C-3:	C[6]-3:O-2:	C[6](C[6]C[6]HH)(C[6]C[6]C)(NO)	C[6](C[6]C[6]N)(C[6]C[6]O)(CC[6a]O)	N(C[6]C[6]2)(OC)	C[6](C[6]C[6]HH)(C[6]C[6]C)(NO){1|C<4>,1|O<2>,2|H<1>}	C[6](C[6]C[6]N)(C[6]C[6]O)(CC[6a]O){1|C<4>,4|H<1>}	N(C[6]C[6]2)(OC)	116.8370	0.000	1	116.8370	0.000	1	116.8370	0.000	1	116.8370	0.000	1	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	4:3:2:	3:3:3:	3:3:	C[6]-4:C[6]-3:N-2:	C[6]-3:C[6]-3:N-3:	C[6]-3:N-3:	C[6](C[6]C[6]HH)(C[6]C[6]N)(NN)	C[6](C[6]C[6]C)(C[6]C[6]N)(NOO)	N(C[6]C[6]2)(NC[6a]H)	C[6](C[6]C[6]HH)(C[6]C[6]N)(NN){2|C<4>,2|H<1>}	C[6](C[6]C[6]C)(C[6]C[6]N)(NOO){1|C<4>,4|H<1>}	N(C[6]C[6]2)(NC[6a]H)	116.5040	0.000	1	116.5040	0.000	1	116.5040	0.000	1	116.5040	0.000	1	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	4:3:2:	3:3:3:	3:4:	C[6]-4:C[6]-3:N-2:	C[6]-3:C[6]-3:C-3:	C[6]-3:S-4:	C[6](C[6]C[6]HH)(C[6]C[6]C)(NS)	C[6](C[6]C[6a]N[6])(C[6]C[6]N)(CCO)	N(C[6]C[6]2)(SC[6a]OO)	C[6](C[6]C[6]HH)(C[6]C[6]C)(NS){1|C<3>,1|N<3>,2|H<1>}	C[6](C[6]C[6a]N[6])(C[6]C[6]N)(CCO){1|C<4>,2|C<3>,3|H<1>}	N(C[6]C[6]2)(SC[6a]OO)	118.9320	0.000	1	118.9320	0.000	1	118.9320	0.000	1	118.9320	0.000	1	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	4:3:2:	3:3:4:	3:2:	C[6]-4:C[6]-3:N-2:	C[6]-3:C[6]-3:C-4:	C[6]-3:N-2:	C[6](C[6]C[3,6]HH)(C[6]C[6]C)(NN)	C[6](C[6]C[6]H)(C[6]C[6]N)(CH3)	N(C[6]C[6]2)(NC[5])	C[6](C[6]C[3,6]HH)(C[6]C[6]C)(NN){1|H<1>,3|C<4>}	C[6](C[6]C[6]H)(C[6]C[6]N)(CH3){2|C<4>,3|H<1>}	N(C[6]C[6]2)(NC[5])	117.0150	0.000	1	117.0150	0.000	1	117.0150	0.000	1	116.4723	3.128	4	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	4:3:2:	3:3:4:	3:2:	C[6]-4:C[6]-3:N-2:	C[6]-3:C[6]-3:C-4:	C[6]-3:O-2:	C[6](C[6]C[6,6]HH)(C[6]C[6]C)(NO)	C[6](C[6]C[6,6]H)(C[6]C[6]N)(CH3)	N(C[6]C[6]2)(OC)	C[6](C[6]C[6,6]HH)(C[6]C[6]C)(NO){1|H<1>,3|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]N)(CH3){1|C<4>,1|O<2>,3|H<1>}	N(C[6]C[6]2)(OC)	115.1410	0.000	1	115.1410	0.000	1	116.2913	4.495	3	116.4723	3.128	4	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	4:3:2:	3:3:4:	3:2:	C[6]-4:C[6]-3:N-2:	C[6]-3:C[6]-3:C-4:	C[6]-3:O-2:	C[6](C[6]C[6]HH)(C[6]C[6]C)(NO)	C[6](C[6]C[6]Br)(C[6]C[6]N)(CC[6a]HO)	N(C[6]C[6]2)(OH)	C[6](C[6]C[6]HH)(C[6]C[6]C)(NO){1|Br<1>,1|C<4>,2|H<1>}	C[6](C[6]C[6]Br)(C[6]C[6]N)(CC[6a]HO){1|C<4>,4|H<1>}	N(C[6]C[6]2)(OH)	114.9950	0.000	1	114.9950	0.000	1	116.2913	4.495	3	116.4723	3.128	4	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	4:3:2:	3:3:4:	3:2:	C[6]-4:C[6]-3:N-2:	C[6]-3:C[6]-3:C-4:	C[6]-3:O-2:	C[6](C[6]C[6]HH)(C[6]C[6]C)(NO)	C[6](C[6]C[6]H)(C[6]C[6]N)(CCCH)	N(C[6]C[6]2)(OC)	C[6](C[6]C[6]HH)(C[6]C[6]C)(NO){2|C<4>,2|H<1>}	C[6](C[6]C[6]H)(C[6]C[6]N)(CCCH){1|C<4>,4|H<1>}	N(C[6]C[6]2)(OC)	118.7380	0.000	1	118.7380	0.000	1	116.2913	4.495	3	116.4723	3.128	4	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	4:3:2:	3:3:4:	3:3:	C[6]-4:C[6]-3:N-2:	C[6]-3:C[6]-3:C-4:	C[6]-3:N-3:	C[6](C[6]C[3,6]HH)(C[6]C[6]C)(NN)	C[6](C[6]C[6]H)(C[6]C[6]N)(CH3)	N(C[6]C[6]2)(NCH)	C[6](C[6]C[3,6]HH)(C[6]C[6]C)(NN){1|H<1>,3|C<4>}	C[6](C[6]C[6]H)(C[6]C[6]N)(CH3){2|C<4>,3|H<1>}	N(C[6]C[6]2)(NCH)	116.1450	0.202	2	116.1450	0.041	2	115.7873	0.184	4	115.7216	0.160	5	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	4:3:2:	3:3:4:	3:3:	C[6]-4:C[6]-3:N-2:	C[6]-3:C[6]-3:C-4:	C[6]-3:N-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(NN)	C[6](C[6]C[6]H)(C[6]C[6]N)(CH3)	N(C[6]C[6]2)(NCH)	C[6](C[6]C[6]HH)(C[6]C[6]C)(NN){1|C<3>,1|C<4>,2|H<1>}	C[6](C[6]C[6]H)(C[6]C[6]N)(CH3){1|C<4>,4|H<1>}	N(C[6]C[6]2)(NCH)	115.4295	0.025	2	115.4295	0.001	2	115.7873	0.184	4	115.7216	0.160	5	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	4:3:2:	3:3:4:	3:3:	C[6]-4:C[6]-3:N-2:	C[6]-3:C[6]-3:C-4:	C[6]-3:N[5]-3:	C[6](C[6]C[6]CH)(C[6]C[6]C)(NN[5])	C[6](C[6]C[6]H)(C[6]C[6]N)(CH3)	N(C[6]C[6]2)(N[5]C[5]2)	C[6](C[6]C[6]CH)(C[6]C[6]C)(NN[5]){1|C<4>,3|H<1>}	C[6](C[6]C[6]H)(C[6]C[6]N)(CH3){2|C<4>,3|H<1>}	N(C[6]C[6]2)(N[5]C[5]2)	115.4590	0.000	1	115.4590	0.000	1	115.4590	0.000	1	115.7216	0.160	5	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	4:3:2:	3:3:4:	4:3:	C[6]-4:C[6]-3:N-2:	C[6]-3:C[6]-3:C-4:	C-4:C[6]-3:	C[6](C[6]C[6]CO)(C[6]C[6]C)(NC)	C[6](C[6]C[6]H)(C[6]C[6]N)(CH3)	N(CC[5x3,5x5,20x6]C[6a]H)(C[6]C[6]2)	C[6](C[6]C[6]CO)(C[6]C[6]C)(NC){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]C[6]N)(CH3){1|C<3>,1|C<4>,1|H<1>,1|O<2>}	N(CC[5x3,5x5,20x6]C[6a]H)(C[6]C[6]2)	116.5680	0.000	1	116.5680	0.000	1	116.5680	0.000	1	116.5680	0.000	1	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	4:3:2:	3:4:1:	3:1:	C[6,6]-4:C[6]-3:N-2:	C[6]-3:C[6]-4:O-1:	C[6]-3:N-1:	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]O)(NN)	C[6](C[6]C[6,6]N)(C[6]C[6]CH)(O)	N(C[6]C[6,6]C[6])(N)	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]O)(NN){1|C<3>,1|O<2>,2|H<1>,4|C<4>}	C[6](C[6]C[6,6]N)(C[6]C[6]CH)(O){2|H<1>,3|C<4>}	N(C[6]C[6,6]C[6])(N)	113.2900	0.000	1	113.2900	0.000	1	113.4920	0.211	3	113.4920	0.211	3	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	4:3:2:	3:4:1:	3:1:	C[6,6]-4:C[6]-3:N-2:	C[6]-3:C[6]-4:O-1:	C[6]-3:N-1:	C[6](C[6,6]C[6,6]C[6]O)(C[6]C[6]O)(NN)	C[6](C[6]C[6,6]N)(C[6]C[6]HH)(O)	N(C[6]C[6,6]C[6])(N)	C[6](C[6,6]C[6,6]C[6]O)(C[6]C[6]O)(NN){4|C<4>,4|H<1>}	C[6](C[6]C[6,6]N)(C[6]C[6]HH)(O){1|O<2>,2|C<4>,2|H<1>}	N(C[6]C[6,6]C[6])(N)	113.5930	0.601	2	113.5930	0.361	2	113.4920	0.211	3	113.4920	0.211	3	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	4:3:2:	4:3:1:	3:3:	C[6]-4:C[6]-3:N-2:	C[6]-4:C[6]-3:H-1:	C[6]-3:N-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(NN)	C[6](C[6]C[6]HH)(C[6]C[6]N)(H)	N(C[6]C[6]2)(NCH)	C[6](C[6]C[6]HH)(C[6]C[6]H)(NN){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]N)(H){1|C<4>,1|N<3>,3|H<1>}	N(C[6]C[6]2)(NCH)	127.8600	0.000	1	127.8600	0.000	1	127.8600	0.000	1	127.8600	0.000	1	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	4:3:2:	4:3:2:	3:2:	C[6]-4:C[6]-3:N-2:	C[6]-4:C[6]-3:N-2:	C[6]-3:O-2:	C[6](C[6]C[6]HH)(C[6]C[6]N)(NO)	C[6](C[6]C[6]HH)(C[6]C[6]N)(NO)	N(C[6]C[6]2)(OH)	C[6](C[6]C[6]HH)(C[6]C[6]N)(NO){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]N)(NO){1|C<4>,4|H<1>}	N(C[6]C[6]2)(OH)	117.5450	0.904	2	117.5450	0.817	2	117.5450	0.817	2	117.5450	0.817	2	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	4:3:2:	4:3:2:	3:3:	C[6]-4:C[6]-3:N-2:	C[6]-4:C[6]-3:N-2:	C[6]-3:N-3:	C[6](C[6]C[6]HH)(C[6]C[6]N)(NN)	C[6](C[6]C[6]HH)(C[6]C[6]N)(NN)	N(C[6]C[6]2)(NCH)	C[6](C[6]C[6]HH)(C[6]C[6]N)(NN){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]N)(NN){1|C<4>,4|H<1>}	N(C[6]C[6]2)(NCH)	122.8330	7.104	2	122.8330	50.461	2	122.8330	50.461	2	124.8302	22.182	4	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	4:3:2:	4:3:2:	3:3:	C[6]-4:C[6]-3:N-2:	C[6]-4:C[6]-3:N-2:	C[6a]-3:C[6]-3:	C[6](C[6]C[6,6a]C[6a]2)(C[6]C[6]N)(NC[6a])	C[6](C[6]C[6,6a]C[6a]O)(C[6]C[6]N)(NC[6a])	N(C[6a]C[6a]2)(C[6]C[6]2)	C[6](C[6]C[6,6a]C[6a]2)(C[6]C[6]N)(NC[6a]){1|O<2>,7|C<3>}	C[6](C[6]C[6,6a]C[6a]O)(C[6]C[6]N)(NC[6a]){6|C<3>}	N(C[6a]C[6a]2)(C[6]C[6]2)	126.5730	0.000	1	126.5730	0.000	1	126.8275	0.130	2	124.8302	22.182	4	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	4:3:2:	4:3:2:	3:3:	C[6]-4:C[6]-3:N-2:	C[6]-4:C[6]-3:N-2:	C[6a]-3:C[6]-3:	C[6](C[6]C[6,6a]C[6a]O)(C[6]C[6]N)(NC[6a])	C[6](C[6]C[6,6a]C[6a]2)(C[6]C[6]N)(NC[6a])	N(C[6a]C[6a]2)(C[6]C[6]2)	C[6](C[6]C[6,6a]C[6a]O)(C[6]C[6]N)(NC[6a]){6|C<3>}	C[6](C[6]C[6,6a]C[6a]2)(C[6]C[6]N)(NC[6a]){1|O<2>,7|C<3>}	N(C[6a]C[6a]2)(C[6]C[6]2)	127.0820	0.000	1	127.0820	0.000	1	126.8275	0.130	2	124.8302	22.182	4	120.6397	23.535	1010	120.6539	23.531	1031
762	762	941	0:SP2_SP2_SP2	C[6]	C[6]	N	4:3:2:	4:3:3:	3:3:	C[6]-4:C[6]-3:N-2:	C[6]-4:C[6]-3:C-3:	C[6a]-3:C[6]-3:	C[6](C[6]C[6]CH)(C[6]C[6]C)(NC[6a])	C[6](C[6]N[6]HH)(C[6]C[6]N)(CC[6a]H)	N(C[6a]C[6a]2)(C[6]C[6]2)	C[6](C[6]C[6]CH)(C[6]C[6]C)(NC[6a]){1|N<3>,4|H<1>}	C[6](C[6]N[6]HH)(C[6]C[6]N)(CC[6a]H){1|H<1>,3|C<4>}	N(C[6a]C[6a]2)(C[6]C[6]2)	118.3580	0.000	1	118.3580	0.000	1	118.3580	0.000	1	118.3580	0.000	1	120.6397	23.535	1010	120.6539	23.531	1031
762	762	942	6:SP2_SP-NON_SP2	C[6]	C[6]	Ga[6]	3:3:4:	3:3:1:	3:3:3:	Ga[6]-3:C[6]-3:Si-4:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6](Ga[6]C[6a]C[6])(C[6]C[6]H)(SiC3)	C[6](C[6]Ga[6]Si)(C[6]C[6]H)(H)	Ga[6](C[6a]C[6a]2)(C[6]C[6]Si)2	C[6](Ga[6]C[6a]C[6])(C[6]C[6]H)(SiC3){1|Si<4>,1|H<1>,3|C<3>}	C[6](C[6]Ga[6]Si)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	Ga[6](C[6a]C[6a]2)(C[6]C[6]Si)2{2|C<4>,2|H<1>,3|C<3>}	113.1890	0.168	2	113.1890	0.028	2	113.1890	0.028	2	113.1890	0.028	2	113.1890	0.028	2	113.1890	0.028	2
762	762	943	6:SP2_SP-NON_SP2	C[6]	C[6]	Ga[6]	4:3:4:	3:4:1:	3:3:3:1:	Ga[6]-4:C[6]-3:Si-4:	C[6]-3:C[6]-4:H-1:	C[6]-3:C[6]-3:N[6]-3:Cl-1:	C[6](Ga[6]C[6]N[6]Cl)(C[6]C[6]H)(SiC3)	C[6](C[6]Ga[6]Si)(C[6]C[6]HH)(H)	Ga[6](C[6]C[6]Si)2(N[6]C[6]2)(Cl)	C[6](Ga[6]C[6]N[6]Cl)(C[6]C[6]H)(SiC3){1|Si<4>,2|H<1>,3|C<3>}	C[6](C[6]Ga[6]Si)(C[6]C[6]HH)(H){1|Cl<1>,1|C<3>,1|H<1>,1|N<3>}	Ga[6](C[6]C[6]Si)2(N[6]C[6]2)(Cl){1|C<4>,2|C<3>,4|H<1>}	111.8935	0.907	2	111.8935	0.823	2	111.8935	0.823	2	111.8935	0.823	2	111.8935	0.823	2	111.8935	0.823	2
762	762	944	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	I	3:4:1:	3:4:3:	3:	C[6,6]-3:C[3x6]-4:I-1:	C[6,6]-3:C[3x6]-4:C[6,6]-3:	C[6,6]-3:	C[6,6](C[6,6]C[3x6]C[6,6])(C[3x6]C[6,6]2H)(I)	C[6,6](C[6,6]C[3x6]C[6,6])(C[3x6]C[6,6]2H)(C[6,6]C[3x6]I)	I(C[6,6]C[3x6]C[6,6])	C[6,6](C[6,6]C[3x6]C[6,6])(C[3x6]C[6,6]2H)(I){1|C<3>,3|C<4>,5|H<1>}	C[6,6](C[6,6]C[3x6]C[6,6])(C[3x6]C[6,6]2H)(C[6,6]C[3x6]I){1|I<1>,5|C<4>,6|H<1>}	I(C[6,6]C[3x6]C[6,6])	124.3750	0.223	2	124.3750	0.050	2	124.3750	0.050	2	124.3750	0.050	2	123.7667	1.135	3	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	I	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:I-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(I)	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]I)(H)	I(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(I){2|C<3>,2|H<1>,2|O<2>}	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]I)(H){1|C<4>,1|H<1>,1|O<1>,2|C<3>}	I(C[6,6]C[3x6]C[6,6])	122.5500	0.000	1	122.5500	0.000	1	122.5500	0.000	1	122.5500	0.000	1	123.7667	1.135	3	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[3x6]	I	3:3:1:	4:4:3:	3:	C[3x6]-3:C[6]-3:I-1:	C[4x6]-4:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[3x6]C[4x6]C[6,6])(C[6]C[6]O)(I)	C[3x6](C[4x6]C[6,6]N[6,6]C[6])(C[6,6]C[6]2H)(C[6]C[6]I)	I(C[6]C[3x6]C[6])	C[6](C[3x6]C[4x6]C[6,6])(C[6]C[6]O)(I){1|H<1>,1|N<3>,1|O<1>,4|C<4>}	C[3x6](C[4x6]C[6,6]N[6,6]C[6])(C[6,6]C[6]2H)(C[6]C[6]I){1|O<1>,2|C<3>,3|C<4>,7|H<1>}	I(C[6]C[3x6]C[6])	122.9670	0.000	1	122.9670	0.000	1	122.9670	0.000	1	122.9670	0.000	1	122.9670	0.000	1	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	2:3:1:	3:3:1:	3:	C[6]-2:C[6]-3:I-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6])(C[6]C[6]H)(I)	C[6](C[6]C[5,6]H)(C[6]C[6]I)(H)	I(C[6]C[6]2)	C[6](C[6]C[5,6])(C[6]C[6]H)(I){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]I)(H){1|C<3>,1|N<3>}	I(C[6]C[6]2)	116.7890	0.000	1	116.7890	0.000	1	116.7890	0.000	1	116.7890	0.000	1	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:I-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(I)	C[6](C[6]C[6]H)(C[6]C[6]I)(H)	I(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(I){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]C[6]I)(H){1|C<3>,1|N<3>}	I(C[6]C[6]2)	119.7080	0.000	1	119.7080	0.000	1	119.7080	0.000	1	119.4967	0.085	3	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:I-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(I)	C[6](N[6]C[6]Co)(C[6]N[6]I)(H)	I(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(I){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]N[6]I)(H){1|C<3>,1|H<1>}	I(C[6]C[6]N[6])	119.6180	0.000	1	119.6180	0.000	1	119.3910	0.103	2	119.4967	0.085	3	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:I-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(I)	C[6](N[6]C[6]Ni)(C[6]N[6]I)(H)	I(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(I){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]N[6]I)(H){1|C<3>,1|H<1>}	I(C[6]C[6]N[6])	119.1640	0.000	1	119.1640	0.000	1	119.3910	0.103	2	119.4967	0.085	3	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	3:3:1:	3:2:4:	3:	C[6,6a]-3:C[6]-3:I-1:	C[6]-3:O[6]-2:C-4:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]O[6]C)(I)	C[6](C[6]C[6,6a]I)(O[6]C[6])(CCHH)	I(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]O[6]C)(I){1|C<4>,1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]I)(O[6]C[6])(CCHH){1|H<1>,1|O<2>,2|C<3>}	I(C[6]C[6,6a]C[6])	120.0120	0.535	8	120.0120	0.286	8	120.0120	0.286	8	120.2387	0.713	9	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:I-1:	C[6]-3:N[6]-2:C-4:	C[6]-3:	C[6](C[6]N[6]C)(C[6]N[6]N)(I)	C[6](C[6]C[6]I)(N[6]C[6])(CH3)	I(C[6]C[6]2)	C[6](C[6]N[6]C)(C[6]N[6]N)(I){1|Pd<4>,1|C<3>}	C[6](C[6]C[6]I)(N[6]C[6])(CH3){1|C<4>,1|N<2>,1|N<3>}	I(C[6]C[6]2)	122.0520	0.000	1	122.0520	0.000	1	122.0520	0.000	1	120.2387	0.713	9	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	3:3:1:	3:3:1:	3:	C[3x6]-3:C[6]-3:I-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[3x6]C[4x6]C[6,6])(C[6]C[6]O)(I)	C[6](C[6]C[3x6]I)(C[6]N[6,6]O)(O)	I(C[6]C[3x6]C[6])	C[6](C[3x6]C[4x6]C[6,6])(C[6]C[6]O)(I){1|H<1>,1|N<3>,1|O<1>,4|C<4>}	C[6](C[6]C[3x6]I)(C[6]N[6,6]O)(O){3|C<4>}	I(C[6]C[3x6]C[6])	114.8770	0.000	1	114.8770	0.000	1	114.8770	0.000	1	119.8891	3.646	278	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:I-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]O)(I)	C[6](C[5,6]C[5,6a]C[5,6])(C[6]C[6]I)(H)	I(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(I){1|H<1>,2|C<3>}	C[6](C[5,6]C[5,6a]C[5,6])(C[6]C[6]I)(H){1|C<4>,1|O<1>,3|C<3>}	I(C[6]C[6]2)	119.0830	0.000	1	118.3685	1.021	2	118.3685	1.021	2	119.8891	3.646	278	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:I-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]O)(I)	C[6](C[5,6]C[5,6a]C[5,6])(C[6]C[6]I)(H)	I(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(I){2|C<3>,2|H<1>}	C[6](C[5,6]C[5,6a]C[5,6])(C[6]C[6]I)(H){1|O<2>,2|C<3>,2|C<4>}	I(C[6]C[6]2)	117.6540	0.000	1	118.3685	1.021	2	118.3685	1.021	2	119.8891	3.646	278	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:I-1:	C[6,6a]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(I)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]I)(O)	I(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(I){1|O<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]I)(O){2|H<1>,3|C<3>}	I(C[6]C[6]2)	116.2770	0.000	1	116.2770	0.000	1	117.4332	0.789	10	119.8891	3.646	278	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:I-1:	C[6,6a]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(I)	C[6](C[6,6a]C[6,6a]N[6a])(C[6]C[6]I)(O)	I(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(I){1|C<3>,1|N<2>,1|S<4>}	C[6](C[6,6a]C[6,6a]N[6a])(C[6]C[6]I)(O){1|H<1>,3|C<3>}	I(C[6]C[6]2)	118.4950	0.000	1	118.4950	0.000	1	117.4332	0.789	10	119.8891	3.646	278	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:I-1:	C[6,6a]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]O)(I)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]I)(O)	I(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]O)(I){1|N<2>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]I)(O){1|H<1>,1|O<2>,3|C<3>}	I(C[6]C[6]2)	116.9470	0.000	1	117.4450	0.663	8	117.4332	0.789	10	119.8891	3.646	278	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:I-1:	C[6,6a]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]O)(I)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]I)(O)	I(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]O)(I){1|O<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]I)(O){1|H<1>,1|O<2>,3|C<3>}	I(C[6]C[6]2)	117.5161	0.852	7	117.4450	0.663	8	117.4332	0.789	10	119.8891	3.646	278	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:I-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(I)	C[6](C[6]C[6,6a]O)(C[6]C[6]I)(H)	I(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(I){1|O<1>,2|C<3>}	C[6](C[6]C[6,6a]O)(C[6]C[6]I)(H){1|O<1>,2|C<3>}	I(C[6]C[6]2)	121.6560	0.000	1	121.6560	0.000	1	120.8480	2.432	134	119.8891	3.646	278	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:I-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(I)	C[6](C[6]C[6,6a]S)(C[6]C[6]I)(H)	I(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(I){1|C<3>,1|N<2>,1|S<4>}	C[6](C[6]C[6,6a]S)(C[6]C[6]I)(H){1|O<1>,2|C<3>}	I(C[6]C[6]2)	118.1440	0.000	1	118.1440	0.000	1	120.8480	2.432	134	119.8891	3.646	278	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:I-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(I)	C[6](C[6]C[6]C)(C[6]C[6]I)(H)	I(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(I){1|H<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]I)(H){1|C<3>,1|H<1>,1|O<1>}	I(C[6]C[6]2)	118.0740	0.000	2	118.0740	0.000	2	120.8480	2.432	134	119.8891	3.646	278	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:I-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(I)	C[6](C[6]C[6]I)(C[6]C[6]O)(H)	I(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(I){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]I)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|O<1>}	I(C[6]C[6]2)	122.4130	0.018	2	122.3480	0.013	3	120.8480	2.432	134	119.8891	3.646	278	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:I-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(I)	C[6](C[6]C[6]I)(C[6]C[6]O)(H)	I(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(I){1|C<4>,1|O<1>,2|H<1>}	C[6](C[6]C[6]I)(C[6]C[6]O)(H){1|H<1>,1|O<1>,2|C<4>}	I(C[6]C[6]2)	122.2180	0.000	1	122.3480	0.013	3	120.8480	2.432	134	119.8891	3.646	278	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:I-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(I)	C[6](C[6]C[6]I)2(H)	I(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(I){1|C<3>,2|I<1>}	C[6](C[6]C[6]I)2(H){1|C<3>,1|H<1>,1|O<1>}	I(C[6]C[6]2)	119.9660	0.277	2	119.9660	0.077	2	120.8480	2.432	134	119.8891	3.646	278	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:I-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(I)	C[6](C[6]C[6]H)(C[6]C[6]I)(H)	I(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(I){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6]I)(H){1|Br<1>,1|H<1>,1|N<3>}	I(C[6]C[6]2)	121.9960	0.000	1	121.8223	1.298	54	120.8480	2.432	134	119.8891	3.646	278	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:I-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(I)	C[6](C[6]C[6]H)(C[6]C[6]I)(H)	I(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(I){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6]I)(H){1|H<1>,2|N<3>}	I(C[6]C[6]2)	121.7820	0.000	1	121.8223	1.298	54	120.8480	2.432	134	119.8891	3.646	278	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:I-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(I)	C[6](C[6]C[6]H)(C[6]C[6]I)(H)	I(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(I){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6]I)(H){1|N<3>,2|H<1>}	I(C[6]C[6]2)	121.8273	1.415	24	121.8223	1.298	54	120.8480	2.432	134	119.8891	3.646	278	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:I-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(I)	C[6](C[6]C[6]H)(C[6]C[6]I)(H)	I(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(I){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]C[6]I)(H){1|H<1>,1|N<2>,1|N<3>}	I(C[6]C[6]2)	120.7118	0.802	5	121.8223	1.298	54	120.8480	2.432	134	119.8891	3.646	278	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:I-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(I)	C[6](C[6]C[6]H)(C[6]C[6]I)(H)	I(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(I){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]C[6]I)(H){1|N<3>,2|H<1>}	I(C[6]C[6]2)	122.1438	0.608	18	121.8223	1.298	54	120.8480	2.432	134	119.8891	3.646	278	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:I-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(I)	C[6](C[6]C[6]H)(C[6]C[6]I)(H)	I(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(I){1|Co<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6]I)(H){1|N<3>,2|H<1>}	I(C[6]C[6]2)	122.5050	0.000	1	121.8223	1.298	54	120.8480	2.432	134	119.8891	3.646	278	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:I-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(I)	C[6](C[6]C[6]H)(C[6]C[6]I)(H)	I(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(I){1|Ni<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6]I)(H){1|N<3>,2|H<1>}	I(C[6]C[6]2)	122.7660	0.000	1	121.8223	1.298	54	120.8480	2.432	134	119.8891	3.646	278	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:I-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(I)	C[6](C[6]C[6]H)(C[6]C[6]I)(H)	I(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(I){1|Pd<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6]I)(H){1|N<3>,2|H<1>}	I(C[6]C[6]2)	119.7300	0.000	1	121.8223	1.298	54	120.8480	2.432	134	119.8891	3.646	278	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:I-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(I)	C[6](C[6]C[6]H)(C[6]C[6]I)(H)	I(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(I){1|Zn<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6]I)(H){1|N<3>,2|H<1>}	I(C[6]C[6]2)	121.8100	0.382	2	121.8223	1.298	54	120.8480	2.432	134	119.8891	3.646	278	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:I-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(I)	C[6](C[6]C[6]I)2(H)	I(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(I){1|C<3>,1|C<4>,1|I<1>}	C[6](C[6]C[6]I)2(H){1|N<3>,2|H<1>}	I(C[6]C[6]2)	121.0683	1.920	16	121.0683	3.686	16	120.8480	2.432	134	119.8891	3.646	278	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:I-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(I)	C[6](C[6]C[6]C)(C[6]C[6]I)(H)	I(C[6]C[6]2)	C[6](C[6]C[6]H)2(I){1|H<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]I)(H){1|C<3>,1|H<1>,1|O<1>}	I(C[6]C[6]2)	119.1970	0.000	1	119.1970	0.000	1	120.8480	2.432	134	119.8891	3.646	278	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:I-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(I)	C[6](C[6]C[6]H)(C[6]C[6]I)(H)	I(C[6]C[6]2)	C[6](C[6]C[6]H)2(I){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]C[6]I)(H){1|C<3>,1|H<1>,1|O<1>}	I(C[6]C[6]2)	119.8861	0.995	11	119.9585	0.964	12	120.8480	2.432	134	119.8891	3.646	278	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:I-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(I)	C[6](C[6]C[6]H)(C[6]C[6]I)(H)	I(C[6]C[6]2)	C[6](C[6]C[6]H)2(I){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]C[6]I)(H){1|C<3>,1|H<1>,1|O<1>}	I(C[6]C[6]2)	120.7550	0.000	1	119.9585	0.964	12	120.8480	2.432	134	119.8891	3.646	278	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:I-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(I)	C[6](C[6]C[6]I)(C[6]N[6]H)(H)	I(C[6]C[6]2)	C[6](C[6]C[6]H)2(I){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]I)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	I(C[6]C[6]2)	119.3710	0.277	2	119.9787	0.956	34	120.8480	2.432	134	119.8891	3.646	278	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:I-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(I)	C[6](C[6]C[6]I)(C[6]N[6]H)(H)	I(C[6]C[6]2)	C[6](C[6]C[6]H)2(I){1|N<3>,2|H<1>}	C[6](C[6]C[6]I)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	I(C[6]C[6]2)	119.9603	0.958	30	119.9787	0.956	34	120.8480	2.432	134	119.8891	3.646	278	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:I-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(I)	C[6](C[6]C[6]I)(C[6]N[6]H)(H)	I(C[6]C[6]2)	C[6](C[6]C[6]H)2(I){1|N<3>,2|H<1>}	C[6](C[6]C[6]I)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	I(C[6]C[6]2)	120.8625	1.602	2	119.9787	0.956	34	120.8480	2.432	134	119.8891	3.646	278	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:I-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(I)	C[6](C[6]C[6]I)2(H)	I(C[6]C[6]2)	C[6](C[6]C[6]H)2(I){1|C<3>,2|I<1>}	C[6](C[6]C[6]I)2(H){1|C<3>,1|H<1>,1|O<1>}	I(C[6]C[6]2)	118.6215	1.293	2	118.6215	1.673	2	120.8480	2.432	134	119.8891	3.646	278	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:I-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(I)	C[6](C[6]C[6]N[6])(C[6]C[6]I)(H)	I(C[6]C[6]2)	C[6](C[6]C[6]H)2(I){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]I)(H){1|Ru<6>,1|H<1>,1|N<3>,2|C<3>}	I(C[6]C[6]2)	121.1230	0.078	2	119.3582	4.522	4	120.8480	2.432	134	119.8891	3.646	278	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:I-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(I)	C[6](C[6]C[6]N[6])(C[6]C[6]I)(H)	I(C[6]C[6]2)	C[6](C[6]C[6]H)2(I){1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]I)(H){1|Pt<4>,1|H<1>,1|N<3>,2|C<3>}	I(C[6]C[6]2)	117.5935	1.050	2	119.3582	4.522	4	120.8480	2.432	134	119.8891	3.646	278	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:I-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(I)	C[6](C[6]C[6a]N[6])(C[6]C[6]I)(H)	I(C[6]C[6]2)	C[6](C[6]C[6]H)2(I){1|N<3>,2|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]I)(H){1|Pt<4>,1|H<1>,3|C<3>}	I(C[6]C[6]2)	121.2825	1.060	2	121.2825	1.124	2	120.8480	2.432	134	119.8891	3.646	278	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:I-1:	C[6]-3:C[6]-3:I-1:	C[6]-3:	C[6](C[6]C[6]I)(C[6]C[6]O)(I)	C[6](C[6]C[6]I)(C[6]C[6]O)(I)	I(C[6]C[6]2)	C[6](C[6]C[6]I)(C[6]C[6]O)(I){1|C<3>,1|I<1>,1|O<1>}	C[6](C[6]C[6]I)(C[6]C[6]O)(I){1|C<3>,1|I<1>,1|O<1>}	I(C[6]C[6]2)	124.3570	0.331	2	124.3570	0.110	2	124.3570	0.110	2	119.8891	3.646	278	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:I-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]O)(I)	C[6](C[6]C[5,6]H)(C[6]C[6]I)(O)	I(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(I){1|H<1>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]I)(O){1|C<3>,1|C<4>,1|H<1>}	I(C[6]C[6]2)	118.1920	0.000	1	118.1920	0.000	1	118.6443	3.008	34	119.8891	3.646	278	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:I-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(I)	C[6](C[6]C[6]H)(C[6]C[6]I)(O)	I(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(I){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]I)(O){1|C<3>,2|H<1>}	I(C[6]C[6]2)	116.7055	0.124	2	118.7242	5.439	4	118.6443	3.008	34	119.8891	3.646	278	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:I-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(I)	C[6](C[6]C[6]H)(C[6]C[6]I)(O)	I(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(I){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]C[6]I)(O){1|C<3>,2|H<1>}	I(C[6]C[6]2)	120.7430	0.000	2	118.7242	5.439	4	118.6443	3.008	34	119.8891	3.646	278	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:I-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(I)	C[6](C[6]C[6]I)2(O)	I(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(I){1|C<3>,2|I<1>}	C[6](C[6]C[6]I)2(O){1|C<3>,2|H<1>}	I(C[6]C[6]2)	119.1075	0.374	2	119.1075	0.140	2	118.6443	3.008	34	119.8891	3.646	278	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:I-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]I)(C[6]C[6]O)(I)	C[6](C[6]C[6]I)2(O)	I(C[6]C[6]2)	C[6](C[6]C[6]I)(C[6]C[6]O)(I){1|C<3>,1|I<1>,1|O<1>}	C[6](C[6]C[6]I)2(O){1|C<3>,2|I<1>}	I(C[6]C[6]2)	114.2975	0.388	2	114.2975	0.151	2	118.6443	3.008	34	119.8891	3.646	278	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:I-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]O)2(I)	C[6](C[6]C[6]H)(C[6]C[6]I)(O)	I(C[6]C[6]2)	C[6](C[6]C[6]O)2(I){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]I)(O){1|C<3>,1|H<1>,1|O<2>}	I(C[6]C[6]2)	115.7100	0.000	1	115.7100	0.000	1	118.6443	3.008	34	119.8891	3.646	278	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:I-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]O)2(I)	C[6](C[6]C[6]I)(C[6]C[6]O)(O)	I(C[6]C[6]2)	C[6](C[6]C[6]O)2(I){1|C<3>,1|O<1>,1|O<2>}	C[6](C[6]C[6]I)(C[6]C[6]O)(O){1|C<3>,1|I<1>,1|O<1>}	I(C[6]C[6]2)	118.8637	0.448	4	118.4015	0.288	12	118.6443	3.008	34	119.8891	3.646	278	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:I-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]O)2(I)	C[6](C[6]C[6]I)(C[6]C[6]O)(O)	I(C[6]C[6]2)	C[6](C[6]C[6]O)2(I){1|C<3>,1|O<1>,1|O<2>}	C[6](C[6]C[6]I)(C[6]C[6]O)(O){1|C<3>,1|I<1>,1|O<2>}	I(C[6]C[6]2)	118.2847	0.435	6	118.4015	0.288	12	118.6443	3.008	34	119.8891	3.646	278	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:I-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]O)2(I)	C[6](C[6]C[6]I)(C[6]C[6]O)(O)	I(C[6]C[6]2)	C[6](C[6]C[6]O)2(I){1|C<3>,2|O<1>}	C[6](C[6]C[6]I)(C[6]C[6]O)(O){1|C<3>,1|I<1>,1|O<2>}	I(C[6]C[6]2)	117.8275	0.145	2	118.4015	0.288	12	118.6443	3.008	34	119.8891	3.646	278	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:I-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]O)2(I)	C[6](C[6]C[6]I)2(O)	I(C[6]C[6]2)	C[6](C[6]C[6]O)2(I){1|C<3>,2|I<1>}	C[6](C[6]C[6]I)2(O){1|C<3>,2|O<1>}	I(C[6]C[6]2)	119.7900	1.205	12	119.7900	1.452	12	118.6443	3.008	34	119.8891	3.646	278	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:I-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(I)	C[6](C[6]C[6]I)(N[6]C[6]C)(H)	I(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(I){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]I)(N[6]C[6]C)(H){1|C<2>,1|C<3>,1|H<1>}	I(C[6]C[6]2)	118.5327	0.546	11	118.5327	0.298	11	118.8718	1.548	77	119.8891	3.646	278	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:I-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(I)	C[6](C[6]C[6]I)(N[6]C[6]C)(H)	I(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(I){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]I)(N[6]C[6]C)(H){1|Br<1>,1|C<3>,1|H<1>}	I(C[6]C[6]2)	119.7400	0.000	1	118.6880	2.184	42	118.8718	1.548	77	119.8891	3.646	278	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:I-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(I)	C[6](C[6]C[6]I)(N[6]C[6]C)(H)	I(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(I){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]I)(N[6]C[6]C)(H){1|C<3>,1|H<1>,1|N<3>}	I(C[6]C[6]2)	119.3070	0.000	1	118.6880	2.184	42	118.8718	1.548	77	119.8891	3.646	278	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:I-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(I)	C[6](C[6]C[6]I)(N[6]C[6]C)(H)	I(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(I){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]I)(N[6]C[6]C)(H){1|C<3>,2|H<1>}	I(C[6]C[6]2)	118.5080	1.029	24	118.6880	2.184	42	118.8718	1.548	77	119.8891	3.646	278	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:I-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(I)	C[6](C[6]C[6]I)(N[6]C[6]C)(H)	I(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(I){1|C<3>,1|C<4>,1|I<1>}	C[6](C[6]C[6]I)(N[6]C[6]C)(H){1|C<3>,2|H<1>}	I(C[6]C[6]2)	118.8534	2.041	16	118.6880	2.184	42	118.8718	1.548	77	119.8891	3.646	278	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:I-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(I)	C[6](C[6]C[6]I)(N[6]C[6]H)(H)	I(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(I){1|C<3>,2|H<1>}	C[6](C[6]C[6]I)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	I(C[6]C[6]2)	120.7790	0.282	5	119.3595	0.796	22	118.8718	1.548	77	119.8891	3.646	278	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:I-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(I)	C[6](C[6]C[6]I)(N[6]C[6]H)(H)	I(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(I){1|C<3>,2|H<1>}	C[6](C[6]C[6]I)(N[6]C[6]H)(H){1|C<3>,2|H<1>}	I(C[6]C[6]2)	118.9421	0.458	17	119.3595	0.796	22	118.8718	1.548	77	119.8891	3.646	278	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:I-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(I)	C[6](C[6]C[6]I)(N[6]C[6]C)(H)	I(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(I){1|C<3>,1|C<4>,2|H<1>}	C[6](C[6]C[6]I)(N[6]C[6]C)(H){1|H<1>,1|O<1>,2|C<4>}	I(C[6]C[6]2)	119.2335	0.486	2	119.2335	0.236	2	118.8718	1.548	77	119.8891	3.646	278	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:I-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(I)	C[6](N[6]C[6]Co)(C[6]C[6]I)(H)	I(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(I){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]I)(H){1|C<3>,2|H<1>}	I(C[6]C[6]2)	118.5220	0.000	1	118.5220	0.000	1	119.2516	0.902	5	119.8891	3.646	278	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:I-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(I)	C[6](N[6]C[6]Ni)(C[6]C[6]I)(H)	I(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(I){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]I)(H){1|C<3>,2|H<1>}	I(C[6]C[6]2)	118.3320	0.000	1	118.3320	0.000	1	119.2516	0.902	5	119.8891	3.646	278	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:I-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(I)	C[6](N[6]C[6]Pd)(C[6]C[6]I)(H)	I(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(I){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]I)(H){1|C<3>,2|H<1>}	I(C[6]C[6]2)	120.5100	0.000	1	120.5100	0.000	1	119.2516	0.902	5	119.8891	3.646	278	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:I-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(I)	C[6](N[6]C[6]Zn)(C[6]C[6]I)(H)	I(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(I){1|Zn<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]I)(H){1|C<3>,2|H<1>}	I(C[6]C[6]2)	119.4470	0.754	2	119.4470	0.568	2	119.2516	0.902	5	119.8891	3.646	278	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:I-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(I)	C[6](C[6]C[6]H)(C[6]N[6]I)(H)	I(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(I){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]I)(H){1|Br<1>,1|C<3>,1|C<4>}	I(C[6]C[6]N[6])	118.8420	0.000	1	118.8420	0.000	1	121.3513	3.529	13	119.8891	3.646	278	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:I-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(I)	C[6](C[6]C[6]H)(C[6]N[6]I)(H)	I(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(I){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]I)(H){1|C<3>,2|H<1>}	I(C[6]C[6]N[6])	122.0763	0.892	7	122.0763	0.795	7	121.3513	3.529	13	119.8891	3.646	278	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:I-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]O)(I)	C[6](C[6]C[6]H)(C[6]N[6]I)(H)	I(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]O)(I){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]I)(H){1|C<3>,1|H<1>,1|O<1>}	I(C[6]C[6]N[6])	122.4097	1.970	3	122.4097	3.881	3	121.3513	3.529	13	119.8891	3.646	278	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:I-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]O)(I)	C[6](C[6]C[6]N)(C[6]N[6]I)(H)	I(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]O)(I){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]I)(H){1|C<3>,1|H<1>,1|O<1>}	I(C[6]C[6]N[6])	118.4810	0.000	2	118.4810	0.000	2	121.3513	3.529	13	119.8891	3.646	278	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	3:3:1:	3:3:2:	3:	C[5a,6]-3:C[6]-3:I-1:	C[6]-3:C[6a]-3:S[6]-2:	C[6]-3:	C[6](C[5a,6]C[5a,6]N[5a])(C[6]C[6a]S[6])(I)	C[6](C[6]C[5a,6]I)(C[6a]C[6a]2)(S[6]C[6])	I(C[6]C[5a,6]C[6])	C[6](C[5a,6]C[5a,6]N[5a])(C[6]C[6a]S[6])(I){2|C<3>,2|C<4>,2|N<2>}	C[6](C[6]C[5a,6]I)(C[6a]C[6a]2)(S[6]C[6]){1|N<3>,3|C<3>,4|H<1>}	I(C[6]C[5a,6]C[6])	118.7880	0.000	1	118.7880	0.000	1	118.7880	0.000	1	121.1659	1.174	38	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	3:3:1:	3:3:2:	3:	C[6,6a]-3:C[6]-3:I-1:	C[6]-3:C[6a]-3:O[6]-2:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]O[6])(I)	C[6](C[6]C[6,6a]I)(C[6a]C[6a]2)(O[6]C[5,6])	I(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]O[6])(I){1|C<4>,1|H<1>,4|C<3>}	C[6](C[6]C[6,6a]I)(C[6a]C[6a]2)(O[6]C[5,6]){1|O<2>,2|H<1>,5|C<3>}	I(C[6]C[6,6a]C[6])	120.6105	0.250	2	120.6105	0.062	2	120.9227	1.100	6	121.1659	1.174	38	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	3:3:1:	3:3:2:	3:	C[6,6a]-3:C[6]-3:I-1:	C[6]-3:C[6a]-3:O[6]-2:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]O[6])(I)	C[6](C[6]C[6,6a]I)(C[6a]C[6a]2)(O[6]C[6])	I(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]O[6])(I){1|C<4>,1|H<1>,4|C<3>}	C[6](C[6]C[6,6a]I)(C[6a]C[6a]2)(O[6]C[6]){4|C<3>,4|H<1>}	I(C[6]C[6,6a]C[6])	122.1750	0.000	1	120.6887	1.660	3	120.9227	1.100	6	121.1659	1.174	38	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	3:3:1:	3:3:2:	3:	C[6,6a]-3:C[6]-3:I-1:	C[6]-3:C[6a]-3:O[6]-2:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]O[6])(I)	C[6](C[6]C[6,6a]I)(C[6a]C[6a]2)(O[6]C[6])	I(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]O[6])(I){1|H<1>,5|C<3>}	C[6](C[6]C[6,6a]I)(C[6a]C[6a]2)(O[6]C[6]){1|N<2>,2|H<1>,4|C<3>}	I(C[6]C[6,6a]C[6])	119.9980	0.000	1	120.6887	1.660	3	120.9227	1.100	6	121.1659	1.174	38	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	3:3:1:	3:3:2:	3:	C[6,6a]-3:C[6]-3:I-1:	C[6]-3:C[6a]-3:O[6]-2:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]O[6])(I)	C[6](C[6]C[6,6a]I)(C[6a]C[6a]2)(O[6]C[6])	I(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]O[6])(I){1|H<1>,5|C<3>}	C[6](C[6]C[6,6a]I)(C[6a]C[6a]2)(O[6]C[6]){1|N<3>,2|H<1>,4|C<3>}	I(C[6]C[6,6a]C[6])	119.8930	0.000	1	120.6887	1.660	3	120.9227	1.100	6	121.1659	1.174	38	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	3:3:1:	3:3:2:	3:	C[6,6a]-3:C[6]-3:I-1:	C[6]-3:C[6a]-3:O[6]-2:	C[6]-3:	C[6](C[6,6a]C[6,6a]N[6a])(C[6]C[6a]O[6])(I)	C[6](C[6]C[6,6a]I)(C[6a]C[6a]2)(O[6]C[6])	I(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]N[6a])(C[6]C[6a]O[6])(I){5|C<3>}	C[6](C[6]C[6,6a]I)(C[6a]C[6a]2)(O[6]C[6]){1|N<2>,1|O<2>,2|H<1>,3|C<3>}	I(C[6]C[6,6a]C[6])	122.2490	0.000	1	122.2490	0.000	1	120.9227	1.100	6	121.1659	1.174	38	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:I-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(I)	C[6](C[6]C[6]H)(C[6]C[6]I)(CC)	I(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(I){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6]I)(CC){1|N<3>,2|H<1>}	I(C[6]C[6]2)	121.9622	0.625	11	121.9622	0.390	11	121.9622	0.390	11	121.1659	1.174	38	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:I-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]O)(I)	C[6](C[6]C[6,6a]N)(C[6]C[6]I)(OH)	I(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]O)(I){1|N<2>,2|C<3>}	C[6](C[6]C[6,6a]N)(C[6]C[6]I)(OH){1|O<1>,2|C<3>}	I(C[6]C[6]2)	120.9070	0.000	1	120.9070	0.000	1	120.9217	0.515	17	121.1659	1.174	38	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:I-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]O)(I)	C[6](C[6]C[6,6a]O)(C[6]C[6]I)(OH)	I(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]O)(I){1|O<1>,2|C<3>}	C[6](C[6]C[6,6a]O)(C[6]C[6]I)(OH){1|O<1>,2|C<3>}	I(C[6]C[6]2)	120.5281	0.832	7	120.5281	0.692	7	120.9217	0.515	17	121.1659	1.174	38	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:I-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)2(I)	C[6](C[6]C[6]I)(C[6]C[6]O)(OC)	I(C[6]C[6]2)	C[6](C[6]C[6]O)2(I){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]I)(C[6]C[6]O)(OC){1|C<3>,1|H<1>,1|O<1>}	I(C[6]C[6]2)	121.5500	0.000	1	121.5500	0.000	1	120.9217	0.515	17	121.1659	1.174	38	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:I-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)2(I)	C[6](C[6]C[6]I)(C[6]C[6]O)(OH)	I(C[6]C[6]2)	C[6](C[6]C[6]O)2(I){1|C<3>,1|O<1>,1|O<2>}	C[6](C[6]C[6]I)(C[6]C[6]O)(OH){1|C<3>,1|I<1>,1|O<1>}	I(C[6]C[6]2)	120.9630	0.366	6	121.1894	0.292	8	120.9217	0.515	17	121.1659	1.174	38	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:I-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)2(I)	C[6](C[6]C[6]I)(C[6]C[6]O)(OH)	I(C[6]C[6]2)	C[6](C[6]C[6]O)2(I){1|C<3>,2|O<1>}	C[6](C[6]C[6]I)(C[6]C[6]O)(OH){1|C<3>,1|I<1>,1|O<1>}	I(C[6]C[6]2)	121.8685	0.380	2	121.1894	0.292	8	120.9217	0.515	17	121.1659	1.174	38	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:I-1:	C[6a]-3:C[6]-3:O[6]-2:	C[6]-3:	C[6](C[6]C[6a]O[6])(C[6]C[5,6]O)(I)	C[6](C[6a]C[6a]2)(C[6]C[6]I)(O[6]C[6])	I(C[6]C[6]2)	C[6](C[6]C[6a]O[6])(C[6]C[5,6]O)(I){2|C<3>,3|C<4>}	C[6](C[6a]C[6a]2)(C[6]C[6]I)(O[6]C[6]){1|C<4>,1|O<1>,3|C<3>,3|H<1>}	I(C[6]C[6]2)	123.1260	0.000	1	123.1260	0.000	1	122.1880	1.760	2	121.1659	1.174	38	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:I-1:	C[6a]-3:C[6]-3:O[6]-2:	C[6]-3:	C[6](C[6]C[6a]O[6])(C[6]C[6]O)(I)	C[6](C[6a]C[6a]2)(C[6]C[6]I)(O[6]C[6])	I(C[6]C[6]2)	C[6](C[6]C[6a]O[6])(C[6]C[6]O)(I){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6a]C[6a]2)(C[6]C[6]I)(O[6]C[6]){1|Br<1>,1|C<4>,1|O<1>,2|C<3>,3|H<1>}	I(C[6]C[6]2)	121.2500	0.000	1	121.2500	0.000	1	122.1880	1.760	2	121.1659	1.174	38	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:I-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]N[6]C)(C[6]N[6]N)(I)	C[6](N[6]C[6]Pd)(C[6]C[6]I)(NC)	I(C[6]C[6]2)	C[6](C[6]N[6]C)(C[6]N[6]N)(I){1|Pd<4>,1|C<3>}	C[6](N[6]C[6]Pd)(C[6]C[6]I)(NC){1|N<2>,2|C<4>}	I(C[6]C[6]2)	118.3500	0.000	1	118.3500	0.000	1	118.3500	0.000	1	121.1659	1.174	38	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	3:3:1:	3:3:3:	3:	C[6,6a]-3:C[6]-3:I-1:	N[5a,6]-3:C[6]-3:C[6a]-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[5a,6]C[6a])(I)	C[6](N[5a,6]C[5a,6a]C[5a,6])(C[6]C[6,6a]I)(C[6a]C[6a]2)	I(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[5a,6]C[6a])(I){1|H<1>,6|C<3>}	C[6](N[5a,6]C[5a,6a]C[5a,6])(C[6]C[6,6a]I)(C[6a]C[6a]2){1|N<3>,2|H<1>,6|C<3>}	I(C[6]C[6,6a]C[6])	117.2877	0.135	3	117.2877	0.018	3	117.2877	0.018	3	119.4571	7.673	7	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	3:3:1:	3:3:3:	3:	C[6,6a]-3:C[6]-3:I-1:	N[6,6]-3:C[6]-3:C[6a]-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6,6]C[6a])(I)	C[6](N[6,6]C[6,6a]C[6,6])(C[6]C[6,6a]I)(C[6a]C[6a]2)	I(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6,6]C[6a])(I){1|C<4>,1|H<1>,5|C<3>}	C[6](N[6,6]C[6,6a]C[6,6])(C[6]C[6,6a]I)(C[6a]C[6a]2){1|N<3>,3|H<1>,6|C<3>}	I(C[6]C[6,6a]C[6])	118.8515	0.623	2	118.8515	0.388	2	118.8515	0.388	2	119.4571	7.673	7	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:I-1:	C[6a]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]O)(I)	C[6](C[6a]C[6a]2)(C[6]C[6]I)(N[6]C[6]C)	I(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]O)(I){1|C<4>,2|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]I)(N[6]C[6]C){1|O<1>,2|C<3>,2|C<4>,3|H<1>}	I(C[6]C[6]2)	123.3170	0.980	2	123.3170	0.960	2	123.3170	0.960	2	119.4571	7.673	7	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:I-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[3x6]O)(C[6]C[6]C)(I)	C[6](C[6]C[3x6]O)(C[6]C[6]I)(CH3)	I(C[6]C[6]2)	C[6](C[6]C[3x6]O)(C[6]C[6]C)(I){1|O<1>,3|C<4>}	C[6](C[6]C[3x6]O)(C[6]C[6]I)(CH3){1|H<1>,1|O<1>,2|C<4>}	I(C[6]C[6]2)	121.5540	0.000	1	121.5540	0.000	1	121.6700	0.026	3	121.6700	0.026	3	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:I-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]C)(I)	C[6](C[6]C[6,6]O)(C[6]C[6]I)(CH3)	I(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]C)(I){1|O<1>,3|C<4>}	C[6](C[6]C[6,6]O)(C[6]C[6]I)(CH3){1|H<1>,1|O<1>,2|C<4>}	I(C[6]C[6]2)	121.7280	0.177	2	121.7280	0.031	2	121.6700	0.026	3	121.6700	0.026	3	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:I-1:	C[3x6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[3x6]O)(C[6]C[6]C)(I)	C[6](C[3x6]C[3x6]2C)(C[6]C[6]I)(O)	I(C[6]C[6]2)	C[6](C[6]C[3x6]O)(C[6]C[6]C)(I){1|O<1>,3|C<4>}	C[6](C[3x6]C[3x6]2C)(C[6]C[6]I)(O){2|C<3>,2|H<1>,3|C<4>}	I(C[6]C[6]2)	113.8060	0.000	1	113.8060	0.000	1	113.8060	0.000	1	116.5357	8.010	18	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:I-1:	C[5,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6a]O[6])(C[6]C[5,6]O)(I)	C[6](C[5,6]C[5]2C[6])(C[6]C[6]I)(O)	I(C[6]C[6]2)	C[6](C[6]C[6a]O[6])(C[6]C[5,6]O)(I){2|C<3>,3|C<4>}	C[6](C[5,6]C[5]2C[6])(C[6]C[6]I)(O){1|O<2>,2|C<3>,2|C<4>,5|H<1>}	I(C[6]C[6]2)	114.7550	0.000	1	114.7550	0.000	1	114.7550	0.000	1	116.5357	8.010	18	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:I-1:	C[6,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]C)(I)	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]I)(O)	I(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]C)(I){1|O<1>,3|C<4>}	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]I)(O){2|C<3>,2|C<4>,3|H<1>}	I(C[6]C[6]2)	114.4180	0.725	2	114.4180	0.526	2	114.4180	0.526	2	116.5357	8.010	18	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:I-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(I)	C[6](C[6]C[6]HO)(C[6]C[6]I)(H)	I(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(I){1|O<2>,2|C<4>,2|H<1>}	C[6](C[6]C[6]HO)(C[6]C[6]I)(H){1|H<1>,1|O<1>,2|C<4>}	I(C[6]C[6]2)	121.9720	1.089	3	121.9720	1.186	3	121.9720	1.186	3	116.5357	8.010	18	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:I-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(I)	C[6](C[6]C[6]2H)(C[6]C[6]I)(O)	I(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(I){1|O<2>,2|C<4>,2|H<1>}	C[6](C[6]C[6]2H)(C[6]C[6]I)(O){1|C<3>,3|C<4>,3|H<1>}	I(C[6]C[6]2)	115.6867	0.544	4	115.6867	0.296	4	115.8482	1.982	11	116.5357	8.010	18	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:I-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(I)	C[6](C[6]C[6]HH)(C[6]C[6]I)(O)	I(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(I){1|C<4>,1|O<1>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]I)(O){1|C<3>,1|C<4>,2|H<1>}	I(C[6]C[6]2)	115.9020	0.000	1	115.9020	0.000	1	115.8482	1.982	11	116.5357	8.010	18	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:I-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]C[6]O)(I)	C[6](C[6]C[6]HH)(C[6]C[6]I)(O)	I(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]C[6]O)(I){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]I)(O){1|N<3>,3|C<4>}	I(C[6]C[6]2)	115.9140	0.000	1	115.9140	0.000	1	115.8482	1.982	11	116.5357	8.010	18	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:I-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(I)	C[6](C[6]C[6]HH)(C[6]C[6]I)(O)	I(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(I){1|C<3>,1|C<4>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]I)(O){1|C<4>,1|N<3>,2|H<1>}	I(C[6]C[6]2)	117.6735	0.152	2	117.6735	0.023	2	115.8482	1.982	11	116.5357	8.010	18	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:I-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]O)(I)	C[6](C[6]C[6]HH)(C[6]C[6]I)(O)	I(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]O)(I){1|C<4>,2|H<1>,3|C<3>}	C[6](C[6]C[6]HH)(C[6]C[6]I)(O){1|C<3>,1|C<4>,1|H<1>,1|N<3>}	I(C[6]C[6]2)	113.6170	0.621	2	113.6170	0.385	2	115.8482	1.982	11	116.5357	8.010	18	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:I-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6a]O[6])(C[6]C[6]O)(I)	C[6](C[6]C[6]HH)(C[6]C[6]I)(O)	I(C[6]C[6]2)	C[6](C[6]C[6a]O[6])(C[6]C[6]O)(I){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]I)(O){1|C<3>,1|O<2>,2|H<1>}	I(C[6]C[6]2)	117.1860	0.000	1	117.1860	0.000	1	115.8482	1.982	11	116.5357	8.010	18	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:I-1:	C[6]-4:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]O)(I)	C[6](C[6]C[5,6]HH)(C[6]C[6]I)(OC)	I(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(I){2|C<3>,2|H<1>}	C[6](C[6]C[5,6]HH)(C[6]C[6]I)(OC){1|C<3>,1|C<4>,1|H<1>}	I(C[6]C[6]2)	119.6080	0.000	1	119.6080	0.000	1	119.6080	0.000	1	119.6080	0.000	1	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:I-1:	C[6]-4:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]C[6]O)(I)	C[6](C[6]C[6]HH)(C[6]C[6]I)(NC[6a]H)	I(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]C[6]O)(I){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]I)(NC[6a]H){1|O<1>,3|C<4>}	I(C[6]C[6]2)	120.7030	0.000	1	120.7030	0.000	1	120.7030	0.000	1	120.7030	0.000	1	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	3:4:1:	3:3:2:	3:	C[6]-3:C[6]-4:I-1:	C[6,6a]-3:C[6]-3:Se-2:	C[6]-3:	C[6](C[6]C[6,6a]Se)(C[6]O[6]HH)(I)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]I)(SeC[6a])	I(C[6]C[6]2)	C[6](C[6]C[6,6a]Se)(C[6]O[6]HH)(I){2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]I)(SeC[6a]){1|O<2>,2|C<3>,3|H<1>}	I(C[6]C[6]2)	125.3160	0.000	1	125.3160	0.000	1	125.3160	0.000	1	125.3160	0.000	1	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	3:4:1:	3:3:3:	3:	C[6]-3:C[6]-4:I-1:	C[6,6a]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]C[6a])(C[6]O[6]HH)(I)	C[6](C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2)(C[6]C[6]I)	I(C[6]C[6]2)	C[6](C[6]C[6,6a]C[6a])(C[6]O[6]HH)(I){4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2)(C[6]C[6]I){1|O<2>,4|C<3>,5|H<1>}	I(C[6]C[6]2)	122.8030	0.000	1	122.8030	0.000	1	122.8030	0.000	1	122.8030	0.000	1	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	3:4:1:	3:4:3:	3:	C[6]-3:C[6]-4:I-1:	C[6,6a]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]C[6])(C[6]C[6]HO)(I)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6a]C[6]H)(C[6]C[6]I)	I(C[6]C[6]2)	C[6](C[6]C[6,6a]C[6])(C[6]C[6]HO)(I){1|C<4>,1|O<2>,2|H<1>,3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6a]C[6]H)(C[6]C[6]I){1|O<2>,2|C<4>,4|C<3>,4|H<1>}	I(C[6]C[6]2)	123.6730	0.000	1	123.6730	0.000	1	123.6730	0.000	1	123.6730	0.000	1	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	4:3:1:	3:2:1:	3:	C[6]-4:C[6]-3:I-1:	C[6]-3:O[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]HO)(C[6]O[6]H)(I)	C[6](C[6]C[6]I)(O[6]C[6])(H)	I(C[6]C[6]2)	C[6](C[6]C[6]HO)(C[6]O[6]H)(I){1|C<4>,1|H<1>,1|O<2>}	C[6](C[6]C[6]I)(O[6]C[6])(H){1|O<2>,2|C<4>,2|H<1>}	I(C[6]C[6]2)	119.2440	0.000	1	119.2440	0.000	1	119.2440	0.000	1	119.2440	0.000	1	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:I-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6a]2C[5a,6])(C[6]C[6,6a]H)(I)	C[6](C[6,6a]C[5a,6,6a]C[6a])(C[6]C[5,6]I)(H)	I(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6a]2C[5a,6])(C[6]C[6,6a]H)(I){7|C<3>}	C[6](C[6,6a]C[5a,6,6a]C[6a])(C[6]C[5,6]I)(H){1|O<2>,5|C<3>}	I(C[6]C[5,6]C[6])	116.7500	0.000	1	116.7500	0.000	1	116.7500	0.000	1	118.3320	5.005	2	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:I-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HO)(C[6]C[6]H)(I)	C[6](C[6]C[6]I)(C[6]C[6]O)(H)	I(C[6]C[6]2)	C[6](C[6]C[6]HO)(C[6]C[6]H)(I){1|C<4>,1|H<1>,1|O<1>,1|O<2>}	C[6](C[6]C[6]I)(C[6]C[6]O)(H){1|C<4>,1|O<2>,3|H<1>}	I(C[6]C[6]2)	119.9140	0.000	1	119.9140	0.000	1	119.9140	0.000	1	118.3320	5.005	2	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	4:3:1:	3:4:1:	3:	C[5,6]-4:C[6]-3:I-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]O[5]H)(C[6]C[6]H)(I)	C[6](C[6]C[5,6]I)(C[6]C[6]HO)(H)	I(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]O[5]H)(C[6]C[6]H)(I){2|C<4>,2|H<1>,2|O<2>}	C[6](C[6]C[5,6]I)(C[6]C[6]HO)(H){1|C<4>,2|H<1>,2|O<2>}	I(C[6]C[5,6]C[6])	120.0875	0.446	2	120.0875	0.199	2	120.0875	0.199	2	120.0875	0.199	2	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	4:3:1:	4:3:1:	3:	C[5,6]-4:C[6]-3:I-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6,6]C[5]H)(C[6]C[6,6]H)(I)	C[6](C[6,6]C[5,6,6]C[6]H)(C[6]C[5,6]I)(H)	I(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6,6]C[5]H)(C[6]C[6,6]H)(I){1|C<3>,1|O<2>,3|C<4>,3|H<1>}	C[6](C[6,6]C[5,6,6]C[6]H)(C[6]C[5,6]I)(H){1|C<3>,3|C<4>,4|H<1>}	I(C[6]C[5,6]C[6])	120.9480	0.000	1	122.8413	8.516	3	122.8413	8.516	3	120.9122	7.020	14	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	4:3:1:	4:3:1:	3:	C[5,6]-4:C[6]-3:I-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6,6]C[5]H)(C[6]C[6,6]H)(I)	C[6](C[6,6]C[5,6,6]C[6]H)(C[6]C[5,6]I)(H)	I(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6,6]C[5]H)(C[6]C[6,6]H)(I){1|C<4>,1|O<2>,3|C<3>,3|H<1>}	C[6](C[6,6]C[5,6,6]C[6]H)(C[6]C[5,6]I)(H){1|Br<1>,2|C<3>,2|C<4>,2|H<1>}	I(C[6]C[5,6]C[6])	123.7880	3.414	2	122.8413	8.516	3	122.8413	8.516	3	120.9122	7.020	14	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	4:3:1:	4:3:1:	3:	C[5,6]-4:C[6]-3:I-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]O[5]H)(C[6]C[6]H)(I)	C[6](C[6]C[6]ClH)(C[6]C[5,6]I)(H)	I(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]O[5]H)(C[6]C[6]H)(I){1|Cl<1>,1|O<2>,2|C<4>,2|H<1>}	C[6](C[6]C[6]ClH)(C[6]C[5,6]I)(H){1|C<4>,2|H<1>,2|O<2>}	I(C[6]C[5,6]C[6])	119.6830	0.000	1	119.6830	0.000	1	119.6830	0.000	1	120.9122	7.020	14	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:I-1:	C[6]-4:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[5a,6]C[6a]2)(C[6]C[6]Br)(I)	C[6](C[6]N[5a,6]HH)(C[6]C[6]I)(Br)	I(C[6]C[6]2)	C[6](C[6]C[5a,6]C[6a]2)(C[6]C[6]Br)(I){1|N<3>,2|H<1>,5|C<3>}	C[6](C[6]N[5a,6]HH)(C[6]C[6]I)(Br){4|C<3>}	I(C[6]C[6]2)	121.0540	0.000	1	121.0540	0.000	1	121.0540	0.000	1	120.9122	7.020	14	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:I-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[3,6]C[6]O)(C[6]C[6]H)(I)	C[6](C[6]C[6]CC)(C[6]C[6]I)(H)	I(C[6]C[6]2)	C[6](C[6]C[3,6]C[6]O)(C[6]C[6]H)(I){1|C<3>,2|H<1>,5|C<4>}	C[6](C[6]C[6]CC)(C[6]C[6]I)(H){1|O<2>,2|C<4>,2|H<1>}	I(C[6]C[6]2)	117.6705	0.233	2	117.6705	0.054	2	119.6130	5.183	7	120.9122	7.020	14	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:I-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]ClH)(C[6]C[6]H)(I)	C[6](C[6]C[6]HH)(C[6]C[6]I)(H)	I(C[6]C[6]2)	C[6](C[6]C[6]ClH)(C[6]C[6]H)(I){1|C<4>,1|O<2>,3|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]I)(H){1|Cl<1>,1|C<4>,3|H<1>}	I(C[6]C[6]2)	119.2390	0.000	1	119.2390	0.000	1	119.6130	5.183	7	120.9122	7.020	14	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:I-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(I)	C[6](C[6]C[6]HO)(C[6]C[6]I)(H)	I(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(I){1|C<4>,1|N<3>,1|O<2>,2|H<1>}	C[6](C[6]C[6]HO)(C[6]C[6]I)(H){1|C<4>,1|N<3>,3|H<1>}	I(C[6]C[6]2)	124.2860	0.000	1	124.2860	0.000	1	119.6130	5.183	7	120.9122	7.020	14	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:I-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HO)(C[6]C[6]H)(I)	C[6](C[6]C[6]HH)(C[6]C[6]I)(H)	I(C[6]C[6]2)	C[6](C[6]C[6]HO)(C[6]C[6]H)(I){2|C<4>,3|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]I)(H){1|C<4>,2|H<1>,2|O<2>}	I(C[6]C[6]2)	120.3190	0.000	1	120.3190	0.000	1	119.6130	5.183	7	120.9122	7.020	14	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:I-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HO)(C[6]C[6]H)(I)	C[6](C[6]C[6]HO)(C[6]C[6]I)(H)	I(C[6]C[6]2)	C[6](C[6]C[6]HO)(C[6]C[6]H)(I){1|C<4>,2|H<1>,2|O<2>}	C[6](C[6]C[6]HO)(C[6]C[6]I)(H){1|C<4>,2|H<1>,2|O<2>}	I(C[6]C[6]2)	119.0530	0.628	2	119.0530	0.394	2	119.6130	5.183	7	120.9122	7.020	14	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:I-1:	C[6]-4:C[6]-3:I-1:	C[6]-3:	C[6](C[6]C[5a,6]C[6a]2)(C[6]C[6]I)(I)	C[6](C[6]N[5a,6]HH)(C[6]C[6]I)(I)	I(C[6]C[6]2)	C[6](C[6]C[5a,6]C[6a]2)(C[6]C[6]I)(I){1|N<3>,2|H<1>,5|C<3>}	C[6](C[6]N[5a,6]HH)(C[6]C[6]I)(I){4|C<3>}	I(C[6]C[6]2)	120.9920	0.000	1	120.9920	0.000	1	123.1095	8.968	2	120.9122	7.020	14	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:I-1:	C[6]-4:C[6]-3:I-1:	C[6]-3:	C[6](C[6]N[5a,6]HH)(C[6]C[6]I)(I)	C[6](C[6]C[5a,6]C[6a]2)(C[6]C[6]I)(I)	I(C[6]C[6]2)	C[6](C[6]N[5a,6]HH)(C[6]C[6]I)(I){4|C<3>}	C[6](C[6]C[5a,6]C[6a]2)(C[6]C[6]I)(I){1|N<3>,2|H<1>,5|C<3>}	I(C[6]C[6]2)	125.2270	0.000	1	125.2270	0.000	1	123.1095	8.968	2	120.9122	7.020	14	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	4:3:1:	4:3:3:	3:	C[6]-4:C[6]-3:I-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]CC)(C[6]C[6]C)(I)	C[6](C[6]C[6]HO)(C[6]C[6]I)(CCO)	I(C[6]C[6]2)	C[6](C[6]C[6]CC)(C[6]C[6]C)(I){1|O<2>,2|C<4>,2|H<1>}	C[6](C[6]C[6]HO)(C[6]C[6]I)(CCO){2|H<1>,3|C<4>}	I(C[6]C[6]2)	118.0260	0.000	1	118.0260	0.000	1	121.8975	29.977	2	121.8975	29.977	2	119.9334	4.541	383	119.9710	4.636	387
762	762	944	0:SP2_SP-NON_SP2	C[6]	C[6]	I	4:3:1:	4:3:3:	3:	C[6]-4:C[6]-3:I-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]HO)(C[6]C[6]C)(I)	C[6](C[6]C[6]HO)(C[6]C[6]I)(COO)	I(C[6]C[6]2)	C[6](C[6]C[6]HO)(C[6]C[6]C)(I){1|C<4>,1|O<2>,3|H<1>}	C[6](C[6]C[6]HO)(C[6]C[6]I)(COO){1|C<4>,2|H<1>,2|O<2>}	I(C[6]C[6]2)	125.7690	0.000	1	125.7690	0.000	1	121.8975	29.977	2	121.8975	29.977	2	119.9334	4.541	383	119.9710	4.636	387
762	762	945	0:SP2_SP2_SP3	C[6]	C[6]	P	3:2:3:	3:3:3:	3:3:3:	C[6]-3:C[6]-2:P-3:	C[6,6]-3:C[5a]-3:C[6]-3:	C[6]-3:C[6]-3:C[6]-3:	C[6](C[6]C[6,6]C[5a])(C[6]C[6])(PC[6]2)	C[6](C[6,6]C[6,6]C[6])(C[5a]N[5a]2)(C[6]C[6]P)	P(C[6]C[6]2)3	C[6](C[6]C[6,6]C[5a])(C[6]C[6])(PC[6]2){1|C<2>,1|C<3>,1|N<2>,1|N<3>}	C[6](C[6,6]C[6,6]C[6])(C[5a]N[5a]2)(C[6]C[6]P){2|C<3>,4|C<2>}	P(C[6]C[6]2)3	118.4190	0.000	1	118.4190	0.000	1	118.4190	0.000	1	118.4190	0.000	1	120.9802	16.932	60	120.9802	16.932	60
762	762	945	0:SP2_SP2_SP3	C[6]	C[6]	P	3:2:3:	3:3:4:	3:3:3:	C[6]-3:P[6]-2:P-3:	C[6]-3:C[6]-3:C-4:	C[6]-3:C[6a]-3:C[6a]-3:	C[6](C[6]C[6]C)(P[6]C[6])(PC[6a]2)	C[6](C[6]C[6]H)(C[6]P[6]P)(CH3)	P(C[6]C[6]P[6])(C[6a]C[6a]2)2	C[6](C[6]C[6]C)(P[6]C[6])(PC[6a]2){1|C<3>,1|H<1>,1|P<3>}	C[6](C[6]C[6]H)(C[6]P[6]P)(CH3){1|C<3>,1|C<4>}	P(C[6]C[6]P[6])(C[6a]C[6a]2)2	117.5765	0.360	2	117.0633	0.855	3	117.0633	0.855	3	117.0633	0.855	3	120.9802	16.932	60	120.9802	16.932	60
762	762	945	0:SP2_SP2_SP3	C[6]	C[6]	P	3:2:3:	3:3:4:	3:3:3:	C[6]-3:P[6]-2:P-3:	C[6]-3:C[6]-3:C-4:	C[6]-3:C[6a]-3:C[6a]-3:	C[6](C[6]C[6]C)(P[6]C[6])(PC[6a]2)	C[6](C[6]C[6]H)(C[6]P[6]P)(CH3)	P(C[6]C[6]P[6])(C[6a]C[6a]2)2	C[6](C[6]C[6]C)(P[6]C[6])(PC[6a]2){1|Si<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]P[6]P)(CH3){1|C<3>,1|H<1>}	P(C[6]C[6]P[6])(C[6a]C[6a]2)2	116.0370	0.000	1	117.0633	0.855	3	117.0633	0.855	3	117.0633	0.855	3	120.9802	16.932	60	120.9802	16.932	60
762	762	945	0:SP2_SP2_SP3	C[6]	C[6]	P	3:3:2:	3:3:1:	3:3:3:	P-3:C[6]-3:C[6]-2:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6](PC[6a]C[6])(C[6]C[6]H)(C[6]C[6])	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	P(C[6a]C[6a]2)(C[6]C[6]2)2	C[6](PC[6a]C[6])(C[6]C[6]H)(C[6]C[6]){1|C<2>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<2>}	P(C[6a]C[6a]2)(C[6]C[6]2)2	122.6700	0.000	1	122.6700	0.000	1	122.6700	0.000	1	122.6700	0.000	1	120.9802	16.932	60	120.9802	16.932	60
762	762	945	0:SP2_SP2_SP3	C[6]	C[6]	P	3:3:3:	3:2:1:	3:3:4:	C[6]-3:C[6]-3:P-3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:C-4:	C[6](C[6]C[6]H)2(PC[6]C)	C[6](C[6]C[6]P)(C[6]C[6])(H)	P(C[6]C[6]2)2(CHHP)	C[6](C[6]C[6]H)2(PC[6]C){1|C<3>,1|H<1>}	C[6](C[6]C[6]P)(C[6]C[6])(H){1|C<3>,2|H<1>}	P(C[6]C[6]2)2(CHHP)	118.2770	0.000	1	118.2770	0.000	1	118.2770	0.000	1	118.2770	0.000	1	120.9802	16.932	60	120.9802	16.932	60
762	762	945	0:SP2_SP2_SP3	C[6]	C[6]	P	3:3:3:	3:3:1:	3:1:1:	N[6]-3:C[6]-3:P-3:	C[6]-3:C[6]-3:H-1:	C[6]-3:Cl-1:Cl-1:	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(PCl2)	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	P(C[6]C[6]N[6])(Cl)2	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(PCl2){1|N<2>,2|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|H<1>,2|C<3>}	P(C[6]C[6]N[6])(Cl)2	124.5930	0.000	1	124.5930	0.000	1	124.5930	0.000	1	124.5930	0.000	1	120.9802	16.932	60	120.9802	16.932	60
762	762	945	0:SP2_SP2_SP3	C[6]	C[6]	P	3:3:3:	3:3:1:	3:3:2:	N[6]-3:C[6]-3:P-3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6](N[6]C[6]Li)(C[6]C[6]H)(PC[6]O)	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	P(C[6]C[6]N[6])2(OC)	C[6](N[6]C[6]Li)(C[6]C[6]H)(PC[6]O){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Li<4>,1|C<3>,1|H<1>}	P(C[6]C[6]N[6])2(OC)	123.8470	0.123	2	123.8470	0.015	2	123.8470	0.015	2	123.8470	0.015	2	120.9802	16.932	60	120.9802	16.932	60
762	762	945	0:SP2_SP2_SP3	C[6]	C[6]	P	3:3:3:	3:3:1:	3:3:3:	C[6]-3:C[6]-3:P-3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6a]-3:C[6]-3:	C[6](C[6]C[6]H)2(PC[6a]2)	C[6](C[6]C[6]C)(C[6]C[6]P)(H)	P(C[6a]C[6a]2)2(C[6]C[6]2)	C[6](C[6]C[6]H)2(PC[6a]2){1|C<3>,2|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]P)(H){1|C<3>,1|H<1>,1|O<1>}	P(C[6a]C[6a]2)2(C[6]C[6]2)	120.6565	7.069	2	120.6565	49.970	2	120.6565	49.970	2	120.2280	15.971	36	120.9802	16.932	60	120.9802	16.932	60
762	762	945	0:SP2_SP2_SP3	C[6]	C[6]	P	3:3:3:	3:3:1:	3:3:3:	N[5,6]-3:C[6]-3:P-3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6a]-3:C[6a]-3:	C[6](N[5,6]C[5,6]Ga[5])(C[6]C[6]H)(PC[6a]2)	C[6](C[6]N[5,6]P)(C[6]C[6]H)(H)	P(C[6]N[5,6]C[6])(C[6a]C[6a]2)2	C[6](N[5,6]C[5,6]Ga[5])(C[6]C[6]H)(PC[6a]2){2|Cl<1>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]N[5,6]P)(C[6]C[6]H)(H){1|Ga<4>,1|C<3>,1|H<1>}	P(C[6]N[5,6]C[6])(C[6a]C[6a]2)2	122.3040	0.641	2	122.3040	0.410	2	124.6940	7.755	4	120.2280	15.971	36	120.9802	16.932	60	120.9802	16.932	60
762	762	945	0:SP2_SP2_SP3	C[6]	C[6]	P	3:3:3:	3:3:1:	3:3:3:	N[5,6]-3:C[6]-3:P-3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6a]-3:C[6a]-3:	C[6](N[5,6]In[5,5]C[5,6])(C[6]C[6]H)(PC[6a]2)	C[6](C[6]N[5,6]P)(C[6]C[6]H)(H)	P(C[6]N[5,6]C[6])(C[6a]C[6a]2)2	C[6](N[5,6]In[5,5]C[5,6])(C[6]C[6]H)(PC[6a]2){2|Cl<1>,1|H<1>,2|C<3>,2|N<3>}	C[6](C[6]N[5,6]P)(C[6]C[6]H)(H){1|In<5>,1|C<3>,1|H<1>}	P(C[6]N[5,6]C[6])(C[6a]C[6a]2)2	127.0840	0.082	2	127.0840	0.007	2	124.6940	7.755	4	120.2280	15.971	36	120.9802	16.932	60	120.9802	16.932	60
762	762	945	0:SP2_SP2_SP3	C[6]	C[6]	P	3:3:3:	3:3:1:	3:3:3:	N[6]-3:C[6]-3:P-3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6](N[6]C[6]Fe)(C[6]C[6]H)(PC[6]2)	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	P(C[6]C[6]N[6])3	C[6](N[6]C[6]Fe)(C[6]C[6]H)(PC[6]2){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Fe<6>,1|C<3>,1|H<1>}	P(C[6]C[6]N[6])3	117.6233	0.433	12	117.6233	0.187	12	116.7336	3.596	15	120.2280	15.971	36	120.9802	16.932	60	120.9802	16.932	60
762	762	945	0:SP2_SP2_SP3	C[6]	C[6]	P	3:3:3:	3:3:1:	3:3:3:	N[6]-3:C[6]-3:P-3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6](N[6]C[6]Mo)(C[6]C[6]H)(PC[6]2)	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	P(C[6]C[6]N[6])3	C[6](N[6]C[6]Mo)(C[6]C[6]H)(PC[6]2){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Mo<6>,1|C<3>,1|H<1>}	P(C[6]C[6]N[6])3	113.1747	0.628	3	113.1747	0.394	3	116.7336	3.596	15	120.2280	15.971	36	120.9802	16.932	60	120.9802	16.932	60
762	762	945	0:SP2_SP2_SP3	C[6]	C[6]	P	3:3:3:	3:3:1:	3:3:3:	N[6]-3:C[6]-3:P-3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6](N[6]C[6]Li)(C[6]C[6]H)(PC[6]N)	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	P(C[6]C[6]N[6])2(NCC)	C[6](N[6]C[6]Li)(C[6]C[6]H)(PC[6]N){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Li<4>,1|C<3>,1|H<1>}	P(C[6]C[6]N[6])2(NCC)	122.3895	0.060	2	122.3895	0.004	2	122.3895	0.004	2	120.2280	15.971	36	120.9802	16.932	60	120.9802	16.932	60
762	762	945	0:SP2_SP2_SP3	C[6]	C[6]	P	3:3:3:	3:3:1:	3:3:3:	N[6]-3:C[6]-3:P-3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6a]-3:C[6a]-3:	C[6](N[6]C[6]Fe)(C[6]C[6]H)(PC[6a]2)	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	P(C[6]C[6]N[6])(C[6a]C[6a]2)2	C[6](N[6]C[6]Fe)(C[6]C[6]H)(PC[6a]2){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Fe<4>,1|C<3>,1|H<1>}	P(C[6]C[6]N[6])(C[6a]C[6a]2)2	125.9260	0.723	2	125.9260	0.522	2	124.3950	3.708	5	120.2280	15.971	36	120.9802	16.932	60	120.9802	16.932	60
762	762	945	0:SP2_SP2_SP3	C[6]	C[6]	P	3:3:3:	3:3:1:	3:3:3:	N[6]-3:C[6]-3:P-3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6a]-3:C[6a]-3:	C[6](N[6]C[6]Re)(C[6]C[6]H)(PC[6a]2)	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	P(C[6]C[6]N[6])(C[6a]C[6a]2)2	C[6](N[6]C[6]Re)(C[6]C[6]H)(PC[6a]2){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Re<6>,1|C<3>,1|H<1>}	P(C[6]C[6]N[6])(C[6a]C[6a]2)2	121.3020	0.000	1	121.3020	0.000	1	124.3950	3.708	5	120.2280	15.971	36	120.9802	16.932	60	120.9802	16.932	60
762	762	945	0:SP2_SP2_SP3	C[6]	C[6]	P	3:3:3:	3:3:1:	3:3:3:	N[6]-3:C[6]-3:P-3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6a]-3:C[6a]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(PC[6a]2)	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	P(C[6]C[6]N[6])(C[6a]C[6a]2)2	C[6](N[6]C[6]Zn)(C[6]C[6]H)(PC[6a]2){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Zn<4>,1|C<3>,1|H<1>}	P(C[6]C[6]N[6])(C[6a]C[6a]2)2	124.2480	0.000	1	124.2480	0.000	1	124.3950	3.708	5	120.2280	15.971	36	120.9802	16.932	60	120.9802	16.932	60
762	762	945	0:SP2_SP2_SP3	C[6]	C[6]	P	3:3:3:	3:3:1:	3:3:3:	N[6]-3:C[6]-3:P-3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6a]-3:C[6a]-3:	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(PC[6a]2)	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	P(C[6]C[6]N[6])(C[6a]C[6a]2)2	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(PC[6a]2){2|H<1>,3|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|H<1>,2|C<3>}	P(C[6]C[6]N[6])(C[6a]C[6a]2)2	124.5730	0.000	1	124.5730	0.000	1	124.3950	3.708	5	120.2280	15.971	36	120.9802	16.932	60	120.9802	16.932	60
762	762	945	0:SP2_SP2_SP3	C[6]	C[6]	P	3:3:3:	3:3:1:	3:3:3:	N[6]-3:C[6]-3:P-3:	C[6]-3:C[6]-3:H-1:	N[5a]-3:N[5a]-3:C[6]-3:	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(PN[5a]2)	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	P(N[5a]C[5a]N[5a])2(C[6]C[6]N[6])	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(PN[5a]2){1|N<2>,2|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|H<1>,2|C<3>}	P(N[5a]C[5a]N[5a])2(C[6]C[6]N[6])	120.7715	0.301	2	120.7715	0.090	2	120.7715	0.090	2	120.2280	15.971	36	120.9802	16.932	60	120.9802	16.932	60
762	762	945	0:SP2_SP2_SP3	C[6]	C[6]	P	3:3:3:	3:3:1:	3:3:3:	P-3:C[6]-3:C[6]-3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6](PC[6a]C[6])(C[6]C[6]H)2	C[6](C[6]C[6]C)(C[6]C[6]P)(H)	P(C[6a]C[6a]2)(C[6]C[6]2)2	C[6](PC[6a]C[6])(C[6]C[6]H)2{1|C<4>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]P)(H){1|C<3>,1|H<1>,1|O<2>}	P(C[6a]C[6a]2)(C[6]C[6]2)2	120.9000	3.967	4	120.9000	15.737	4	120.9000	15.737	4	120.2280	15.971	36	120.9802	16.932	60	120.9802	16.932	60
762	762	945	0:SP2_SP2_SP3	C[6]	C[6]	P	3:3:3:	3:3:1:	3:3:3:	P-3:C[6]-3:N[6]-3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6](PC[6a]C[6])(C[6]C[6]H)(N[6]C[6]W)	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	P(C[6a]C[6a]N[6a])(C[6]C[6]N[6])2	C[6](PC[6a]C[6])(C[6]C[6]H)(N[6]C[6]W){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|C<3>,1|H<1>,1|W<6>}	P(C[6a]C[6a]N[6a])(C[6]C[6]N[6])2	122.6085	0.289	2	122.6085	0.084	2	122.6085	0.084	2	120.2280	15.971	36	120.9802	16.932	60	120.9802	16.932	60
762	762	945	0:SP2_SP2_SP3	C[6]	C[6]	P	3:3:3:	3:3:1:	3:3:4:	C[6]-3:C[6]-3:P-3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6](C[6]C[6]H)2(PC[6]C)	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	P(C[6]C[6]2)2(CHHP)	C[6](C[6]C[6]H)2(PC[6]C){1|C<2>,2|H<1>}	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<3>,1|H<1>}	P(C[6]C[6]2)2(CHHP)	120.5890	5.076	2	121.2843	14.331	3	121.2843	14.331	3	121.2843	14.331	3	120.9802	16.932	60	120.9802	16.932	60
762	762	945	0:SP2_SP2_SP3	C[6]	C[6]	P	3:3:3:	3:3:1:	3:3:4:	C[6]-3:C[6]-3:P-3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6](C[6]C[6]H)2(PC[6]C)	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	P(C[6]C[6]2)2(CHHP)	C[6](C[6]C[6]H)2(PC[6]C){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<2>,2|H<1>}	P(C[6]C[6]2)2(CHHP)	122.6750	0.000	1	121.2843	14.331	3	121.2843	14.331	3	121.2843	14.331	3	120.9802	16.932	60	120.9802	16.932	60
762	762	945	0:SP2_SP2_SP3	C[6]	C[6]	P	3:3:3:	3:3:1:	3:4:3:	C[6]-3:C[6]-3:P-3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C-4:C-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(PCC)	C[6](C[6]C[6]C)(C[6]C[6]P)(H)	P(C[6]C[6]2)(CCCH)(CCC)	C[6](C[6]C[6]H)(C[6]C[6]N)(PCC){1|H<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]P)(H){1|C<3>,1|H<1>,1|N<2>}	P(C[6]C[6]2)(CCCH)(CCC)	121.4640	0.000	1	121.4640	0.000	1	121.4640	0.000	1	121.4640	0.000	1	120.9802	16.932	60	120.9802	16.932	60
762	762	945	0:SP2_SP2_SP3	C[6]	C[6]	P	3:3:3:	3:3:1:	3:4:4:	C[6]-3:C[6]-3:P-3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C-4:C-4:	C[6](C[6]C[6]H)(C[6]C[6]N)(PCC)	C[6](C[6]C[6]C)(C[6]C[6]P)(H)	P(C[6]C[6]2)(CCCH)2	C[6](C[6]C[6]H)(C[6]C[6]N)(PCC){1|H<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]P)(H){1|C<3>,1|H<1>,1|N<2>}	P(C[6]C[6]2)(CCCH)2	123.4380	0.000	1	123.4380	0.000	1	123.4380	0.000	1	125.0450	21.111	6	120.9802	16.932	60	120.9802	16.932	60
762	762	945	0:SP2_SP2_SP3	C[6]	C[6]	P	3:3:3:	3:3:1:	3:4:4:	N[6]-3:C[6]-3:P-3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:C[6]-4:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(PC[6]2)	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	P(C[6]C[6]N[6])(C[6]C[6]2H)2	C[6](N[6]C[6]Zn)(C[6]C[6]H)(PC[6]2){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Zn<5>,1|C<3>,1|H<1>}	P(C[6]C[6]N[6])(C[6]C[6]2H)2	127.5662	1.375	4	127.5662	1.890	4	127.5662	1.890	4	125.0450	21.111	6	120.9802	16.932	60	120.9802	16.932	60
762	762	945	0:SP2_SP2_SP3	C[6]	C[6]	P	3:3:3:	3:3:1:	3:4:4:	N[6]-3:C[6]-3:P-3:	C[6]-3:C[6]-3:H-1:	C[6]-3:P-4:P-4:	C[6](N[6]C[6]Ag)(C[6]C[6]H)(PPP)	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	P(C[6]C[6]N[6])(PC[6]2Ag)2	C[6](N[6]C[6]Ag)(C[6]C[6]H)(PPP){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Ag<4>,1|C<3>,1|H<1>}	P(C[6]C[6]N[6])(PC[6]2Ag)2	116.5670	0.000	1	116.5670	0.000	1	116.5670	0.000	1	125.0450	21.111	6	120.9802	16.932	60	120.9802	16.932	60
762	762	945	0:SP2_SP2_SP3	C[6]	C[6]	P	3:3:3:	3:3:2:	3:4:3:	C[6]-3:C[6]-3:P-3:	C[6]-3:C[6]-3:N-2:	C[6]-3:C-4:C-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(PCC)	C[6](C[6]C[6]H)(C[6]C[6]P)(NC[6])	P(C[6]C[6]2)(CCCH)(CCC)	C[6](C[6]C[6]H)(C[6]C[6]N)(PCC){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]C[6]P)(NC[6]){1|C<3>,2|H<1>}	P(C[6]C[6]2)(CCCH)(CCC)	118.7310	0.000	1	118.7310	0.000	1	118.7310	0.000	1	118.7310	0.000	1	120.9802	16.932	60	120.9802	16.932	60
762	762	945	0:SP2_SP2_SP3	C[6]	C[6]	P	3:3:3:	3:3:2:	3:4:4:	C[6]-3:C[6]-3:P-3:	C[6]-3:C[6]-3:N-2:	C[6]-3:C-4:C-4:	C[6](C[6]C[6]H)(C[6]C[6]N)(PCC)	C[6](C[6]C[6]H)(C[6]C[6]P)(NC[6])	P(C[6]C[6]2)(CCCH)2	C[6](C[6]C[6]H)(C[6]C[6]N)(PCC){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]C[6]P)(NC[6]){1|C<3>,2|H<1>}	P(C[6]C[6]2)(CCCH)2	117.6210	0.000	1	117.6210	0.000	1	117.6210	0.000	1	117.6210	0.000	1	120.9802	16.932	60	120.9802	16.932	60
762	762	945	0:SP2_SP2_SP3	C[6]	C[6]	P	4:3:3:	3:3:1:	3:4:4:	C[6]-4:C[6]-3:P-3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C-4:C-4:	C[6](C[6]C[6]TiN)(C[6]C[6]H)(PCC)	C[6](C[6]C[6]C)(C[6]C[6]P)(H)	P(C[6]C[6]2)(CCCH)2	C[6](C[6]C[6]TiN)(C[6]C[6]H)(PCC){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]C[6]P)(H){1|Ti<6>,1|C<3>,1|H<1>,1|N<3>}	P(C[6]C[6]2)(CCCH)2	123.8200	0.000	1	123.8200	0.000	1	123.8200	0.000	1	123.8200	0.000	1	120.9802	16.932	60	120.9802	16.932	60
762	762	945	0:SP2_SP2_SP3	C[6]	C[6]	P	4:3:3:	3:3:3:	3:3:3:	P[6]-4:C[6]-3:P-3:	C[6]-3:N[6]-3:N-3:	C[6]-3:C[6a]-3:C[6a]-3:	C[6](P[6]C[6a]2N[6])(C[6]N[6]N)(PC[6a]2)	C[6](C[6]P[6]P)(N[6]B[6]H)(NC[6a]H)	P(C[6]C[6]P[6])(C[6a]C[6a]2)2	C[6](P[6]C[6a]2N[6])(C[6]N[6]N)(PC[6a]2){1|B<4>,1|H<1>,5|C<3>}	C[6](C[6]P[6]P)(N[6]B[6]H)(NC[6a]H){1|N<3>,4|C<3>}	P(C[6]C[6]P[6])(C[6a]C[6a]2)2	128.9130	0.000	1	128.9130	0.000	1	128.9130	0.000	1	128.9130	0.000	1	120.9802	16.932	60	120.9802	16.932	60
762	762	945	0:SP2_SP2_SP3	C[6]	C[6]	P	4:3:3:	4:3:3:	3:3:2:	B[6]-4:C[6]-3:P-3:	P[6]-4:C[6a]-3:C[6]-3:	C[6]-3:C[6a]-3:C-2:	C[6](B[6]C[6a]2C[6])(C[6]C[6a]P[6])(PC[6a]C)	C[6](P[6]C[6a]2C[6])(C[6a]C[6a]2)(C[6]B[6]P)	P(C[6]B[6]C[6])(C[6a]C[6a]2)(CC)	C[6](B[6]C[6a]2C[6])(C[6]C[6a]P[6])(PC[6a]C){1|C<4>,2|H<1>,8|C<3>}	C[6](P[6]C[6a]2C[6])(C[6a]C[6a]2)(C[6]B[6]P){1|C<4>,4|H<1>,8|C<3>}	P(C[6]B[6]C[6])(C[6a]C[6a]2)(CC)	123.0890	0.000	1	123.0890	0.000	1	123.0890	0.000	1	123.0890	0.000	1	120.9802	16.932	60	120.9802	16.932	60
762	762	950	0:SP2_SP2_SPD5	C[6]	C[6]	P	5:3:3:	3:3:1:	3:3:3:1:1:	P-5:C[6]-3:N[6]-3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6a]-3:C[6a]-3:F-1:F-1:	C[6](PC[6a]2FF)(C[6]C[6]H)(N[6]C[6]C)	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	P(C[6]C[6]N[6])(C[6a]C[6a]2)2(F)2	C[6](PC[6a]2FF)(C[6]C[6]H)(N[6]C[6]C){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|C<3>,1|C<4>,1|H<1>}	P(C[6]C[6]N[6])(C[6a]C[6a]2)2(F)2	116.5550	0.000	1	116.5550	0.000	1	116.5550	0.000	1	116.5550	0.000	1	116.5550	0.000	1	116.5550	0.000	1
762	762	951	0:SP2_SP-NON_SP2	C[3x6]	C[3x6]	H	4:3:1:	4:3:1:	3:	C[4,3x6]-4:C[3x6]-3:H-1:	C[4,3x6]-4:C[3x6]-3:H-1:	C[3x6]-3:	C[3x6](C[4,3x6]C[4,4,6,6]C[4,6]C)(C[3x6]C[4,3x6]H)(H)	C[3x6](C[4,3x6]C[4,4,6,6]C[4,6]C)(C[3x6]C[4,3x6]H)(H)	H(C[3x6]C[4,3x6]C[3x6])	C[3x6](C[4,3x6]C[4,4,6,6]C[4,6]C)(C[3x6]C[4,3x6]H)(H){1|C<2>,1|C<3>,1|C<4>}	C[3x6](C[4,3x6]C[4,4,6,6]C[4,6]C)(C[3x6]C[4,3x6]H)(H){1|C<2>,2|C<3>}	H(C[3x6]C[4,3x6]C[3x6])	114.9600	0.000	1	119.3120	37.880	2	119.3120	37.880	2	119.3120	37.880	2	119.3120	37.880	2	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[3x6]	C[3x6]	H	4:3:1:	4:3:1:	3:	C[4,3x6]-4:C[3x6]-3:H-1:	C[4,3x6]-4:C[3x6]-3:H-1:	C[3x6]-3:	C[3x6](C[4,3x6]C[4,4,6,6]C[4,6]C)(C[3x6]C[4,3x6]H)(H)	C[3x6](C[4,3x6]C[4,4,6,6]C[4,6]C)(C[3x6]C[4,3x6]H)(H)	H(C[3x6]C[4,3x6]C[3x6])	C[3x6](C[4,3x6]C[4,4,6,6]C[4,6]C)(C[3x6]C[4,3x6]H)(H){1|C<2>,2|C<3>}	C[3x6](C[4,3x6]C[4,4,6,6]C[4,6]C)(C[3x6]C[4,3x6]H)(H){1|C<2>,1|C<3>,1|C<4>}	H(C[3x6]C[4,3x6]C[3x6])	123.6640	0.000	1	119.3120	37.880	2	119.3120	37.880	2	119.3120	37.880	2	119.3120	37.880	2	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[3x6]	H	3:4:1:	4:3:3:	3:	C[3x6]-3:C[3x6]-4:H-1:	C[5,4x6]-4:C[6,6]-3:C[6]-3:	C[6,6]-3:	C[6,6](C[3x6]C[5,4x6]C[6])(C[3x6]C[6,6]2H)(H)	C[3x6](C[5,4x6]C[5,6,6]2O[6])(C[6,6]C[3x6]H)(C[6]C[6,6a]O)	H(C[6,6]C[3x6]2)	C[6,6](C[3x6]C[5,4x6]C[6])(C[3x6]C[6,6]2H)(H){1|C<3>,1|O<2>,2|C<4>,2|H<1>,2|O<1>}	C[3x6](C[5,4x6]C[5,6,6]2O[6])(C[6,6]C[3x6]H)(C[6]C[6,6a]O){1|O<2>,2|H<1>,3|C<3>,3|C<4>}	H(C[6,6]C[3x6]2)	122.7110	0.000	1	122.7110	0.000	1	122.8520	0.032	4	122.8520	0.032	4	120.6245	31.456	22	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[3x6]	H	3:4:1:	4:3:3:	3:	C[3x6]-3:C[3x6]-4:H-1:	C[5,4x6]-4:C[6,6]-3:C[6]-3:	C[6,6]-3:	C[6,6](C[3x6]C[5,4x6]C[6])(C[3x6]C[6,6]2H)(H)	C[3x6](C[5,4x6]C[5,6,6]2O[6])(C[6,6]C[3x6]H)(C[6]C[6]O)	H(C[6,6]C[3x6]2)	C[6,6](C[3x6]C[5,4x6]C[6])(C[3x6]C[6,6]2H)(H){1|O<2>,2|H<1>,2|O<1>,3|C<4>}	C[3x6](C[5,4x6]C[5,6,6]2O[6])(C[6,6]C[3x6]H)(C[6]C[6]O){1|C<3>,1|O<2>,4|C<4>,4|H<1>}	H(C[6,6]C[3x6]2)	122.8510	0.000	1	122.8510	0.000	1	122.8520	0.032	4	122.8520	0.032	4	120.6245	31.456	22	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[3x6]	H	3:4:1:	4:3:3:	3:	C[3x6]-3:C[3x6]-4:H-1:	C[5,4x6]-4:C[6,6]-3:C[6]-3:	C[6,6]-3:	C[6,6](C[3x6]C[5,4x6]C[6])(C[3x6]C[6,6]2H)(H)	C[3x6](C[5,4x6]C[5,6,6]2O[6])(C[6,6]C[3x6]H)(C[6]O[6]O)	H(C[6,6]C[3x6]2)	C[6,6](C[3x6]C[5,4x6]C[6])(C[3x6]C[6,6]2H)(H){2|C<4>,2|H<1>,2|O<1>,2|O<2>}	C[3x6](C[5,4x6]C[5,6,6]2O[6])(C[6,6]C[3x6]H)(C[6]O[6]O){1|C<3>,1|O<2>,2|H<1>,4|C<4>}	H(C[6,6]C[3x6]2)	123.1030	0.000	1	123.1030	0.000	1	122.8520	0.032	4	122.8520	0.032	4	120.6245	31.456	22	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[3x6]	H	3:4:1:	4:3:3:	3:	C[3x6]-3:C[3x6]-4:H-1:	C[5,4x6]-4:C[6,6]-3:C[6]-3:	C[6,6]-3:	C[6,6](C[3x6]C[5,4x6]C[6])(C[3x6]C[6,6]2O)(H)	C[3x6](C[5,4x6]C[5,6,6]2O[6])(C[6,6]C[3x6]H)(C[6]C[6,6a]O)	H(C[6,6]C[3x6]2)	C[6,6](C[3x6]C[5,4x6]C[6])(C[3x6]C[6,6]2O)(H){1|C<3>,1|O<2>,2|C<4>,2|H<1>,2|O<1>}	C[3x6](C[5,4x6]C[5,6,6]2O[6])(C[6,6]C[3x6]H)(C[6]C[6,6a]O){1|H<1>,2|O<2>,3|C<3>,3|C<4>}	H(C[6,6]C[3x6]2)	122.7430	0.000	1	122.7430	0.000	1	122.8520	0.032	4	122.8520	0.032	4	120.6245	31.456	22	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[3x6]	H	3:4:1:	4:3:4:	3:	C[3x6]-3:C[3x6]-4:H-1:	C[5x6]-4:C[6,6]-3:C[6]-4:	C[6,6]-3:	C[6,6](C[3x6]C[5x6]C[6])(C[3x6]C[6,6]2H)(H)	C[3x6](C[5x6]C[3x6]C[6,6]2)(C[6,6]C[3x6]H)(C[6]O[6]HH)	H(C[6,6]C[3x6]2)	C[6,6](C[3x6]C[5x6]C[6])(C[3x6]C[6,6]2H)(H){1|O<2>,2|C<3>,2|C<4>,3|H<1>}	C[3x6](C[5x6]C[3x6]C[6,6]2)(C[6,6]C[3x6]H)(C[6]O[6]HH){2|C<3>,2|C<4>,2|O<2>,3|H<1>}	H(C[6,6]C[3x6]2)	126.7110	0.000	1	126.7110	0.000	1	126.7110	0.000	1	126.7110	0.000	1	120.6245	31.456	22	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[3x6]	H	3:4:1:	4:4:3:	3:	C[3x6]-3:C[3x6]-4:H-1:	C[4x6]-4:C[6,6]-4:C[6,6]-3:	C[6,6]-3:	C[6,6](C[3x6]C[4x6]C[6,6])(C[3x6]C[6,6]2H)(H)	C[3x6](C[4x6]C[6,6]2C[6])(C[6,6]C[6,6]C[6]C)(C[6,6]C[3x6]H)	H(C[6,6]C[3x6]2)	C[6,6](C[3x6]C[4x6]C[6,6])(C[3x6]C[6,6]2H)(H){1|C<3>,2|H<1>,2|O<2>,5|C<4>}	C[3x6](C[4x6]C[6,6]2C[6])(C[6,6]C[6,6]C[6]C)(C[6,6]C[3x6]H){1|C<3>,1|O<1>,5|C<4>,7|H<1>}	H(C[6,6]C[3x6]2)	121.6707	0.273	3	121.7690	0.052	7	121.7690	0.052	7	121.7690	0.052	7	120.6245	31.456	22	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[3x6]	H	3:4:1:	4:4:3:	3:	C[3x6]-3:C[3x6]-4:H-1:	C[4x6]-4:C[6,6]-4:C[6,6]-3:	C[6,6]-3:	C[6,6](C[3x6]C[4x6]C[6,6])(C[3x6]C[6,6]2H)(H)	C[3x6](C[4x6]C[6,6]2C[6])(C[6,6]C[6,6]C[6]C)(C[6,6]C[3x6]H)	H(C[6,6]C[3x6]2)	C[6,6](C[3x6]C[4x6]C[6,6])(C[3x6]C[6,6]2H)(H){1|H<1>,1|O<1>,2|C<3>,4|C<4>}	C[3x6](C[4x6]C[6,6]2C[6])(C[6,6]C[6,6]C[6]C)(C[6,6]C[3x6]H){1|O<1>,3|C<3>,3|C<4>,6|H<1>}	H(C[6,6]C[3x6]2)	121.8090	0.163	2	121.7690	0.052	7	121.7690	0.052	7	121.7690	0.052	7	120.6245	31.456	22	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[3x6]	H	3:4:1:	4:4:3:	3:	C[3x6]-3:C[3x6]-4:H-1:	C[4x6]-4:C[6,6]-4:C[6,6]-3:	C[6,6]-3:	C[6,6](C[3x6]C[4x6]C[6,6])(C[3x6]C[6,6]2H)(H)	C[3x6](C[4x6]C[6,6]2C[6])(C[6,6]C[6,6]C[6]C)(C[6,6]C[3x6]H)	H(C[6,6]C[3x6]2)	C[6,6](C[3x6]C[4x6]C[6,6])(C[3x6]C[6,6]2H)(H){1|O<1>,2|C<3>,5|C<4>}	C[3x6](C[4x6]C[6,6]2C[6])(C[6,6]C[6,6]C[6]C)(C[6,6]C[3x6]H){1|O<1>,2|C<3>,3|C<4>,7|H<1>}	H(C[6,6]C[3x6]2)	121.6770	0.000	1	121.7690	0.052	7	121.7690	0.052	7	121.7690	0.052	7	120.6245	31.456	22	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[3x6]	H	3:4:1:	4:4:3:	3:	C[3x6]-3:C[3x6]-4:H-1:	C[4x6]-4:C[6,6]-4:C[6,6]-3:	C[6,6]-3:	C[6,6](C[3x6]C[4x6]C[6,6])(C[3x6]C[6,6]2H)(H)	C[3x6](C[4x6]C[6,6]2C[6])(C[6,6]C[6,6]C[6]C)(C[6,6]C[3x6]H)	H(C[6,6]C[3x6]2)	C[6,6](C[3x6]C[4x6]C[6,6])(C[3x6]C[6,6]2H)(H){1|Si<4>,2|C<3>,2|O<2>,4|C<4>}	C[3x6](C[4x6]C[6,6]2C[6])(C[6,6]C[6,6]C[6]C)(C[6,6]C[3x6]H){1|C<3>,1|O<1>,4|C<4>,7|H<1>}	H(C[6,6]C[3x6]2)	122.0760	0.000	1	121.7690	0.052	7	121.7690	0.052	7	121.7690	0.052	7	120.6245	31.456	22	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[3x6]	H	4:3:1:	4:3:3:	3:	C[3x6]-4:C[3x6]-3:H-1:	C[4x6]-4:C[6,6]-3:C[6]-3:	C[6,6]-3:	C[6,6](C[3x6]Si[4,6,6]C[6,6]H)(C[3x6]C[4x6]C[6])(H)	C[3x6](C[4x6]Si[4,3x6]C[6,6]H)(C[6,6]C[3x6]H)(C[6]N[6]N)	H(C[6,6]C[3x6]2)	C[6,6](C[3x6]Si[4,6,6]C[6,6]H)(C[3x6]C[4x6]C[6])(H){1|Si<5>,2|Si<4>,1|C<3>,1|N<2>,1|N<3>,2|H<1>}	C[3x6](C[4x6]Si[4,3x6]C[6,6]H)(C[6,6]C[3x6]H)(C[6]N[6]N){1|Si<5>,2|Si<4>,1|C<3>,1|C<4>,2|H<1>}	H(C[6,6]C[3x6]2)	120.6290	0.000	1	120.6290	0.000	1	120.6290	0.000	1	122.1695	1.177	4	120.6245	31.456	22	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[3x6]	H	4:3:1:	4:3:3:	3:	C[5,3x6]-4:C[3x6]-3:H-1:	C[4x6]-4:C[6,6]-3:C[6]-3:	C[6,6]-3:	C[6,6](C[5,3x6]C[5,6,6]2H)(C[3x6]C[4x6]C[6])(H)	C[3x6](C[4x6]C[6,6]2O[6])(C[6,6]C[5,3x6]H)(C[6]O[6]O)	H(C[6,6]C[5,3x6]C[3x6])	C[6,6](C[5,3x6]C[5,6,6]2H)(C[3x6]C[4x6]C[6])(H){1|C<3>,1|H<1>,1|O<1>,3|C<4>,3|O<2>}	C[3x6](C[4x6]C[6,6]2O[6])(C[6,6]C[5,3x6]H)(C[6]O[6]O){1|O<1>,3|C<4>,3|H<1>}	H(C[6,6]C[5,3x6]C[3x6])	122.2200	0.000	1	122.2200	0.000	1	122.6830	0.184	3	122.1695	1.177	4	120.6245	31.456	22	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[3x6]	H	4:3:1:	4:3:3:	3:	C[5,3x6]-4:C[3x6]-3:H-1:	C[4x6]-4:C[6,6]-3:C[6]-3:	C[6,6]-3:	C[6,6](C[5,3x6]C[5,6,6]2H)(C[3x6]C[4x6]C[6])(H)	C[3x6](C[4x6]C[6,6]O[6,6]C[6])(C[6,6]C[5,3x6]H)(C[6]C[6,6a]O)	H(C[6,6]C[5,3x6]C[3x6])	C[6,6](C[5,3x6]C[5,6,6]2H)(C[3x6]C[4x6]C[6])(H){1|H<1>,1|O<1>,1|O<2>,2|C<3>,4|C<4>}	C[3x6](C[4x6]C[6,6]O[6,6]C[6])(C[6,6]C[5,3x6]H)(C[6]C[6,6a]O){1|H<1>,1|O<1>,3|C<3>,3|C<4>}	H(C[6,6]C[5,3x6]C[3x6])	122.9145	0.214	2	122.9145	0.046	2	122.6830	0.184	3	122.1695	1.177	4	120.6245	31.456	22	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[3x6]	H	4:3:1:	4:3:4:	3:	C[3x6]-4:C[3x6]-3:H-1:	C[4x6]-4:C[6,6]-3:C[6]-4:	C[6,6]-3:	C[6,6](C[3x6]C[5,6,6]2N)(C[3x6]C[4x6]C[6])(H)	C[3x6](C[4x6]C[5,6,6]2C[6])(C[6,6]C[3x6]H)(C[6]C[6]HH)	H(C[6,6]C[3x6]2)	C[6,6](C[3x6]C[5,6,6]2N)(C[3x6]C[4x6]C[6])(H){2|C<3>,4|C<4>,4|H<1>}	C[3x6](C[4x6]C[5,6,6]2C[6])(C[6,6]C[3x6]H)(C[6]C[6]HH){1|N<3>,2|C<3>,3|C<4>,6|H<1>}	H(C[6,6]C[3x6]2)	121.6030	0.000	1	121.6030	0.000	1	122.4920	1.581	2	121.7927	2.258	3	120.6245	31.456	22	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[3x6]	H	4:3:1:	4:3:4:	3:	C[3x6]-4:C[3x6]-3:H-1:	C[4x6]-4:C[6,6]-3:C[6]-4:	C[6,6]-3:	C[6,6](C[3x6]C[6,6]O[6,6]H)(C[3x6]C[4x6]C[6])(H)	C[3x6](C[4x6]C[6,6]O[6,6]C[6])(C[6,6]C[3x6]H)(C[6]O[6]HH)	H(C[6,6]C[3x6]2)	C[6,6](C[3x6]C[6,6]O[6,6]H)(C[3x6]C[4x6]C[6])(H){2|C<4>,3|H<1>,3|O<2>}	C[3x6](C[4x6]C[6,6]O[6,6]C[6])(C[6,6]C[3x6]H)(C[6]O[6]HH){1|C<4>,2|O<2>,5|H<1>}	H(C[6,6]C[3x6]2)	123.3810	0.000	1	123.3810	0.000	1	122.4920	1.581	2	121.7927	2.258	3	120.6245	31.456	22	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[3x6]	H	4:3:1:	4:3:4:	3:	C[3x6]-4:C[3x6]-3:H-1:	C[5x6]-4:C[6,6]-3:C[6]-4:	C[6,6]-3:	C[6,6](C[3x6]C[5,6,6]Si[6,6]H)(C[3x6]C[5x6]C[6])(H)	C[3x6](C[5x6]C[5,6,6]C[3x6]C[6,6])(C[6,6]C[3x6]H)(C[6]C[5,6]CH)	H(C[6,6]C[3x6]2)	C[6,6](C[3x6]C[5,6,6]Si[6,6]H)(C[3x6]C[5x6]C[6])(H){2|C<3>,2|H<1>,6|C<4>}	C[3x6](C[5x6]C[5,6,6]C[3x6]C[6,6])(C[6,6]C[3x6]H)(C[6]C[5,6]CH){1|Si<4>,2|C<4>,4|C<3>,4|H<1>}	H(C[6,6]C[3x6]2)	120.3940	0.000	1	120.3940	0.000	1	120.3940	0.000	1	121.7927	2.258	3	120.6245	31.456	22	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[3x6]	H	4:3:1:	4:4:3:	3:	C[3x6]-4:C[3x6]-3:H-1:	C[4x6]-4:C[6,6]-4:C[6,6]-3:	C[6,6]-3:	C[6,6](C[3x6]C[6,6,6a]C[6,6]H)(C[3x6]C[4x6]C[6,6])(H)	C[3x6](C[4x6]C[6,6,6a]C[6,6]C[6])(C[6,6]C[6,6]C[6]C)(C[6,6]C[3x6]H)	H(C[6,6]C[3x6]2)	C[6,6](C[3x6]C[6,6,6a]C[6,6]H)(C[3x6]C[4x6]C[6,6])(H){1|O<1>,3|C<3>,4|C<4>}	C[3x6](C[4x6]C[6,6,6a]C[6,6]C[6])(C[6,6]C[6,6]C[6]C)(C[6,6]C[3x6]H){1|O<1>,3|C<3>,3|C<4>,6|H<1>}	H(C[6,6]C[3x6]2)	121.7050	0.000	1	121.7050	0.000	1	121.7050	0.000	1	109.7267	108.069	3	120.6245	31.456	22	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[3x6]	H	4:3:1:	4:4:3:	3:	C[3x6]-4:C[3x6]-3:H-1:	C[6,6]-4:C[6,6]-4:C[6,6]-3:	C[6,6]-3:	C[6,6](C[3x6]C[6,6]2N)(C[3x6]C[6,6]2)(H)	C[3x6](C[6,6]C[3x6]HH)2(C[6,6]C[3x6]H)	H(C[6,6]C[3x6]2)	C[6,6](C[3x6]C[6,6]2N)(C[3x6]C[6,6]2)(H){1|C<3>,1|C<4>,7|H<1>}	C[3x6](C[6,6]C[3x6]HH)2(C[6,6]C[3x6]H){1|C<3>,1|H<1>,1|N<3>,2|C<4>}	H(C[6,6]C[3x6]2)	103.7375	0.958	2	103.7375	0.918	2	103.7375	0.918	2	109.7267	108.069	3	120.6245	31.456	22	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[4x6]	H	3:4:1:	4:4:3:	3:	C[4x6]-3:C[3x6]-4:H-1:	C[5,6,6]-4:C[6x6]-4:C[6,6]-3:	C[6,6]-3:	C[6,6](C[4x6]C[5,6,6]C[6x6])(C[3x6]C[6,6]2H)(H)	C[4x6](C[5,6,6]C[5,4x6]N[5]H)(C[6x6]C[4x6]C[6,6]2)(C[6,6]C[3x6]H)	H(C[6,6]C[3x6]C[4x6])	C[6,6](C[4x6]C[5,6,6]C[6x6])(C[3x6]C[6,6]2H)(H){1|C<3>,1|N<3>,4|C<4>,4|H<1>}	C[4x6](C[5,6,6]C[5,4x6]N[5]H)(C[6x6]C[4x6]C[6,6]2)(C[6,6]C[3x6]H){1|O<2>,5|H<1>,7|C<4>}	H(C[6,6]C[3x6]C[4x6])	123.1060	0.000	1	123.1060	0.000	1	123.1060	0.000	1	123.1060	0.000	1	123.1060	0.000	1	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	3:3:1:	3:4:4:	3:	N[5,3x6]-3:C[6,6]-3:H-1:	C[6,6]-3:C[3x6]-4:C-4:	C[6,6]-3:	C[6,6](N[5,3x6]C[5,6,6]2)(C[6,6]C[3x6]C)(H)	C[6,6](C[6,6]N[5,3x6]H)(C[3x6]C[6,6]2H)(CCHO)	H(C[6,6]N[5,3x6]C[6,6])	C[6,6](N[5,3x6]C[5,6,6]2)(C[6,6]C[3x6]C)(H){3|H<1>,4|C<4>}	C[6,6](C[6,6]N[5,3x6]H)(C[3x6]C[6,6]2H)(CCHO){3|C<4>,3|H<1>}	H(C[6,6]N[5,3x6]C[6,6])	121.1870	0.000	1	121.1870	0.000	1	121.1870	0.000	1	121.1870	0.000	1	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	3:3:1:	4:3:1:	3:	Ge[3x6]-3:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](Ge[3x6]N[6,6]2)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[6,6]2H)(C[6,6]Ge[3x6]H)(H)	H(C[6,6]Ge[3x6]C[6,6])	C[6,6](Ge[3x6]N[6,6]2)(C[6,6]C[3x6]H)(H){1|H<1>,4|C<3>}	C[6,6](C[3x6]C[6,6]2H)(C[6,6]Ge[3x6]H)(H){1|C<3>,1|C<4>,2|N<3>}	H(C[6,6]Ge[3x6]C[6,6])	122.3340	0.000	1	122.3340	0.000	1	122.3340	0.000	1	122.3340	0.000	1	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:Ge[3x6]-3:H-1:	C[3x6]-4:C[6,6]-3:C[6a]-3:	C[6,6]-3:	C[6,6](C[6,6]C[3x6]C[6a])(Ge[3x6]N[6,6]2)(H)	C[6,6](C[3x6]C[6,6]2H)(C[6,6]Ge[3x6]H)(C[6a]C[6a]2)	H(C[6,6]Ge[3x6]C[6,6])	C[6,6](C[6,6]C[3x6]C[6a])(Ge[3x6]N[6,6]2)(H){1|H<1>,6|C<3>}	C[6,6](C[3x6]C[6,6]2H)(C[6,6]Ge[3x6]H)(C[6a]C[6a]2){1|C<4>,2|H<1>,2|N<3>,3|C<3>}	H(C[6,6]Ge[3x6]C[6,6])	121.1390	0.000	1	121.1390	0.000	1	121.1390	0.000	1	121.1390	0.000	1	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	3:4:1:	4:3:1:	3:	C[6,6]-3:C[3x6]-4:H-1:	C[5,3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[6,6]C[5,3x6]H)(C[3x6]C[6,6]2C)(H)	C[6,6](C[5,3x6]C[5,6,6]2H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[6,6]C[5,3x6]H)(C[3x6]C[6,6]2C)(H){1|O<1>,2|H<1>,3|C<4>}	C[6,6](C[5,3x6]C[5,6,6]2H)(C[6,6]C[3x6]H)(H){1|O<2>,2|C<3>,2|C<4>,2|H<1>}	H(C[6,6]C[3x6]C[6,6])	123.8940	0.000	1	123.8940	0.000	1	122.9854	0.482	14	122.7810	0.442	22	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	3:4:1:	4:3:1:	3:	C[6,6]-3:C[3x6]-4:H-1:	C[5,3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[6,6]C[5,3x6]H)(C[3x6]C[6,6]2C)(H)	C[6,6](C[5,3x6]C[5,6,6]C[6,6]C[5])(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[6,6]C[5,3x6]H)(C[3x6]C[6,6]2C)(H){1|C<3>,1|O<2>,2|C<4>,3|H<1>}	C[6,6](C[5,3x6]C[5,6,6]C[6,6]C[5])(C[6,6]C[3x6]H)(H){1|O<1>,3|H<1>,5|C<4>}	H(C[6,6]C[3x6]C[6,6])	123.0370	1.273	2	123.3453	1.095	3	122.9854	0.482	14	122.7810	0.442	22	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	3:4:1:	4:3:1:	3:	C[6,6]-3:C[3x6]-4:H-1:	C[5,3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[6,6]C[5,3x6]H)(C[3x6]C[6,6]2C)(H)	C[6,6](C[5,3x6]C[5,6,6]C[6,6]C[5])(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[6,6]C[5,3x6]H)(C[3x6]C[6,6]2C)(H){1|O<2>,3|C<4>,3|H<1>}	C[6,6](C[5,3x6]C[5,6,6]C[6,6]C[5])(C[6,6]C[3x6]H)(H){1|O<2>,4|H<1>,5|C<4>}	H(C[6,6]C[3x6]C[6,6])	123.9620	0.000	1	123.3453	1.095	3	122.9854	0.482	14	122.7810	0.442	22	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	3:4:1:	4:3:1:	3:	C[6,6]-3:C[3x6]-4:H-1:	C[5,3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[6,6]C[5,3x6]H)(C[3x6]C[6,6]2H)(H)	C[6,6](C[5,3x6]C[5,5,6,6]C[5,6,6]H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[6,6]C[5,3x6]H)(C[3x6]C[6,6]2H)(H){1|C<2>,1|O<2>,2|C<4>,3|H<1>}	C[6,6](C[5,3x6]C[5,5,6,6]C[5,6,6]H)(C[6,6]C[3x6]H)(H){1|N<3>,1|S<4>,2|H<1>,3|C<4>}	H(C[6,6]C[3x6]C[6,6])	122.8210	0.000	1	122.7783	0.013	3	122.9854	0.482	14	122.7810	0.442	22	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	3:4:1:	4:3:1:	3:	C[6,6]-3:C[3x6]-4:H-1:	C[5,3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[6,6]C[5,3x6]H)(C[3x6]C[6,6]2H)(H)	C[6,6](C[5,3x6]C[5,5,6,6]C[5,6,6]H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[6,6]C[5,3x6]H)(C[3x6]C[6,6]2H)(H){1|O<1>,2|C<4>,3|H<1>}	C[6,6](C[5,3x6]C[5,5,6,6]C[5,6,6]H)(C[6,6]C[3x6]H)(H){1|C<3>,1|N<3>,1|S<4>,2|C<4>,2|H<1>}	H(C[6,6]C[3x6]C[6,6])	122.7570	0.156	2	122.7783	0.013	3	122.9854	0.482	14	122.7810	0.442	22	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	3:4:1:	4:3:1:	3:	C[6,6]-3:C[3x6]-4:H-1:	C[5,3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[6,6]C[5,3x6]H)(C[3x6]C[6,6]2H)(H)	C[6,6](C[5,3x6]C[5,6,6]2C)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[6,6]C[5,3x6]H)(C[3x6]C[6,6]2H)(H){1|H<1>,1|O<1>,4|C<4>}	C[6,6](C[5,3x6]C[5,6,6]2C)(C[6,6]C[3x6]H)(H){1|C<4>,1|O<2>,2|C<3>,3|H<1>}	H(C[6,6]C[3x6]C[6,6])	123.7800	0.000	1	123.7800	0.000	1	122.9854	0.482	14	122.7810	0.442	22	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	3:4:1:	4:3:1:	3:	C[6,6]-3:C[3x6]-4:H-1:	C[5,3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[6,6]C[5,3x6]H)(C[3x6]C[6,6]2H)(H)	C[6,6](C[5,3x6]C[5,6,6]2H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[6,6]C[5,3x6]H)(C[3x6]C[6,6]2H)(H){1|O<1>,2|C<4>,3|H<1>}	C[6,6](C[5,3x6]C[5,6,6]2H)(C[6,6]C[3x6]H)(H){1|C<3>,2|C<4>,2|H<1>,2|O<2>}	H(C[6,6]C[3x6]C[6,6])	122.5030	0.000	1	122.5030	0.000	1	122.9854	0.482	14	122.7810	0.442	22	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	3:4:1:	4:3:1:	3:	C[6,6]-3:C[3x6]-4:H-1:	C[5,3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[6,6]C[5,3x6]H)(C[3x6]C[6,6]2H)(H)	C[6,6](C[5,3x6]C[5,6,6]C[6,6]C[5])(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[6,6]C[5,3x6]H)(C[3x6]C[6,6]2H)(H){1|C<3>,1|O<1>,2|C<4>,2|H<1>}	C[6,6](C[5,3x6]C[5,6,6]C[6,6]C[5])(C[6,6]C[3x6]H)(H){2|C<4>,2|H<1>,2|O<2>,3|C<3>}	H(C[6,6]C[3x6]C[6,6])	122.2465	0.647	2	122.2465	0.419	2	122.9854	0.482	14	122.7810	0.442	22	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	3:4:1:	4:3:1:	3:	C[6,6]-3:C[3x6]-4:H-1:	C[5,3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[6,6]C[5,3x6]H)(C[3x6]C[6,6]2H)(H)	C[6,6](C[5,3x6]C[5,6,6]C[6,6]N[5])(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[6,6]C[5,3x6]H)(C[3x6]C[6,6]2H)(H){1|N<3>,2|C<3>,3|H<1>}	C[6,6](C[5,3x6]C[5,6,6]C[6,6]N[5])(C[6,6]C[3x6]H)(H){2|C<4>,2|H<1>,3|C<3>}	H(C[6,6]C[3x6]C[6,6])	122.6880	0.075	2	122.9183	0.162	3	122.9854	0.482	14	122.7810	0.442	22	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	3:4:1:	4:3:1:	3:	C[6,6]-3:C[3x6]-4:H-1:	C[5,3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[6,6]C[5,3x6]H)(C[3x6]C[6,6]2H)(H)	C[6,6](C[5,3x6]C[5,6,6]C[6,6]N[5])(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[6,6]C[5,3x6]H)(C[3x6]C[6,6]2H)(H){1|N<3>,2|C<4>,4|H<1>}	C[6,6](C[5,3x6]C[5,6,6]C[6,6]N[5])(C[6,6]C[3x6]H)(H){1|N<3>,2|C<3>,2|C<4>,4|H<1>}	H(C[6,6]C[3x6]C[6,6])	123.3790	0.000	1	122.9183	0.162	3	122.9854	0.482	14	122.7810	0.442	22	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	3:4:1:	4:3:1:	3:	C[6,6]-3:C[3x6]-4:H-1:	C[5,4x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[6,6]C[5,4x6]H)(C[3x6]C[6,6]2H)(H)	C[6,6](C[5,4x6]C[5,3x6]C[5,5,6]C[6,6])(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[6,6]C[5,4x6]H)(C[3x6]C[6,6]2H)(H){1|O<1>,2|H<1>,3|C<4>}	C[6,6](C[5,4x6]C[5,3x6]C[5,5,6]C[6,6])(C[6,6]C[3x6]H)(H){1|C<3>,2|O<2>,3|H<1>,4|C<4>}	H(C[6,6]C[3x6]C[6,6])	123.0630	0.000	1	123.0630	0.000	1	122.4234	0.200	8	122.7810	0.442	22	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	3:4:1:	4:3:1:	3:	C[6,6]-3:C[3x6]-4:H-1:	C[5,4x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[6,6]C[5,4x6]H)(C[3x6]C[6,6]2H)(H)	C[6,6](C[5,4x6]C[5,3x6]C[5,6,6]C[6,6])(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[6,6]C[5,4x6]H)(C[3x6]C[6,6]2H)(H){1|C<3>,1|O<2>,2|H<1>,3|C<4>}	C[6,6](C[5,4x6]C[5,3x6]C[5,6,6]C[6,6])(C[6,6]C[3x6]H)(H){1|C<3>,1|H<1>,1|O<1>,1|O<2>,5|C<4>}	H(C[6,6]C[3x6]C[6,6])	121.4700	0.000	1	121.4700	0.000	1	122.4234	0.200	8	122.7810	0.442	22	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	3:4:1:	4:3:1:	3:	C[6,6]-3:C[3x6]-4:H-1:	C[5,4x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[6,6]C[5,4x6]H)(C[3x6]C[6,6]2O)(H)	C[6,6](C[5,4x6]C[3,3x6]N[5,6,6]N[5,6])(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[6,6]C[5,4x6]H)(C[3x6]C[6,6]2O)(H){1|C<3>,1|C<4>,2|N<3>,3|H<1>}	C[6,6](C[5,4x6]C[3,3x6]N[5,6,6]N[5,6])(C[6,6]C[3x6]H)(H){2|O<2>,3|C<3>,3|C<4>}	H(C[6,6]C[3x6]C[6,6])	122.4430	0.000	1	122.4430	0.000	1	122.4234	0.200	8	122.7810	0.442	22	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	3:4:1:	4:3:1:	3:	C[6,6]-3:C[3x6]-4:H-1:	C[5,4x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[6,6]C[5,4x6]H)(C[3x6]C[6,6]2O)(H)	C[6,6](C[5,4x6]N[5,6,6]C[3x6]N[5,6])(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[6,6]C[5,4x6]H)(C[3x6]C[6,6]2O)(H){1|C<3>,1|C<4>,2|N<3>,3|H<1>}	C[6,6](C[5,4x6]N[5,6,6]C[3x6]N[5,6])(C[6,6]C[3x6]H)(H){1|H<1>,1|O<2>,3|C<3>,3|C<4>}	H(C[6,6]C[3x6]C[6,6])	122.5277	0.132	3	122.4822	0.015	5	122.4234	0.200	8	122.7810	0.442	22	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	3:4:1:	4:3:1:	3:	C[6,6]-3:C[3x6]-4:H-1:	C[5,4x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[6,6]C[5,4x6]H)(C[3x6]C[6,6]2O)(H)	C[6,6](C[5,4x6]N[5,6,6]C[3x6]N[5,6])(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[6,6]C[5,4x6]H)(C[3x6]C[6,6]2O)(H){1|C<4>,2|N<3>,4|H<1>}	C[6,6](C[5,4x6]N[5,6,6]C[3x6]N[5,6])(C[6,6]C[3x6]H)(H){1|H<1>,1|O<2>,3|C<3>,3|C<4>}	H(C[6,6]C[3x6]C[6,6])	122.3400	0.000	1	122.4822	0.015	5	122.4234	0.200	8	122.7810	0.442	22	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	3:4:1:	4:3:1:	3:	C[6,6]-3:C[3x6]-4:H-1:	C[5,4x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[6,6]C[5,4x6]H)(C[3x6]C[6,6]2O)(H)	C[6,6](C[5,4x6]N[5,6,6]C[3x6]N[5,6])(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[6,6]C[5,4x6]H)(C[3x6]C[6,6]2O)(H){2|C<4>,2|N<3>,3|H<1>}	C[6,6](C[5,4x6]N[5,6,6]C[3x6]N[5,6])(C[6,6]C[3x6]H)(H){1|H<1>,1|O<2>,3|C<3>,3|C<4>}	H(C[6,6]C[3x6]C[6,6])	122.4880	0.000	1	122.4822	0.015	5	122.4234	0.200	8	122.7810	0.442	22	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	3:4:1:	4:3:3:	3:	C[6,6]-3:C[3x6]-4:H-1:	C[3x6]-4:C[6,6]-3:C[6a]-3:	C[6,6]-3:	C[6,6](C[6,6]C[3x6]C[6a])(C[3x6]C[6,6]2H)(H)	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(C[6a]C[6a]2)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[6,6]C[3x6]C[6a])(C[3x6]C[6,6]2H)(H){1|H<1>,1|I<1>,2|O<2>,4|C<3>}	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(C[6a]C[6a]2){1|C<4>,1|O<1>,3|C<3>,4|H<1>}	H(C[6,6]C[3x6]C[6,6])	114.1010	0.000	1	114.1010	0.000	1	114.1010	0.000	1	121.7646	7.552	10	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	3:4:1:	4:3:3:	3:	C[6,6]-3:C[3x6]-4:H-1:	C[3x6]-4:C[6,6]-3:N[5]-3:	C[6,6]-3:	C[6,6](C[6,6]C[3x6]N[5])(C[3x6]C[6,6]2H)(H)	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(N[5]C[5]2)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[6,6]C[3x6]N[5])(C[3x6]C[6,6]2H)(H){2|C<3>,3|C<4>,4|H<1>}	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(N[5]C[5]2){1|O<1>,1|O<2>,4|C<4>,6|H<1>}	H(C[6,6]C[3x6]C[6,6])	123.1953	0.151	3	123.1953	0.023	3	123.1953	0.023	3	121.7646	7.552	10	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	3:4:1:	4:3:3:	3:	C[6,6]-3:C[3x6]-4:H-1:	C[4x6]-4:C[6,6]-3:C[6a]-3:	C[6,6]-3:	C[6,6](C[6,6]C[4x6]C[6a])(C[3x6]C[6,6]2H)(H)	C[6,6](C[4x6]C[3x6]C[6,6]C[6])(C[6,6]C[3x6]H)(C[6a]C[6a]2)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[6,6]C[4x6]C[6a])(C[3x6]C[6,6]2H)(H){1|C<4>,1|H<1>,1|O<1>,4|C<3>}	C[6,6](C[4x6]C[3x6]C[6,6]C[6])(C[6,6]C[3x6]H)(C[6a]C[6a]2){1|O<1>,2|C<4>,4|C<3>,5|H<1>}	H(C[6,6]C[3x6]C[6,6])	121.9770	0.074	2	121.9770	0.005	2	121.9770	0.005	2	121.7646	7.552	10	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	3:4:1:	4:3:3:	3:	C[6,6]-3:C[3x6]-4:H-1:	C[5,3x6]-4:C[6,6]-3:C-3:	C[6,6]-3:	C[6,6](C[6,6]C[5,3x6]C)(C[3x6]C[6,6]2C)(H)	C[6,6](C[5,3x6]C[5,6,6]C[6,6]O[5])(C[6,6]C[3x6]H)(CHO)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[6,6]C[5,3x6]C)(C[3x6]C[6,6]2C)(H){1|O<2>,2|C<3>,3|H<1>}	C[6,6](C[5,3x6]C[5,6,6]C[6,6]O[5])(C[6,6]C[3x6]H)(CHO){2|C<3>,4|C<4>}	H(C[6,6]C[3x6]C[6,6])	122.2310	0.000	1	122.2310	0.000	1	122.1850	0.004	2	121.7646	7.552	10	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	3:4:1:	4:3:3:	3:	C[6,6]-3:C[3x6]-4:H-1:	C[5,3x6]-4:C[6,6]-3:C-3:	C[6,6]-3:	C[6,6](C[6,6]C[5,3x6]C)(C[3x6]C[6,6]2H)(H)	C[6,6](C[5,3x6]C[5,6,6]2H)(C[6,6]C[3x6]H)(CCH)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[6,6]C[5,3x6]C)(C[3x6]C[6,6]2H)(H){1|C<3>,1|O<1>,2|C<4>,2|H<1>}	C[6,6](C[5,3x6]C[5,6,6]2H)(C[6,6]C[3x6]H)(CCH){1|C<4>,2|C<3>,2|H<1>,2|O<2>}	H(C[6,6]C[3x6]C[6,6])	122.1390	0.000	1	122.1390	0.000	1	122.1850	0.004	2	121.7646	7.552	10	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	3:4:1:	4:3:3:	3:	C[6,6]-3:C[3x6]-4:H-1:	C[5,4x6]-4:C[6,6]-3:C-3:	C[6,6]-3:	C[6,6](C[6,6]C[5,4x6]C)(C[3x6]C[6,6]2O)(H)	C[6,6](C[5,4x6]N[5,6,6]C[3x6]N[5,6])(C[6,6]C[3x6]H)(COO)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[6,6]C[5,4x6]C)(C[3x6]C[6,6]2O)(H){1|C<3>,1|C<4>,2|N<3>,3|H<1>}	C[6,6](C[5,4x6]N[5,6,6]C[3x6]N[5,6])(C[6,6]C[3x6]H)(COO){1|H<1>,1|O<2>,3|C<3>,3|C<4>}	H(C[6,6]C[3x6]C[6,6])	122.3840	0.000	1	122.3840	0.000	1	122.3840	0.000	1	121.7646	7.552	10	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	3:4:1:	4:3:3:	3:	C[6,6]-3:C[4x6]-4:H-1:	C[3x6]-4:C[6,6]-3:N[5]-3:	C[6,6]-3:	C[6,6](C[6,6]C[3x6]N[5])(C[4x6]C[3x6]2H)(H)	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[4x6]H)(N[5]C[5]2)	H(C[6,6]C[4x6]C[6,6])	C[6,6](C[6,6]C[3x6]N[5])(C[4x6]C[3x6]2H)(H){1|C<3>,3|H<1>,5|C<4>}	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[4x6]H)(N[5]C[5]2){1|O<1>,1|O<2>,4|C<4>,6|H<1>}	H(C[6,6]C[4x6]C[6,6])	123.2510	0.000	1	123.2510	0.000	1	123.2510	0.000	1	121.7646	7.552	10	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	3:4:1:	4:3:4:	3:	C[6,6]-3:C[3x6]-4:H-1:	C[5,3x6]-4:C[6,6]-3:C-4:	C[6,6]-3:	C[6,6](C[6,6]C[5,3x6]C)(C[3x6]C[6,6]2C)(H)	C[6,6](C[5,3x6]C[5,6,6]C[6,6]O[5])(C[6,6]C[3x6]H)(CC3)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[6,6]C[5,3x6]C)(C[3x6]C[6,6]2C)(H){1|O<2>,2|C<3>,3|H<1>}	C[6,6](C[5,3x6]C[5,6,6]C[6,6]O[5])(C[6,6]C[3x6]H)(CC3){3|C<3>,3|C<4>}	H(C[6,6]C[3x6]C[6,6])	121.0350	0.000	1	121.0350	0.000	1	121.0350	0.000	1	121.0350	0.000	1	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	3:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	Ge[3x6]-3:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[6,6]2H)(C[6,6]Ge[3x6]H)(H)	C[6,6](Ge[3x6]N[6,6]2)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6]2H)(C[6,6]Ge[3x6]H)(H){1|C<3>,1|C<4>,2|N<3>}	C[6,6](Ge[3x6]N[6,6]2)(C[6,6]C[3x6]H)(H){1|H<1>,4|C<3>}	H(C[6,6]C[3x6]C[6,6])	119.9950	0.000	1	119.9950	0.000	1	119.9950	0.000	1	119.9950	0.000	1	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	3:3:3:	3:	C[3x6]-4:C[6,6]-3:H-1:	P[3x6]-3:C[6,6]-3:C[6a]-3:	C[6,6]-3:	C[6,6](C[3x6]C[6,6,6a]C[6,6]C[6a])(C[6,6]P[3x6]C[6a])(H)	C[6,6](P[3x6]C[6,6,6a]C[6,6])(C[6,6]C[3x6]H)(C[6a]C[6a]2)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6,6a]C[6,6]C[6a])(C[6,6]P[3x6]C[6a])(H){1|H<1>,7|C<3>}	C[6,6](P[3x6]C[6,6,6a]C[6,6])(C[6,6]C[3x6]H)(C[6a]C[6a]2){2|H<1>,7|C<3>}	H(C[6,6]C[3x6]C[6,6])	120.5010	1.331	2	120.5010	1.771	2	120.5010	1.771	2	120.5210	0.887	3	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	3:3:3:	3:	C[4,5,4x6]-4:C[6,6]-3:H-1:	N[6,6]-3:C[6,6]-3:C[6]-3:	C[6,6]-3:	C[6,6](C[4,5,4x6]C[4,5,5,6,6]2C[5,6,6])(C[6,6]N[6,6]C[6])(H)	C[6,6](N[6,6]C[4,5,6,6]Pt)(C[6,6]C[4,5,4x6]H)(C[6]C[6]N[6])	H(C[6,6]C[4,5,4x6]C[6,6])	C[6,6](C[4,5,4x6]C[4,5,5,6,6]2C[5,6,6])(C[6,6]N[6,6]C[6])(H){1|Pt<4>,1|H<1>,1|N<3>,3|C<3>,3|C<4>}	C[6,6](N[6,6]C[4,5,6,6]Pt)(C[6,6]C[4,5,4x6]H)(C[6]C[6]N[6]){1|C<4>,2|H<1>,4|C<3>}	H(C[6,6]C[4,5,4x6]C[6,6])	120.5610	0.000	1	120.5610	0.000	1	120.5610	0.000	1	120.5210	0.887	3	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	3:4:1:	3:	C[5,3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:C[3x6]-4:H-1:	C[6,6]-3:	C[6,6](C[5,3x6]C[5,5,6,6]C[5,6,6]H)(C[6,6]C[3x6]H)(H)	C[6,6](C[6,6]C[5,3x6]H)(C[3x6]C[6,6]2H)(H)	H(C[6,6]C[5,3x6]C[6,6])	C[6,6](C[5,3x6]C[5,5,6,6]C[5,6,6]H)(C[6,6]C[3x6]H)(H){1|C<3>,1|N<3>,1|S<4>,2|C<4>,2|H<1>}	C[6,6](C[6,6]C[5,3x6]H)(C[3x6]C[6,6]2H)(H){1|O<1>,2|C<4>,3|H<1>}	H(C[6,6]C[5,3x6]C[6,6])	122.2210	0.140	2	122.3303	0.046	3	123.1462	0.873	14	123.3341	0.807	22	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	3:4:1:	3:	C[5,3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:C[3x6]-4:H-1:	C[6,6]-3:	C[6,6](C[5,3x6]C[5,5,6,6]C[5,6,6]H)(C[6,6]C[3x6]H)(H)	C[6,6](C[6,6]C[5,3x6]H)(C[3x6]C[6,6]2H)(H)	H(C[6,6]C[5,3x6]C[6,6])	C[6,6](C[5,3x6]C[5,5,6,6]C[5,6,6]H)(C[6,6]C[3x6]H)(H){1|N<3>,1|S<4>,2|H<1>,3|C<4>}	C[6,6](C[6,6]C[5,3x6]H)(C[3x6]C[6,6]2H)(H){1|C<2>,1|O<2>,2|C<4>,3|H<1>}	H(C[6,6]C[5,3x6]C[6,6])	122.5490	0.000	1	122.3303	0.046	3	123.1462	0.873	14	123.3341	0.807	22	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	3:4:1:	3:	C[5,3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:C[3x6]-4:H-1:	C[6,6]-3:	C[6,6](C[5,3x6]C[5,6,6]2C)(C[6,6]C[3x6]H)(H)	C[6,6](C[6,6]C[5,3x6]H)(C[3x6]C[6,6]2H)(H)	H(C[6,6]C[5,3x6]C[6,6])	C[6,6](C[5,3x6]C[5,6,6]2C)(C[6,6]C[3x6]H)(H){1|C<4>,1|O<2>,2|C<3>,3|H<1>}	C[6,6](C[6,6]C[5,3x6]H)(C[3x6]C[6,6]2H)(H){1|H<1>,1|O<1>,4|C<4>}	H(C[6,6]C[5,3x6]C[6,6])	122.5930	0.000	1	122.5930	0.000	1	123.1462	0.873	14	123.3341	0.807	22	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	3:4:1:	3:	C[5,3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:C[3x6]-4:H-1:	C[6,6]-3:	C[6,6](C[5,3x6]C[5,6,6]2H)(C[6,6]C[3x6]H)(H)	C[6,6](C[6,6]C[5,3x6]H)(C[3x6]C[6,6]2C)(H)	H(C[6,6]C[5,3x6]C[6,6])	C[6,6](C[5,3x6]C[5,6,6]2H)(C[6,6]C[3x6]H)(H){1|O<2>,2|C<3>,2|C<4>,2|H<1>}	C[6,6](C[6,6]C[5,3x6]H)(C[3x6]C[6,6]2C)(H){1|O<1>,2|H<1>,3|C<4>}	H(C[6,6]C[5,3x6]C[6,6])	123.9320	0.000	1	123.9320	0.000	1	123.1462	0.873	14	123.3341	0.807	22	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	3:4:1:	3:	C[5,3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:C[3x6]-4:H-1:	C[6,6]-3:	C[6,6](C[5,3x6]C[5,6,6]2H)(C[6,6]C[3x6]H)(H)	C[6,6](C[6,6]C[5,3x6]H)(C[3x6]C[6,6]2H)(H)	H(C[6,6]C[5,3x6]C[6,6])	C[6,6](C[5,3x6]C[5,6,6]2H)(C[6,6]C[3x6]H)(H){1|C<3>,2|C<4>,2|H<1>,2|O<2>}	C[6,6](C[6,6]C[5,3x6]H)(C[3x6]C[6,6]2H)(H){1|O<1>,2|C<4>,3|H<1>}	H(C[6,6]C[5,3x6]C[6,6])	122.1830	0.000	1	122.1830	0.000	1	123.1462	0.873	14	123.3341	0.807	22	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	3:4:1:	3:	C[5,3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:C[3x6]-4:H-1:	C[6,6]-3:	C[6,6](C[5,3x6]C[5,6,6]C[6,6]C[5])(C[6,6]C[3x6]H)(H)	C[6,6](C[6,6]C[5,3x6]H)(C[3x6]C[6,6]2C)(H)	H(C[6,6]C[5,3x6]C[6,6])	C[6,6](C[5,3x6]C[5,6,6]C[6,6]C[5])(C[6,6]C[3x6]H)(H){1|O<1>,3|H<1>,5|C<4>}	C[6,6](C[6,6]C[5,3x6]H)(C[3x6]C[6,6]2C)(H){1|C<3>,1|O<2>,2|C<4>,3|H<1>}	H(C[6,6]C[5,3x6]C[6,6])	124.8295	0.518	2	124.2677	1.081	3	123.1462	0.873	14	123.3341	0.807	22	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	3:4:1:	3:	C[5,3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:C[3x6]-4:H-1:	C[6,6]-3:	C[6,6](C[5,3x6]C[5,6,6]C[6,6]C[5])(C[6,6]C[3x6]H)(H)	C[6,6](C[6,6]C[5,3x6]H)(C[3x6]C[6,6]2C)(H)	H(C[6,6]C[5,3x6]C[6,6])	C[6,6](C[5,3x6]C[5,6,6]C[6,6]C[5])(C[6,6]C[3x6]H)(H){1|O<2>,4|H<1>,5|C<4>}	C[6,6](C[6,6]C[5,3x6]H)(C[3x6]C[6,6]2C)(H){1|O<2>,3|C<4>,3|H<1>}	H(C[6,6]C[5,3x6]C[6,6])	123.1440	0.000	1	124.2677	1.081	3	123.1462	0.873	14	123.3341	0.807	22	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	3:4:1:	3:	C[5,3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:C[3x6]-4:H-1:	C[6,6]-3:	C[6,6](C[5,3x6]C[5,6,6]C[6,6]C[5])(C[6,6]C[3x6]H)(H)	C[6,6](C[6,6]C[5,3x6]H)(C[3x6]C[6,6]2H)(H)	H(C[6,6]C[5,3x6]C[6,6])	C[6,6](C[5,3x6]C[5,6,6]C[6,6]C[5])(C[6,6]C[3x6]H)(H){2|C<4>,2|H<1>,2|O<2>,3|C<3>}	C[6,6](C[6,6]C[5,3x6]H)(C[3x6]C[6,6]2H)(H){1|C<3>,1|O<1>,2|C<4>,2|H<1>}	H(C[6,6]C[5,3x6]C[6,6])	122.8135	0.991	2	122.8135	0.981	2	123.1462	0.873	14	123.3341	0.807	22	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	3:4:1:	3:	C[5,3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:C[3x6]-4:H-1:	C[6,6]-3:	C[6,6](C[5,3x6]C[5,6,6]C[6,6]N[5])(C[6,6]C[3x6]H)(H)	C[6,6](C[6,6]C[5,3x6]H)(C[3x6]C[6,6]2H)(H)	H(C[6,6]C[5,3x6]C[6,6])	C[6,6](C[5,3x6]C[5,6,6]C[6,6]N[5])(C[6,6]C[3x6]H)(H){1|N<3>,2|C<3>,2|C<4>,4|H<1>}	C[6,6](C[6,6]C[5,3x6]H)(C[3x6]C[6,6]2H)(H){1|N<3>,2|C<4>,4|H<1>}	H(C[6,6]C[5,3x6]C[6,6])	122.9670	0.000	1	123.3060	0.095	3	123.1462	0.873	14	123.3341	0.807	22	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	3:4:1:	3:	C[5,3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:C[3x6]-4:H-1:	C[6,6]-3:	C[6,6](C[5,3x6]C[5,6,6]C[6,6]N[5])(C[6,6]C[3x6]H)(H)	C[6,6](C[6,6]C[5,3x6]H)(C[3x6]C[6,6]2H)(H)	H(C[6,6]C[5,3x6]C[6,6])	C[6,6](C[5,3x6]C[5,6,6]C[6,6]N[5])(C[6,6]C[3x6]H)(H){2|C<4>,2|H<1>,3|C<3>}	C[6,6](C[6,6]C[5,3x6]H)(C[3x6]C[6,6]2H)(H){1|N<3>,2|C<3>,3|H<1>}	H(C[6,6]C[5,3x6]C[6,6])	123.4755	0.135	2	123.3060	0.095	3	123.1462	0.873	14	123.3341	0.807	22	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	3:4:1:	3:	C[5,4x6]-4:C[6,6]-3:H-1:	C[6,6]-3:C[3x6]-4:H-1:	C[6,6]-3:	C[6,6](C[5,4x6]C[3,3x6]N[5,6,6]N[5,6])(C[6,6]C[3x6]H)(H)	C[6,6](C[6,6]C[5,4x6]H)(C[3x6]C[6,6]2O)(H)	H(C[6,6]C[5,4x6]C[6,6])	C[6,6](C[5,4x6]C[3,3x6]N[5,6,6]N[5,6])(C[6,6]C[3x6]H)(H){2|O<2>,3|C<3>,3|C<4>}	C[6,6](C[6,6]C[5,4x6]H)(C[3x6]C[6,6]2O)(H){1|C<3>,1|C<4>,2|N<3>,3|H<1>}	H(C[6,6]C[5,4x6]C[6,6])	123.9850	0.000	1	123.9850	0.000	1	123.6630	0.605	8	123.3341	0.807	22	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	3:4:1:	3:	C[5,4x6]-4:C[6,6]-3:H-1:	C[6,6]-3:C[3x6]-4:H-1:	C[6,6]-3:	C[6,6](C[5,4x6]C[5,3x6]C[5,5,6]C[6,6])(C[6,6]C[3x6]H)(H)	C[6,6](C[6,6]C[5,4x6]H)(C[3x6]C[6,6]2H)(H)	H(C[6,6]C[5,4x6]C[6,6])	C[6,6](C[5,4x6]C[5,3x6]C[5,5,6]C[6,6])(C[6,6]C[3x6]H)(H){1|C<3>,2|O<2>,3|H<1>,4|C<4>}	C[6,6](C[6,6]C[5,4x6]H)(C[3x6]C[6,6]2H)(H){1|O<1>,2|H<1>,3|C<4>}	H(C[6,6]C[5,4x6]C[6,6])	121.8360	0.000	1	121.8360	0.000	1	123.6630	0.605	8	123.3341	0.807	22	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	3:4:1:	3:	C[5,4x6]-4:C[6,6]-3:H-1:	C[6,6]-3:C[3x6]-4:H-1:	C[6,6]-3:	C[6,6](C[5,4x6]C[5,3x6]C[5,6,6]C[6,6])(C[6,6]C[3x6]H)(H)	C[6,6](C[6,6]C[5,4x6]H)(C[3x6]C[6,6]2H)(H)	H(C[6,6]C[5,4x6]C[6,6])	C[6,6](C[5,4x6]C[5,3x6]C[5,6,6]C[6,6])(C[6,6]C[3x6]H)(H){1|C<3>,1|H<1>,1|O<1>,1|O<2>,5|C<4>}	C[6,6](C[6,6]C[5,4x6]H)(C[3x6]C[6,6]2H)(H){1|C<3>,1|O<2>,2|H<1>,3|C<4>}	H(C[6,6]C[5,4x6]C[6,6])	123.3470	0.000	1	123.3470	0.000	1	123.6630	0.605	8	123.3341	0.807	22	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	3:4:1:	3:	C[5,4x6]-4:C[6,6]-3:H-1:	C[6,6]-3:C[3x6]-4:H-1:	C[6,6]-3:	C[6,6](C[5,4x6]N[5,6,6]C[3x6]N[5,6])(C[6,6]C[3x6]H)(H)	C[6,6](C[6,6]C[5,4x6]H)(C[3x6]C[6,6]2O)(H)	H(C[6,6]C[5,4x6]C[6,6])	C[6,6](C[5,4x6]N[5,6,6]C[3x6]N[5,6])(C[6,6]C[3x6]H)(H){1|H<1>,1|O<2>,3|C<3>,3|C<4>}	C[6,6](C[6,6]C[5,4x6]H)(C[3x6]C[6,6]2O)(H){1|C<3>,1|C<4>,2|N<3>,3|H<1>}	H(C[6,6]C[5,4x6]C[6,6])	124.0413	0.040	3	124.0272	0.008	5	123.6630	0.605	8	123.3341	0.807	22	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	3:4:1:	3:	C[5,4x6]-4:C[6,6]-3:H-1:	C[6,6]-3:C[3x6]-4:H-1:	C[6,6]-3:	C[6,6](C[5,4x6]N[5,6,6]C[3x6]N[5,6])(C[6,6]C[3x6]H)(H)	C[6,6](C[6,6]C[5,4x6]H)(C[3x6]C[6,6]2O)(H)	H(C[6,6]C[5,4x6]C[6,6])	C[6,6](C[5,4x6]N[5,6,6]C[3x6]N[5,6])(C[6,6]C[3x6]H)(H){1|H<1>,1|O<2>,3|C<3>,3|C<4>}	C[6,6](C[6,6]C[5,4x6]H)(C[3x6]C[6,6]2O)(H){1|C<4>,2|N<3>,4|H<1>}	H(C[6,6]C[5,4x6]C[6,6])	124.1220	0.000	1	124.0272	0.008	5	123.6630	0.605	8	123.3341	0.807	22	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	3:4:1:	3:	C[5,4x6]-4:C[6,6]-3:H-1:	C[6,6]-3:C[3x6]-4:H-1:	C[6,6]-3:	C[6,6](C[5,4x6]N[5,6,6]C[3x6]N[5,6])(C[6,6]C[3x6]H)(H)	C[6,6](C[6,6]C[5,4x6]H)(C[3x6]C[6,6]2O)(H)	H(C[6,6]C[5,4x6]C[6,6])	C[6,6](C[5,4x6]N[5,6,6]C[3x6]N[5,6])(C[6,6]C[3x6]H)(H){1|H<1>,1|O<2>,3|C<3>,3|C<4>}	C[6,6](C[6,6]C[5,4x6]H)(C[3x6]C[6,6]2O)(H){2|C<4>,2|N<3>,3|H<1>}	H(C[6,6]C[5,4x6]C[6,6])	123.8900	0.000	1	124.0272	0.008	5	123.6630	0.605	8	123.3341	0.807	22	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	3:4:4:	3:	C[5,3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:C[3x6]-4:C-4:	C[6,6]-3:	C[6,6](C[5,3x6]C[5,5,6,6]C[5,6,6]H)(C[6,6]C[3x6]C)(H)	C[6,6](C[6,6]C[5,3x6]H)(C[3x6]C[6,6]2H)(CH3)	H(C[6,6]C[5,3x6]C[6,6])	C[6,6](C[5,3x6]C[5,5,6,6]C[5,6,6]H)(C[6,6]C[3x6]C)(H){1|N<3>,2|C<3>,2|C<4>,2|H<1>}	C[6,6](C[6,6]C[5,3x6]H)(C[3x6]C[6,6]2H)(CH3){1|C<3>,1|O<1>,2|C<4>,2|H<1>}	H(C[6,6]C[5,3x6]C[6,6])	121.6710	0.000	1	121.6710	0.000	1	121.9543	0.067	3	122.1204	0.094	5	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	3:4:4:	3:	C[5,3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:C[3x6]-4:C-4:	C[6,6]-3:	C[6,6](C[5,3x6]C[5,6,6]C[5,6]C[6,6])(C[6,6]C[3x6]C)(H)	C[6,6](C[6,6]C[5,3x6]H)(C[3x6]C[6,6]2H)(CH3)	H(C[6,6]C[5,3x6]C[6,6])	C[6,6](C[5,3x6]C[5,6,6]C[5,6]C[6,6])(C[6,6]C[3x6]C)(H){1|C<3>,2|O<2>,3|H<1>,4|C<4>}	C[6,6](C[6,6]C[5,3x6]H)(C[3x6]C[6,6]2H)(CH3){3|C<4>,4|H<1>}	H(C[6,6]C[5,3x6]C[6,6])	122.0960	0.116	2	122.0960	0.013	2	121.9543	0.067	3	122.1204	0.094	5	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	3:4:4:	3:	C[5,4x6]-4:C[6,6]-3:H-1:	C[6,6]-3:C[3x6]-4:C-4:	C[6,6]-3:	C[6,6](C[5,4x6]C[5,3x6]C[5,6,6]C[6,6])(C[6,6]C[3x6]C)(H)	C[6,6](C[6,6]C[5,4x6]H)(C[3x6]C[6,6]2H)(CH3)	H(C[6,6]C[5,4x6]C[6,6])	C[6,6](C[5,4x6]C[5,3x6]C[5,6,6]C[6,6])(C[6,6]C[3x6]C)(H){1|O<2>,2|C<3>,3|H<1>,4|C<4>}	C[6,6](C[6,6]C[5,4x6]H)(C[3x6]C[6,6]2H)(CH3){3|C<4>,4|H<1>}	H(C[6,6]C[5,4x6]C[6,6])	122.3695	0.189	2	122.3695	0.036	2	122.3695	0.036	2	122.1204	0.094	5	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	B[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](B[3x6]C[6,6,6a]C[6,6]N[6])(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[6,6,6a]C[6,6]C)(C[6,6]B[3x6]H)(H)	H(C[6,6]B[3x6]C[6,6])	C[6,6](B[3x6]C[6,6,6a]C[6,6]N[6])(C[6,6]C[3x6]H)(H){1|C<4>,1|H<1>,5|C<3>}	C[6,6](C[3x6]C[6,6,6a]C[6,6]C)(C[6,6]B[3x6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6,6]B[3x6]C[6,6])	123.9200	0.008	2	123.9200	0.000	2	123.0628	1.871	6	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	B[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](B[3x6]C[6,6]2N[6])(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[6,6]2H)(C[6,6]B[3x6]H)(H)	H(C[6,6]B[3x6]C[6,6])	C[6,6](B[3x6]C[6,6]2N[6])(C[6,6]C[3x6]H)(H){1|C<2>,1|C<4>,3|C<3>,3|H<1>}	C[6,6](C[3x6]C[6,6]2H)(C[6,6]B[3x6]H)(H){1|C<2>,1|C<3>,1|C<4>,1|N<3>,2|H<1>}	H(C[6,6]B[3x6]C[6,6])	121.3010	0.175	2	122.6343	2.384	4	123.0628	1.871	6	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	B[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](B[3x6]C[6,6]2N[6])(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[6,6]2H)(C[6,6]B[3x6]H)(H)	H(C[6,6]B[3x6]C[6,6])	C[6,6](B[3x6]C[6,6]2N[6])(C[6,6]C[3x6]H)(H){2|H<1>,5|C<3>}	C[6,6](C[3x6]C[6,6]2H)(C[6,6]B[3x6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6,6]B[3x6]C[6,6])	123.9675	0.104	2	122.6343	2.384	4	123.0628	1.871	6	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3,6,6]-4:C[6,6]-3:H-1:	C[5,5,6,6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3,6,6]C[3,5,6,6]2H)(C[6,6]C[5,5,6,6]H)(H)	C[6,6](C[5,5,6,6]C[5,5,6,6]2H)(C[6,6]C[3,6,6]H)(H)	H(C[6,6]C[3,6,6]C[6,6])	C[6,6](C[3,6,6]C[3,5,6,6]2H)(C[6,6]C[5,5,6,6]H)(H){1|Si<4>,2|C<4>,2|H<1>}	C[6,6](C[5,5,6,6]C[5,5,6,6]2H)(C[6,6]C[3,6,6]H)(H){1|Si<4>,2|C<3>,2|C<4>,2|H<1>}	H(C[6,6]C[3,6,6]C[6,6])	121.4990	0.000	1	121.4990	0.000	1	121.4990	0.000	1	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3,6,6]-4:C[6,6]-3:H-1:	C[5,6,6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3,6,6]C[3,5,6,6]2C)(C[6,6]C[5,6,6]H)(H)	C[6,6](C[5,6,6]C[5,6]2H)(C[6,6]C[3,6,6]H)(H)	H(C[6,6]C[3,6,6]C[6,6])	C[6,6](C[3,6,6]C[3,5,6,6]2C)(C[6,6]C[5,6,6]H)(H){1|C<3>,1|H<1>,3|C<4>}	C[6,6](C[5,6,6]C[5,6]2H)(C[6,6]C[3,6,6]H)(H){1|C<3>,2|C<4>,4|H<1>}	H(C[6,6]C[3,6,6]C[6,6])	121.1540	0.000	1	121.1540	0.000	1	122.0657	2.271	3	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3,6,6]-4:C[6,6]-3:H-1:	C[5,6,6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3,6,6]C[3,5,6]2H)(C[6,6]C[5,6,6]H)(H)	C[6,6](C[5,6,6]C[5,6]2H)(C[6,6]C[3,6,6]H)(H)	H(C[6,6]C[3,6,6]C[6,6])	C[6,6](C[3,6,6]C[3,5,6]2H)(C[6,6]C[5,6,6]H)(H){1|C<4>,2|C<3>,2|H<1>}	C[6,6](C[5,6,6]C[5,6]2H)(C[6,6]C[3,6,6]H)(H){2|C<3>,2|C<4>,2|H<1>}	H(C[6,6]C[3,6,6]C[6,6])	122.5215	1.815	2	122.5215	3.295	2	122.0657	2.271	3	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	B[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[6,6,6a]C[6,6]C)(C[6,6]B[3x6]H)(H)	C[6,6](B[3x6]C[6,6,6a]C[6,6]N[6])(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6,6a]C[6,6]C)(C[6,6]B[3x6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6,6](B[3x6]C[6,6,6a]C[6,6]N[6])(C[6,6]C[3x6]H)(H){1|C<4>,1|H<1>,5|C<3>}	H(C[6,6]C[3x6]C[6,6])	122.9740	0.229	2	122.9740	0.052	2	123.1202	0.419	6	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	B[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[6,6]2H)(C[6,6]B[3x6]H)(H)	C[6,6](B[3x6]C[6,6]2N[6])(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6]2H)(C[6,6]B[3x6]H)(H){1|C<2>,1|C<3>,1|C<4>,1|N<3>,2|H<1>}	C[6,6](B[3x6]C[6,6]2N[6])(C[6,6]C[3x6]H)(H){1|C<2>,1|C<4>,3|C<3>,3|H<1>}	H(C[6,6]C[3x6]C[6,6])	123.8385	0.554	2	123.1933	0.659	4	123.1202	0.419	6	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	B[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[6,6]2H)(C[6,6]B[3x6]H)(H)	C[6,6](B[3x6]C[6,6]2N[6])(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6]2H)(C[6,6]B[3x6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6,6](B[3x6]C[6,6]2N[6])(C[6,6]C[3x6]H)(H){2|H<1>,5|C<3>}	H(C[6,6]C[3x6]C[6,6])	122.5480	0.076	2	123.1933	0.659	4	123.1202	0.419	6	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:Br-1:	C[6,6]-3:	C[6,6](C[3x6]C[3x6]C[6,6]H)(C[6,6]C[3x6]Br)(H)	C[6,6](C[3x6]C[3x6]C[6,6]H)(C[6,6]C[3x6]H)(Br)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[3x6]C[6,6]H)(C[6,6]C[3x6]Br)(H){2|C<3>,2|C<4>,2|H<1>}	C[6,6](C[3x6]C[3x6]C[6,6]H)(C[6,6]C[3x6]H)(Br){1|C<3>,2|C<4>,4|H<1>}	H(C[6,6]C[3x6]C[6,6])	123.7290	0.000	1	123.7290	0.000	1	123.5593	0.038	3	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:Br-1:	C[6,6]-3:	C[6,6](C[3x6]C[5,6,6]C[6,6]C)(C[6,6]C[3x6]Br)(H)	C[6,6](C[3x6]C[5,6,6]O[6,6]H)(C[6,6]C[3x6]H)(Br)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[5,6,6]C[6,6]C)(C[6,6]C[3x6]Br)(H){1|C<4>,1|N<3>,1|O<1>,1|O<2>,2|H<1>}	C[6,6](C[3x6]C[5,6,6]O[6,6]H)(C[6,6]C[3x6]H)(Br){1|C<3>,1|H<1>,3|C<4>}	H(C[6,6]C[3x6]C[6,6])	123.3470	0.000	1	123.3470	0.000	1	123.5593	0.038	3	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:Br-1:	C[6,6]-3:	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]Br)(H)	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(Br)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]Br)(H){1|O<1>,1|S<2>,2|C<4>,2|H<1>}	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(Br){1|C<3>,1|C<4>,2|O<2>,3|H<1>}	H(C[6,6]C[3x6]C[6,6])	123.6020	0.000	1	123.6020	0.000	1	123.5593	0.038	3	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:Cl-1:	C[6,6]-3:	C[6,6](C[3x6]C[3x6]C[6,6]H)(C[6,6]C[3x6]Cl)(H)	C[6,6](C[3x6]C[3x6]C[6,6]H)(C[6,6]C[3x6]H)(Cl)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[3x6]C[6,6]H)(C[6,6]C[3x6]Cl)(H){2|C<3>,2|C<4>,2|H<1>}	C[6,6](C[3x6]C[3x6]C[6,6]H)(C[6,6]C[3x6]H)(Cl){1|C<3>,2|C<4>,4|H<1>}	H(C[6,6]C[3x6]C[6,6])	123.5230	0.000	1	123.5230	0.000	1	123.6860	0.053	2	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:Cl-1:	C[6,6]-3:	C[6,6](C[3x6]C[6,6]O[6,6]H)(C[6,6]C[3x6]Cl)(H)	C[6,6](C[3x6]C[3,6,6]N[6,6]H)(C[6,6]C[3x6]H)(Cl)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6]O[6,6]H)(C[6,6]C[3x6]Cl)(H){1|C<4>,1|H<1>,1|N<3>,1|O<1>}	C[6,6](C[3x6]C[3,6,6]N[6,6]H)(C[6,6]C[3x6]H)(Cl){1|C<4>,1|H<1>,2|C<3>,2|O<2>}	H(C[6,6]C[3x6]C[6,6])	123.8490	0.000	1	123.8490	0.000	1	123.6860	0.053	2	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]As[4x6]C[6,6]H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[6,6]P[4x6]H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]As[4x6]C[6,6]H)(C[6,6]C[3x6]H)(H){1|P<4>,2|C<4>,3|H<1>}	C[6,6](C[3x6]C[6,6]P[4x6]H)(C[6,6]C[3x6]H)(H){1|As<3>,1|W<6>,2|C<4>,3|H<1>}	H(C[6,6]C[3x6]C[6,6])	120.7275	0.081	2	120.7275	0.007	2	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[3,5,6,6]N[5a,6,6]H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]N[5a,6,6]C[3,6,6]H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[3,5,6,6]N[5a,6,6]H)(C[6,6]C[3x6]H)(H){1|C<3>,1|H<1>,1|N<3>,3|C<4>}	C[6,6](C[3x6]N[5a,6,6]C[3,6,6]H)(C[6,6]C[3x6]H)(H){1|C<3>,1|N<3>,2|C<4>,2|H<1>}	H(C[6,6]C[3x6]C[6,6])	123.1100	0.000	1	123.1100	0.000	1	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[3,6,6]C[3x6]H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[3x6]C[6,6]C)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[3,6,6]C[3x6]H)(C[6,6]C[3x6]H)(H){1|C<3>,1|H<1>,1|O<2>,4|C<4>}	C[6,6](C[3x6]C[3x6]C[6,6]C)(C[6,6]C[3x6]H)(H){1|C<3>,1|O<1>,2|C<4>,2|H<1>}	H(C[6,6]C[3x6]C[6,6])	122.5090	0.317	2	122.5090	0.100	2	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[3,6,6]C[5,6,6]H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[3,6,6]C[5,6,6]H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[3,6,6]C[5,6,6]H)(C[6,6]C[3x6]H)(H){1|C<3>,3|C<4>,3|H<1>}	C[6,6](C[3x6]C[3,6,6]C[5,6,6]H)(C[6,6]C[3x6]H)(H){1|C<3>,3|C<4>,3|H<1>}	H(C[6,6]C[3x6]C[6,6])	122.5975	0.114	6	122.5975	0.013	6	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[3,6,6]C[6,6]H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[3,6,6]C[6,6]H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[3,6,6]C[6,6]H)(C[6,6]C[3x6]H)(H){3|C<4>,4|H<1>}	C[6,6](C[3x6]C[3,6,6]C[6,6]H)(C[6,6]C[3x6]H)(H){3|C<4>,4|H<1>}	H(C[6,6]C[3x6]C[6,6])	122.7225	0.104	4	122.7225	0.011	4	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[3,6,6]N[6,6]C)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[6,6]O[6,6]C)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[3,6,6]N[6,6]C)(C[6,6]C[3x6]H)(H){2|C<3>,2|C<4>,2|O<2>}	C[6,6](C[3x6]C[6,6]O[6,6]C)(C[6,6]C[3x6]H)(H){1|N<3>,1|O<1>,2|C<4>}	H(C[6,6]C[3x6]C[6,6])	122.7960	0.000	1	122.7960	0.000	1	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[3x6]2H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[3x6]2H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[3x6]2H)(C[6,6]C[3x6]H)(H){1|H<1>,2|C<3>,2|C<4>}	C[6,6](C[3x6]C[3x6]2H)(C[6,6]C[3x6]H)(H){1|H<1>,2|C<3>,2|C<4>}	H(C[6,6]C[3x6]C[6,6])	123.2672	0.097	4	123.2672	0.009	4	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[3x6]C[6,6]C)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[3,6,6]C[3x6]H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[3x6]C[6,6]C)(C[6,6]C[3x6]H)(H){1|C<3>,1|O<1>,2|C<4>,2|H<1>}	C[6,6](C[3x6]C[3,6,6]C[3x6]H)(C[6,6]C[3x6]H)(H){1|C<3>,1|H<1>,1|O<2>,4|C<4>}	H(C[6,6]C[3x6]C[6,6])	121.8645	0.378	2	121.8645	0.143	2	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[3x6]C[6,6]H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[3x6]C[6,6]H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[3x6]C[6,6]H)(C[6,6]C[3x6]H)(H){1|C<2>,1|C<3>,2|C<4>,3|H<1>}	C[6,6](C[3x6]C[3x6]C[6,6]H)(C[6,6]C[3x6]H)(H){1|O<2>,2|C<4>,4|H<1>}	H(C[6,6]C[3x6]C[6,6])	123.3770	0.208	2	122.8496	0.094	21	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[3x6]C[6,6]H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[3x6]C[6,6]H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[3x6]C[6,6]H)(C[6,6]C[3x6]H)(H){1|C<3>,1|F<1>,2|H<1>,3|C<4>}	C[6,6](C[3x6]C[3x6]C[6,6]H)(C[6,6]C[3x6]H)(H){1|C<3>,1|O<1>,2|C<4>,2|H<1>}	H(C[6,6]C[3x6]C[6,6])	122.5940	0.000	1	122.8496	0.094	21	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[3x6]C[6,6]H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[3x6]C[6,6]H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[3x6]C[6,6]H)(C[6,6]C[3x6]H)(H){1|C<3>,1|O<1>,2|C<4>,2|H<1>}	C[6,6](C[3x6]C[3x6]C[6,6]H)(C[6,6]C[3x6]H)(H){1|C<3>,1|F<1>,2|H<1>,3|C<4>}	H(C[6,6]C[3x6]C[6,6])	122.4590	0.000	1	122.8496	0.094	21	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[3x6]C[6,6]H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[3x6]C[6,6]H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[3x6]C[6,6]H)(C[6,6]C[3x6]H)(H){1|C<3>,1|O<1>,2|C<4>,2|H<1>}	C[6,6](C[3x6]C[3x6]C[6,6]H)(C[6,6]C[3x6]H)(H){1|C<3>,1|O<2>,2|H<1>,3|C<4>}	H(C[6,6]C[3x6]C[6,6])	122.3730	0.000	1	122.8496	0.094	21	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[3x6]C[6,6]H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[3x6]C[6,6]H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[3x6]C[6,6]H)(C[6,6]C[3x6]H)(H){1|C<3>,1|O<2>,2|H<1>,3|C<4>}	C[6,6](C[3x6]C[3x6]C[6,6]H)(C[6,6]C[3x6]H)(H){1|C<3>,1|O<1>,2|C<4>,2|H<1>}	H(C[6,6]C[3x6]C[6,6])	123.0550	0.000	1	122.8496	0.094	21	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[3x6]C[6,6]H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[3x6]C[6,6]H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[3x6]C[6,6]H)(C[6,6]C[3x6]H)(H){1|C<3>,2|C<4>,4|H<1>}	C[6,6](C[3x6]C[3x6]C[6,6]H)(C[6,6]C[3x6]H)(H){1|C<3>,2|C<4>,4|H<1>}	H(C[6,6]C[3x6]C[6,6])	122.7621	0.097	9	122.8496	0.094	21	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[3x6]C[6,6]H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[3x6]C[6,6]H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[3x6]C[6,6]H)(C[6,6]C[3x6]H)(H){1|C<3>,2|C<4>,4|H<1>}	C[6,6](C[3x6]C[3x6]C[6,6]H)(C[6,6]C[3x6]H)(H){1|C<3>,3|C<4>,3|H<1>}	H(C[6,6]C[3x6]C[6,6])	122.6990	0.000	1	122.8496	0.094	21	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[3x6]C[6,6]H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[3x6]C[6,6]H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[3x6]C[6,6]H)(C[6,6]C[3x6]H)(H){1|C<3>,2|C<4>,4|H<1>}	C[6,6](C[3x6]C[3x6]C[6,6]H)(C[6,6]C[3x6]H)(H){3|C<4>,4|H<1>}	H(C[6,6]C[3x6]C[6,6])	122.8170	0.000	1	122.8496	0.094	21	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[3x6]C[6,6]H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[3x6]C[6,6]H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[3x6]C[6,6]H)(C[6,6]C[3x6]H)(H){1|C<3>,3|C<4>,3|H<1>}	C[6,6](C[3x6]C[3x6]C[6,6]H)(C[6,6]C[3x6]H)(H){1|C<3>,2|C<4>,4|H<1>}	H(C[6,6]C[3x6]C[6,6])	122.8130	0.000	1	122.8496	0.094	21	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[3x6]C[6,6]H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[3x6]C[6,6]H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[3x6]C[6,6]H)(C[6,6]C[3x6]H)(H){1|O<2>,2|C<4>,4|H<1>}	C[6,6](C[3x6]C[3x6]C[6,6]H)(C[6,6]C[3x6]H)(H){1|C<2>,1|C<3>,2|C<4>,3|H<1>}	H(C[6,6]C[3x6]C[6,6])	123.3615	0.284	2	122.8496	0.094	21	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[3x6]C[6,6]H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[3x6]C[6,6]H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[3x6]C[6,6]H)(C[6,6]C[3x6]H)(H){3|C<4>,4|H<1>}	C[6,6](C[3x6]C[3x6]C[6,6]H)(C[6,6]C[3x6]H)(H){1|C<3>,2|C<4>,4|H<1>}	H(C[6,6]C[3x6]C[6,6])	122.6960	0.000	1	122.8496	0.094	21	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[3x6]C[6,6]O)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[3x6]O[6,6]H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[3x6]C[6,6]O)(C[6,6]C[3x6]H)(H){1|H<1>,1|O<1>,1|O<2>,3|C<4>}	C[6,6](C[3x6]C[3x6]O[6,6]H)(C[6,6]C[3x6]H)(H){1|C<3>,1|H<1>,1|O<2>,2|C<4>}	H(C[6,6]C[3x6]C[6,6])	123.2910	0.000	1	123.2910	0.000	1	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[3x6]O[6,6]H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[3x6]C[6,6]O)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[3x6]O[6,6]H)(C[6,6]C[3x6]H)(H){1|C<3>,1|H<1>,1|O<2>,2|C<4>}	C[6,6](C[3x6]C[3x6]C[6,6]O)(C[6,6]C[3x6]H)(H){1|H<1>,1|O<1>,1|O<2>,3|C<4>}	H(C[6,6]C[3x6]C[6,6])	123.3570	0.000	1	123.3570	0.000	1	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[4,3x6]C[6,6]H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[4,3x6]C[6,6]H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[4,3x6]C[6,6]H)(C[6,6]C[3x6]H)(H){1|C<3>,3|C<4>,3|H<1>}	C[6,6](C[3x6]C[4,3x6]C[6,6]H)(C[6,6]C[3x6]H)(H){1|C<3>,3|C<4>,3|H<1>}	H(C[6,6]C[3x6]C[6,6])	122.9045	0.216	2	122.9045	0.047	2	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[4,5,3x6]C[3x6]H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[4,5,3x6]C[3x6]H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[4,5,3x6]C[3x6]H)(C[6,6]C[3x6]H)(H){1|O<2>,2|H<1>,4|C<4>}	C[6,6](C[3x6]C[4,5,3x6]C[3x6]H)(C[6,6]C[3x6]H)(H){2|C<3>,2|H<1>,3|C<4>}	H(C[6,6]C[3x6]C[6,6])	122.3575	0.117	2	122.5062	0.038	4	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[4,5,3x6]C[3x6]H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[4,5,3x6]C[3x6]H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[4,5,3x6]C[3x6]H)(C[6,6]C[3x6]H)(H){2|C<3>,2|H<1>,3|C<4>}	C[6,6](C[3x6]C[4,5,3x6]C[3x6]H)(C[6,6]C[3x6]H)(H){1|O<2>,2|H<1>,4|C<4>}	H(C[6,6]C[3x6]C[6,6])	122.6550	0.113	2	122.5062	0.038	4	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[4,5,3x6]C[6,6]H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[4,5,3x6]C[6,6]H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[4,5,3x6]C[6,6]H)(C[6,6]C[3x6]H)(H){1|C<3>,3|C<4>,3|H<1>}	C[6,6](C[3x6]C[4,5,3x6]C[6,6]H)(C[6,6]C[3x6]H)(H){1|C<3>,3|C<4>,3|H<1>}	H(C[6,6]C[3x6]C[6,6])	124.3335	0.077	2	122.9191	0.789	8	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[4,5,3x6]C[6,6]H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[4,5,3x6]C[6,6]H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[4,5,3x6]C[6,6]H)(C[6,6]C[3x6]H)(H){1|O<2>,3|C<4>,3|H<1>}	C[6,6](C[3x6]C[4,5,3x6]C[6,6]H)(C[6,6]C[3x6]H)(H){2|C<3>,2|H<1>,3|C<4>}	H(C[6,6]C[3x6]C[6,6])	122.2933	0.077	3	122.9191	0.789	8	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[4,5,3x6]C[6,6]H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[4,5,3x6]C[6,6]H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[4,5,3x6]C[6,6]H)(C[6,6]C[3x6]H)(H){2|C<3>,2|H<1>,3|C<4>}	C[6,6](C[3x6]C[4,5,3x6]C[6,6]H)(C[6,6]C[3x6]H)(H){1|O<2>,3|C<4>,3|H<1>}	H(C[6,6]C[3x6]C[6,6])	122.6020	0.120	3	122.9191	0.789	8	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[4,5,6,6]C[6,6]H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[4,5,6,6]C[6,6]H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[4,5,6,6]C[6,6]H)(C[6,6]C[3x6]H)(H){1|C<2>,1|H<1>,2|C<3>,2|C<4>}	C[6,6](C[3x6]C[4,5,6,6]C[6,6]H)(C[6,6]C[3x6]H)(H){1|C<2>,1|H<1>,2|C<3>,2|C<4>}	H(C[6,6]C[3x6]C[6,6])	122.1080	0.150	2	122.1080	0.022	2	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[4,6,6]C[3x6]H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[4,6,6]C[3x6]H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[4,6,6]C[3x6]H)(C[6,6]C[3x6]H)(H){1|C<3>,3|C<4>,3|H<1>}	C[6,6](C[3x6]C[4,6,6]C[3x6]H)(C[6,6]C[3x6]H)(H){3|H<1>,4|C<4>}	H(C[6,6]C[3x6]C[6,6])	122.9500	0.000	1	122.6770	0.149	2	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[4,6,6]C[3x6]H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[4,6,6]C[3x6]H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[4,6,6]C[3x6]H)(C[6,6]C[3x6]H)(H){3|H<1>,4|C<4>}	C[6,6](C[3x6]C[4,6,6]C[3x6]H)(C[6,6]C[3x6]H)(H){1|C<3>,3|C<4>,3|H<1>}	H(C[6,6]C[3x6]C[6,6])	122.4040	0.000	1	122.6770	0.149	2	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[4x6]C[6,6]H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[4x6]C[6,6]H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[4x6]C[6,6]H)(C[6,6]C[3x6]H)(H){3|C<4>,4|H<1>}	C[6,6](C[3x6]C[4x6]C[6,6]H)(C[6,6]C[3x6]H)(H){3|C<4>,4|H<1>}	H(C[6,6]C[3x6]C[6,6])	122.7008	0.104	5	122.7008	0.011	5	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[5,3x6]C[6,6]H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[5,3x6]C[6,6]H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[5,3x6]C[6,6]H)(C[6,6]C[3x6]H)(H){2|C<3>,2|H<1>,3|C<4>}	C[6,6](C[3x6]C[5,3x6]C[6,6]H)(C[6,6]C[3x6]H)(H){2|C<3>,2|H<1>,3|C<4>}	H(C[6,6]C[3x6]C[6,6])	122.8790	0.000	1	122.8790	0.000	1	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[5,3x6]C[6,6]H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[5,3x6]C[6,6]H)(C[6,6]C[3x6]H)(H){1|O<2>,3|C<4>,3|H<1>}	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(H){2|C<4>,5|H<1>}	H(C[6,6]C[3x6]C[6,6])	122.6730	0.000	1	122.6730	0.000	1	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[5,6,6]2C)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[5,6,6]2H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[5,6,6]2C)(C[6,6]C[3x6]H)(H){1|O<2>,3|C<4>,3|H<1>}	C[6,6](C[3x6]C[5,6,6]2H)(C[6,6]C[3x6]H)(H){1|O<2>,2|H<1>,4|C<4>}	H(C[6,6]C[3x6]C[6,6])	123.4905	1.375	2	123.4905	1.892	2	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[5,6,6]2H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[5,6,6]2C)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[5,6,6]2H)(C[6,6]C[3x6]H)(H){1|O<2>,2|H<1>,4|C<4>}	C[6,6](C[3x6]C[5,6,6]2C)(C[6,6]C[3x6]H)(H){1|O<2>,3|C<4>,3|H<1>}	H(C[6,6]C[3x6]C[6,6])	123.2955	0.078	2	123.2955	0.006	2	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[5,6,6]2H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[5,6,6]2H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[5,6,6]2H)(C[6,6]C[3x6]H)(H){1|C<3>,1|N<2>,1|O<2>,2|C<4>,2|H<1>}	C[6,6](C[3x6]C[5,6,6]2H)(C[6,6]C[3x6]H)(H){1|O<2>,2|H<1>,4|C<4>}	H(C[6,6]C[3x6]C[6,6])	122.6130	0.000	1	122.6718	0.013	10	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[5,6,6]2H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[5,6,6]2H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[5,6,6]2H)(C[6,6]C[3x6]H)(H){1|O<2>,2|H<1>,4|C<4>}	C[6,6](C[3x6]C[5,6,6]2H)(C[6,6]C[3x6]H)(H){1|C<3>,1|N<2>,1|O<2>,2|C<4>,2|H<1>}	H(C[6,6]C[3x6]C[6,6])	122.9510	0.000	1	122.6718	0.013	10	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[5,6,6]2H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[5,6,6]2H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[5,6,6]2H)(C[6,6]C[3x6]H)(H){2|C<3>,2|C<4>,3|H<1>}	C[6,6](C[3x6]C[5,6,6]2H)(C[6,6]C[3x6]H)(H){2|C<3>,2|C<4>,3|H<1>}	H(C[6,6]C[3x6]C[6,6])	122.6442	0.063	8	122.6718	0.013	10	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[5,6,6]2H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[5,6,6]N[5,6,6]H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[5,6,6]2H)(C[6,6]C[3x6]H)(H){1|N<3>,2|C<3>,2|C<4>,2|H<1>}	C[6,6](C[3x6]C[5,6,6]N[5,6,6]H)(C[6,6]C[3x6]H)(H){2|C<3>,2|C<4>,2|H<1>}	H(C[6,6]C[3x6]C[6,6])	122.9030	0.000	1	122.9030	0.000	1	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[5,6,6]C[6,6]Br)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[5,6,6]C[6,6]Br)(C[6,6]C[3x6]H)(H){1|Br<1>,1|C<3>,2|C<4>,3|H<1>}	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]H)(H){1|Br<1>,3|C<4>,3|H<1>}	H(C[6,6]C[3x6]C[6,6])	123.7540	0.000	1	123.6113	0.025	3	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[5,6,6]C[6,6]Br)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[5,6,6]C[6,6]Br)(C[6,6]C[3x6]H)(H){1|Br<1>,3|C<4>,3|H<1>}	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]H)(H){1|Br<1>,1|C<3>,2|C<4>,3|H<1>}	H(C[6,6]C[3x6]C[6,6])	123.5400	0.143	2	123.6113	0.025	3	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[5,6,6]C[6,6]C)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[5,6,6]C[6,6]C)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[5,6,6]C[6,6]C)(C[6,6]C[3x6]H)(H){1|C<3>,3|C<4>,3|H<1>}	C[6,6](C[3x6]C[5,6,6]C[6,6]C)(C[6,6]C[3x6]H)(H){1|C<3>,3|C<4>,3|H<1>}	H(C[6,6]C[3x6]C[6,6])	121.8307	0.382	4	121.8307	0.146	4	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[5,6,6]C[6,6]C)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[5,6,6]C[6,6]C)(C[6,6]C[3x6]H)(H){1|C<3>,1|O<2>,2|C<4>,3|H<1>}	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]H)(H){1|H<1>,1|O<1>,4|C<4>}	H(C[6,6]C[3x6]C[6,6])	123.5468	0.713	4	123.5468	0.508	4	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[5,6,6]C[6,6]C)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[5,6,6]N[6,6]H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[5,6,6]C[6,6]C)(C[6,6]C[3x6]H)(H){1|C<4>,1|N<3>,2|C<3>,3|H<1>}	C[6,6](C[3x6]C[5,6,6]N[6,6]H)(C[6,6]C[3x6]H)(H){1|H<1>,2|C<3>,3|C<4>}	H(C[6,6]C[3x6]C[6,6])	122.9040	0.000	1	122.9040	0.000	1	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[5,6,6]C[6,6]C)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[5,6,6]C[6,6]C)(C[6,6]C[3x6]H)(H){2|H<1>,2|O<2>,3|C<4>}	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(H){3|C<4>,4|H<1>}	H(C[6,6]C[3x6]C[6,6])	122.2880	0.404	4	122.2880	0.163	4	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[5,6,6]C[6,6]Br)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]H)(H){1|Br<1>,1|C<3>,2|C<4>,3|H<1>}	C[6,6](C[3x6]C[5,6,6]C[6,6]Br)(C[6,6]C[3x6]H)(H){1|Br<1>,3|C<4>,3|H<1>}	H(C[6,6]C[3x6]C[6,6])	122.4550	0.035	2	122.4450	0.001	3	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[5,6,6]C[6,6]Br)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]H)(H){1|Br<1>,3|C<4>,3|H<1>}	C[6,6](C[3x6]C[5,6,6]C[6,6]Br)(C[6,6]C[3x6]H)(H){1|Br<1>,1|C<3>,2|C<4>,3|H<1>}	H(C[6,6]C[3x6]C[6,6])	122.4250	0.000	1	122.4450	0.001	3	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[5,6,6]C[6,6]C)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]H)(H){1|H<1>,1|O<1>,4|C<4>}	C[6,6](C[3x6]C[5,6,6]C[6,6]C)(C[6,6]C[3x6]H)(H){1|C<3>,1|O<2>,2|C<4>,3|H<1>}	H(C[6,6]C[3x6]C[6,6])	123.7280	0.410	4	123.7280	0.168	4	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]H)(H){1|C<2>,1|C<3>,1|C<4>,1|O<2>,2|H<1>}	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]H)(H){1|C<2>,1|C<3>,1|C<4>,1|O<2>,2|H<1>}	H(C[6,6]C[3x6]C[6,6])	122.8260	0.055	2	122.9650	0.163	24	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]H)(H){1|C<3>,1|O<2>,2|C<4>,3|H<1>}	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]H)(H){1|C<3>,1|O<2>,2|C<4>,3|H<1>}	H(C[6,6]C[3x6]C[6,6])	122.7320	0.181	2	122.9650	0.163	24	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]H)(H){1|C<3>,2|C<4>,4|H<1>}	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]H)(H){1|C<3>,2|C<4>,4|H<1>}	H(C[6,6]C[3x6]C[6,6])	122.7070	0.214	2	122.9650	0.163	24	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]H)(H){1|C<3>,2|C<4>,4|H<1>}	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]H)(H){3|C<4>,4|H<1>}	H(C[6,6]C[3x6]C[6,6])	122.9530	0.286	2	122.9650	0.163	24	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]H)(H){1|C<3>,3|C<4>,3|H<1>}	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]H)(H){2|C<3>,2|C<4>,3|H<1>}	H(C[6,6]C[3x6]C[6,6])	122.7535	0.337	2	122.9650	0.163	24	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]H)(H){1|C<4>,2|C<3>,3|H<1>}	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]H)(H){1|C<4>,2|C<3>,3|H<1>}	H(C[6,6]C[3x6]C[6,6])	123.3303	0.477	8	122.9650	0.163	24	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]H)(H){2|C<3>,2|C<4>,3|H<1>}	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]H)(H){1|C<3>,3|C<4>,3|H<1>}	H(C[6,6]C[3x6]C[6,6])	122.8620	0.178	2	122.9650	0.163	24	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]H)(H){3|C<4>,4|H<1>}	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]H)(H){1|C<3>,2|C<4>,4|H<1>}	H(C[6,6]C[3x6]C[6,6])	122.5975	0.237	2	122.9650	0.163	24	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]H)(H){3|C<4>,4|H<1>}	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]H)(H){3|C<4>,4|H<1>}	H(C[6,6]C[3x6]C[6,6])	122.8285	0.131	2	122.9650	0.163	24	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[5,6,6]C[6,6]O)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]H)(H){1|C<3>,1|H<1>,1|O<1>,1|O<2>,2|C<4>}	C[6,6](C[3x6]C[5,6,6]C[6,6]O)(C[6,6]C[3x6]H)(H){1|C<4>,2|C<3>,2|H<1>,2|O<2>}	H(C[6,6]C[3x6]C[6,6])	122.0290	0.000	1	123.5380	2.559	5	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[5,6,6]C[6,6]O)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]H)(H){1|C<3>,1|H<1>,1|O<1>,1|O<2>,2|C<4>}	C[6,6](C[3x6]C[5,6,6]C[6,6]O)(C[6,6]C[3x6]H)(H){1|C<4>,2|C<3>,4|H<1>}	H(C[6,6]C[3x6]C[6,6])	123.7590	0.000	1	123.5380	2.559	5	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[5,6,6]C[6,6]O)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]H)(H){1|C<3>,1|O<2>,1|W<7>,2|C<4>,2|H<1>}	C[6,6](C[3x6]C[5,6,6]C[6,6]O)(C[6,6]C[3x6]H)(H){1|C<3>,1|W<7>,2|C<4>,3|H<1>}	H(C[6,6]C[3x6]C[6,6])	124.5840	2.253	2	123.5380	2.559	5	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[5,6,6]C[6,6]O)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]H)(H){1|C<3>,1|O<2>,2|C<4>,3|H<1>}	C[6,6](C[3x6]C[5,6,6]C[6,6]O)(C[6,6]C[3x6]H)(H){1|C<3>,2|C<4>,4|H<1>}	H(C[6,6]C[3x6]C[6,6])	122.7340	0.000	1	123.5380	2.559	5	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[5,6,6]N[6,6]C)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]H)(H){1|C<3>,1|N<3>,2|H<1>,3|C<4>}	C[6,6](C[3x6]C[5,6,6]N[6,6]C)(C[6,6]C[3x6]H)(H){1|C<3>,2|H<1>,3|C<4>}	H(C[6,6]C[3x6]C[6,6])	123.1040	0.125	4	123.0968	0.012	5	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[5,6,6]N[6,6]C)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]H)(H){1|N<3>,2|C<3>,2|C<4>,2|H<1>}	C[6,6](C[3x6]C[5,6,6]N[6,6]C)(C[6,6]C[3x6]H)(H){1|C<3>,2|H<1>,3|C<4>}	H(C[6,6]C[3x6]C[6,6])	123.0680	0.000	1	123.0968	0.012	5	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]N[5,6,6]C[6,6]H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]H)(H){1|C<3>,1|N<3>,2|C<4>,3|H<1>}	C[6,6](C[3x6]N[5,6,6]C[6,6]H)(C[6,6]C[3x6]H)(H){1|Cl<1>,1|C<2>,1|C<3>,1|H<1>,2|C<4>}	H(C[6,6]C[3x6]C[6,6])	122.9050	0.000	1	122.8853	0.021	3	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]N[5,6,6]C[6,6]H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]H)(H){1|C<3>,1|N<3>,2|H<1>,3|C<4>}	C[6,6](C[3x6]N[5,6,6]C[6,6]H)(C[6,6]C[3x6]H)(H){2|C<3>,2|C<4>,2|H<1>}	H(C[6,6]C[3x6]C[6,6])	122.8755	0.202	2	122.8853	0.021	3	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[5,6,6]C[6,6]O)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[5,6,6]C[6,6]O)(C[6,6]C[3x6]H)(H){1|C<3>,1|W<7>,2|C<4>,3|H<1>}	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]H)(H){1|C<3>,1|O<2>,1|W<7>,2|C<4>,2|H<1>}	H(C[6,6]C[3x6]C[6,6])	122.1735	0.043	2	122.7788	1.277	5	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[5,6,6]C[6,6]O)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[5,6,6]C[6,6]O)(C[6,6]C[3x6]H)(H){1|C<3>,2|C<4>,4|H<1>}	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]H)(H){1|C<3>,1|O<2>,2|C<4>,3|H<1>}	H(C[6,6]C[3x6]C[6,6])	122.2240	0.000	1	122.7788	1.277	5	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[5,6,6]C[6,6]O)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[5,6,6]C[6,6]O)(C[6,6]C[3x6]H)(H){1|C<4>,2|C<3>,2|H<1>,2|O<2>}	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]H)(H){1|C<3>,1|H<1>,1|O<1>,1|O<2>,2|C<4>}	H(C[6,6]C[3x6]C[6,6])	122.5420	0.000	1	122.7788	1.277	5	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[5,6,6]C[6,6]O)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[5,6,6]C[6,6]O)(C[6,6]C[3x6]H)(H){1|C<4>,2|C<3>,4|H<1>}	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]H)(H){1|C<3>,1|H<1>,1|O<1>,1|O<2>,2|C<4>}	H(C[6,6]C[3x6]C[6,6])	124.7810	0.000	1	122.7788	1.277	5	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[5,6,6]C[6,6]O)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[5,6,6]O[6,6]H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[5,6,6]C[6,6]O)(C[6,6]C[3x6]H)(H){1|C<3>,1|C<4>,1|O<1>,1|O<2>,2|H<1>}	C[6,6](C[3x6]C[5,6,6]O[6,6]H)(C[6,6]C[3x6]H)(H){1|C<4>,1|H<1>,1|O<2>,2|C<3>}	H(C[6,6]C[3x6]C[6,6])	123.0690	0.283	2	123.0690	0.080	2	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[5,6,6]C[6,6]O)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[5,6,6]C[6,6]O)(C[6,6]C[3x6]H)(H){2|C<4>,2|S<2>,3|H<1>}	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(H){1|O<2>,2|C<4>,4|H<1>}	H(C[6,6]C[3x6]C[6,6])	116.7450	3.132	2	116.7450	9.812	2	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[5,6,6]N[5,6,6]H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[5,6,6]2H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[5,6,6]N[5,6,6]H)(C[6,6]C[3x6]H)(H){2|C<3>,2|C<4>,2|H<1>}	C[6,6](C[3x6]C[5,6,6]2H)(C[6,6]C[3x6]H)(H){1|N<3>,2|C<3>,2|C<4>,2|H<1>}	H(C[6,6]C[3x6]C[6,6])	122.9420	0.000	1	122.9420	0.000	1	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[5,6,6]N[6,6]C)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[5,6,6]N[6,6]C)(C[6,6]C[3x6]H)(H){1|C<3>,2|H<1>,3|C<4>}	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]H)(H){1|C<3>,1|N<3>,2|H<1>,3|C<4>}	H(C[6,6]C[3x6]C[6,6])	123.1020	0.194	4	123.0620	0.036	5	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[5,6,6]N[6,6]C)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[5,6,6]N[6,6]C)(C[6,6]C[3x6]H)(H){1|C<3>,2|H<1>,3|C<4>}	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]H)(H){1|N<3>,2|C<3>,2|C<4>,2|H<1>}	H(C[6,6]C[3x6]C[6,6])	122.9020	0.000	1	123.0620	0.036	5	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[5,6,6]N[6,6]H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[5,6,6]C[6,6]C)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[5,6,6]N[6,6]H)(C[6,6]C[3x6]H)(H){1|H<1>,2|C<3>,3|C<4>}	C[6,6](C[3x6]C[5,6,6]C[6,6]C)(C[6,6]C[3x6]H)(H){1|C<4>,1|N<3>,2|C<3>,3|H<1>}	H(C[6,6]C[3x6]C[6,6])	122.8530	0.000	1	122.8530	0.000	1	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[5,6,6]N[6,6]H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[5,6,6]N[6,6]H)(C[6,6]C[3x6]H)(H){1|H<1>,2|C<4>,3|C<3>}	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(H){1|C<3>,1|C<4>,1|N<3>,4|H<1>}	H(C[6,6]C[3x6]C[6,6])	122.6350	0.000	1	122.6350	0.000	1	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[5,6,6]O[6,6]H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[5,6,6]C[6,6]O)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[5,6,6]O[6,6]H)(C[6,6]C[3x6]H)(H){1|C<4>,1|H<1>,1|O<2>,2|C<3>}	C[6,6](C[3x6]C[5,6,6]C[6,6]O)(C[6,6]C[3x6]H)(H){1|C<3>,1|C<4>,1|O<1>,1|O<2>,2|H<1>}	H(C[6,6]C[3x6]C[6,6])	123.3650	0.211	2	123.3650	0.044	2	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[5a,6,6]C[6,6]H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[5a,6,6]C[6,6]H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[5a,6,6]C[6,6]H)(C[6,6]C[3x6]H)(H){1|C<4>,2|C<3>,3|H<1>}	C[6,6](C[3x6]C[5a,6,6]C[6,6]H)(C[6,6]C[3x6]H)(H){1|C<4>,2|C<3>,3|H<1>}	H(C[6,6]C[3x6]C[6,6])	123.5512	1.065	16	123.5512	1.134	16	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[5x3,5x5,22x6]C[6,6,6a]H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[5x3,5x5,22x6]C[6,6,6a]H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[5x3,5x5,22x6]C[6,6,6a]H)(C[6,6]C[3x6]H)(H){1|C<6>,1|H<1>,2|C<3>,4|B<6>}	C[6,6](C[3x6]C[5x3,5x5,22x6]C[6,6,6a]H)(C[6,6]C[3x6]H)(H){1|C<6>,1|H<1>,2|C<3>,4|B<6>}	H(C[6,6]C[3x6]C[6,6])	122.5635	0.206	4	122.5635	0.043	4	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[5x3,5x5,22x6]C[6,6]C)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[5x3,5x5,22x6]C[6,6]H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[5x3,5x5,22x6]C[6,6]C)(C[6,6]C[3x6]H)(H){1|C<3>,1|C<6>,2|H<1>,4|B<6>}	C[6,6](C[3x6]C[5x3,5x5,22x6]C[6,6]H)(C[6,6]C[3x6]H)(H){1|C<3>,1|C<4>,1|C<6>,1|H<1>,4|B<6>}	H(C[6,6]C[3x6]C[6,6])	122.2355	0.069	2	122.2355	0.005	2	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[5x3,5x5,22x6]C[6,6]H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[5x3,5x5,22x6]C[6,6]C)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[5x3,5x5,22x6]C[6,6]H)(C[6,6]C[3x6]H)(H){1|C<3>,1|C<4>,1|C<6>,1|H<1>,4|B<6>}	C[6,6](C[3x6]C[5x3,5x5,22x6]C[6,6]C)(C[6,6]C[3x6]H)(H){1|C<3>,1|C<6>,2|H<1>,4|B<6>}	H(C[6,6]C[3x6]C[6,6])	122.8490	0.025	2	122.8490	0.001	2	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[5x3,5x5,22x6]C[6,6]H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[5x3,5x5,22x6]C[6,6]H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[5x3,5x5,22x6]C[6,6]H)(C[6,6]C[3x6]H)(H){1|C<3>,1|C<6>,3|H<1>,4|B<6>}	C[6,6](C[3x6]C[5x3,5x5,22x6]C[6,6]H)(C[6,6]C[3x6]H)(H){1|C<4>,1|C<6>,1|H<1>,1|O<1>,4|B<6>}	H(C[6,6]C[3x6]C[6,6])	121.6695	0.344	2	122.2163	0.443	4	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[5x3,5x5,22x6]C[6,6]H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[5x3,5x5,22x6]C[6,6]H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[5x3,5x5,22x6]C[6,6]H)(C[6,6]C[3x6]H)(H){1|C<4>,1|C<6>,1|H<1>,1|O<1>,4|B<6>}	C[6,6](C[3x6]C[5x3,5x5,22x6]C[6,6]H)(C[6,6]C[3x6]H)(H){1|C<3>,1|C<6>,3|H<1>,4|B<6>}	H(C[6,6]C[3x6]C[6,6])	122.7630	0.126	2	122.2163	0.443	4	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[5x3,5x5,22x6]C[6,6]H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[5x3,5x5,22x6]C[6,6]Si)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[5x3,5x5,22x6]C[6,6]H)(C[6,6]C[3x6]H)(H){1|Si<4>,1|C<3>,1|C<6>,1|H<1>,4|B<6>}	C[6,6](C[3x6]C[5x3,5x5,22x6]C[6,6]Si)(C[6,6]C[3x6]H)(H){1|C<3>,1|C<6>,2|H<1>,4|B<6>}	H(C[6,6]C[3x6]C[6,6])	122.9315	0.183	2	122.9315	0.034	2	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[5x3,5x5,22x6]C[6,6]Si)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[5x3,5x5,22x6]C[6,6]H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[5x3,5x5,22x6]C[6,6]Si)(C[6,6]C[3x6]H)(H){1|C<3>,1|C<6>,2|H<1>,4|B<6>}	C[6,6](C[3x6]C[5x3,5x5,22x6]C[6,6]H)(C[6,6]C[3x6]H)(H){1|Si<4>,1|C<3>,1|C<6>,1|H<1>,4|B<6>}	H(C[6,6]C[3x6]C[6,6])	121.9140	0.044	2	121.9140	0.002	2	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[6,6,6a]2H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[6,6,6a]2H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6,6a]2H)(C[6,6]C[3x6]H)(H){1|H<1>,4|C<3>}	C[6,6](C[3x6]C[6,6,6a]2H)(C[6,6]C[3x6]H)(H){1|H<1>,4|C<3>}	H(C[6,6]C[3x6]C[6,6])	123.3375	0.708	6	123.3375	0.501	6	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[6,6,6a]C[3,6,6]H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[6,6,6a]C[3,6,6]H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6,6a]C[3,6,6]H)(C[6,6]C[3x6]H)(H){2|C<3>,2|C<4>,2|H<1>}	C[6,6](C[3x6]C[6,6,6a]C[3,6,6]H)(C[6,6]C[3x6]H)(H){2|C<3>,2|C<4>,2|H<1>}	H(C[6,6]C[3x6]C[6,6])	123.6100	0.922	2	123.6100	0.850	2	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[6,6,6a]C[4,6,6]H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[6,6,6a]C[4,6,6]H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6,6a]C[4,6,6]H)(C[6,6]C[3x6]H)(H){2|C<3>,2|C<4>,2|H<1>}	C[6,6](C[3x6]C[6,6,6a]C[4,6,6]H)(C[6,6]C[3x6]H)(H){2|C<3>,2|C<4>,2|H<1>}	H(C[6,6]C[3x6]C[6,6])	122.4635	0.081	2	122.4635	0.007	2	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[6,6,6a]C[5,3x6]H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[6,6,6a]C[5,3x6]H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6,6a]C[5,3x6]H)(C[6,6]C[3x6]H)(H){2|C<3>,2|C<4>,2|H<1>}	C[6,6](C[3x6]C[6,6,6a]C[5,3x6]H)(C[6,6]C[3x6]H)(H){2|C<3>,2|C<4>,2|H<1>}	H(C[6,6]C[3x6]C[6,6])	126.3897	2.917	4	126.3897	8.510	4	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[6,6,6a]C[5,6,6]H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[6,6,6a]C[5,6,6]H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6,6a]C[5,6,6]H)(C[6,6]C[3x6]H)(H){1|C<4>,1|O<2>,2|C<3>,2|H<1>}	C[6,6](C[3x6]C[6,6,6a]C[5,6,6]H)(C[6,6]C[3x6]H)(H){1|C<4>,1|O<2>,2|C<3>,2|H<1>}	H(C[6,6]C[3x6]C[6,6])	122.6875	0.022	2	122.7278	0.017	12	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[6,6,6a]C[5,6,6]H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[6,6,6a]C[5,6,6]H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6,6a]C[5,6,6]H)(C[6,6]C[3x6]H)(H){1|C<4>,2|H<1>,3|C<3>}	C[6,6](C[3x6]C[6,6,6a]C[5,6,6]H)(C[6,6]C[3x6]H)(H){1|C<4>,2|H<1>,3|C<3>}	H(C[6,6]C[3x6]C[6,6])	122.7359	0.142	10	122.7278	0.017	12	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[6,6,6a]C[6,6]C)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[6,6,6a]C[6,6]H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6,6a]C[6,6]C)(C[6,6]C[3x6]H)(H){1|C<4>,2|C<3>,3|H<1>}	C[6,6](C[3x6]C[6,6,6a]C[6,6]H)(C[6,6]C[3x6]H)(H){1|C<2>,1|C<4>,1|N<3>,3|C<3>}	H(C[6,6]C[3x6]C[6,6])	122.9283	0.117	3	122.9283	0.014	3	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[6,6,6a]C[6,6]H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[6,6,6a]C[6,6]C)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6,6a]C[6,6]H)(C[6,6]C[3x6]H)(H){1|C<2>,1|C<4>,1|N<3>,3|C<3>}	C[6,6](C[3x6]C[6,6,6a]C[6,6]C)(C[6,6]C[3x6]H)(H){1|C<4>,2|C<3>,3|H<1>}	H(C[6,6]C[3x6]C[6,6])	122.5747	0.163	3	122.5747	0.027	3	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[6,6,6a]C[6,6]H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[6,6,6a]C[6,6]H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6,6a]C[6,6]H)(C[6,6]C[3x6]H)(H){1|Br<1>,1|H<1>,3|C<3>}	C[6,6](C[3x6]C[6,6,6a]C[6,6]H)(C[6,6]C[3x6]H)(H){1|Br<1>,1|H<1>,3|C<3>}	H(C[6,6]C[3x6]C[6,6])	123.0935	0.071	2	124.1431	4.504	12	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[6,6,6a]C[6,6]H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[6,6,6a]C[6,6]H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6,6a]C[6,6]H)(C[6,6]C[3x6]H)(H){1|C<4>,2|C<3>,3|H<1>}	C[6,6](C[3x6]C[6,6,6a]C[6,6]H)(C[6,6]C[3x6]H)(H){1|C<4>,2|C<3>,3|H<1>}	H(C[6,6]C[3x6]C[6,6])	123.2302	0.209	4	124.1431	4.504	12	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[6,6,6a]C[6,6]H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[6,6,6a]C[6,6]H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6,6a]C[6,6]H)(C[6,6]C[3x6]H)(H){1|H<1>,4|C<3>}	C[6,6](C[3x6]C[6,6,6a]C[6,6]H)(C[6,6]C[3x6]H)(H){1|H<1>,4|C<3>}	H(C[6,6]C[3x6]C[6,6])	125.1015	2.770	6	124.1431	4.504	12	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[6,6,6a]C[6,6]H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[6,6,6a]C[6,6]O)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6,6a]C[6,6]H)(C[6,6]C[3x6]H)(H){1|C<4>,1|O<2>,2|C<3>,2|H<1>}	C[6,6](C[3x6]C[6,6,6a]C[6,6]O)(C[6,6]C[3x6]H)(H){1|C<4>,2|C<3>,3|H<1>}	H(C[6,6]C[3x6]C[6,6])	123.5230	0.000	1	123.5230	0.000	1	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[6,6,6a]C[6,6]O)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[6,6,6a]C[6,6]H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6,6a]C[6,6]O)(C[6,6]C[3x6]H)(H){1|C<4>,2|C<3>,3|H<1>}	C[6,6](C[3x6]C[6,6,6a]C[6,6]H)(C[6,6]C[3x6]H)(H){1|C<4>,1|O<2>,2|C<3>,2|H<1>}	H(C[6,6]C[3x6]C[6,6])	123.2660	0.000	1	123.2660	0.000	1	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[6,6]2C)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6]2C)(C[6,6]C[3x6]H)(H){1|C<3>,2|C<2>,2|C<4>,2|H<1>}	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(H){1|C<3>,2|C<2>,2|C<4>,2|H<1>}	H(C[6,6]C[3x6]C[6,6])	121.9870	0.000	1	121.9870	0.000	1	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[6,6]2C)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[6,6]O[6,6]C)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6]2C)(C[6,6]C[3x6]H)(H){1|C<3>,1|O<2>,2|C<4>,2|H<1>}	C[6,6](C[3x6]C[6,6]O[6,6]C)(C[6,6]C[3x6]H)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6,6]C[3x6]C[6,6])	123.9070	0.000	1	123.9070	0.000	1	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[6,6]2C)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[6,6]O[6,6]H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6]2C)(C[6,6]C[3x6]H)(H){1|C<4>,1|O<1>,2|H<1>,2|O<2>}	C[6,6](C[3x6]C[6,6]O[6,6]H)(C[6,6]C[3x6]H)(H){1|C<4>,2|C<3>,2|H<1>}	H(C[6,6]C[3x6]C[6,6])	123.7640	0.000	1	123.5150	0.124	2	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[6,6]2C)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[6,6]O[6,6]H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6]2C)(C[6,6]C[3x6]H)(H){2|C<4>,2|O<2>,3|H<1>}	C[6,6](C[3x6]C[6,6]O[6,6]H)(C[6,6]C[3x6]H)(H){2|H<1>,3|C<4>}	H(C[6,6]C[3x6]C[6,6])	123.2660	0.000	1	123.5150	0.124	2	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[5,3x6]C[6,6]H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(H){2|C<4>,5|H<1>}	C[6,6](C[3x6]C[5,3x6]C[6,6]H)(C[6,6]C[3x6]H)(H){1|O<2>,3|C<4>,3|H<1>}	H(C[6,6]C[3x6]C[6,6])	122.9120	0.000	1	122.9120	0.000	1	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[5,6,6]C[6,6]C)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(H){3|C<4>,4|H<1>}	C[6,6](C[3x6]C[5,6,6]C[6,6]C)(C[6,6]C[3x6]H)(H){2|H<1>,2|O<2>,3|C<4>}	H(C[6,6]C[3x6]C[6,6])	122.4730	0.225	4	122.4730	0.051	4	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[5,6,6]C[6,6]O)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(H){1|O<2>,2|C<4>,4|H<1>}	C[6,6](C[3x6]C[5,6,6]C[6,6]O)(C[6,6]C[3x6]H)(H){2|C<4>,2|S<2>,3|H<1>}	H(C[6,6]C[3x6]C[6,6])	114.7065	0.298	2	114.7065	0.089	2	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[5,6,6]N[6,6]H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(H){1|C<3>,1|C<4>,1|N<3>,4|H<1>}	C[6,6](C[3x6]C[5,6,6]N[6,6]H)(C[6,6]C[3x6]H)(H){1|H<1>,2|C<4>,3|C<3>}	H(C[6,6]C[3x6]C[6,6])	123.5050	0.000	1	123.5050	0.000	1	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[6,6]2C)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(H){1|C<3>,2|C<2>,2|C<4>,2|H<1>}	C[6,6](C[3x6]C[6,6]2C)(C[6,6]C[3x6]H)(H){1|C<3>,2|C<2>,2|C<4>,2|H<1>}	H(C[6,6]C[3x6]C[6,6])	122.4690	0.000	1	122.4690	0.000	1	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(H){1|C<3>,2|C<4>,3|H<1>}	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(H){1|C<4>,2|C<3>,4|H<1>}	H(C[6,6]C[3x6]C[6,6])	122.7415	0.142	2	123.0931	0.226	15	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(H){1|C<3>,2|C<4>,4|H<1>}	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(H){1|C<3>,2|C<4>,4|H<1>}	H(C[6,6]C[3x6]C[6,6])	124.2085	0.118	2	123.0931	0.226	15	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(H){1|C<4>,2|C<3>,4|H<1>}	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(H){1|C<3>,2|C<4>,3|H<1>}	H(C[6,6]C[3x6]C[6,6])	123.1175	0.087	2	123.0931	0.226	15	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(H){2|C<3>,2|C<4>,3|H<1>}	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(H){2|C<3>,2|C<4>,3|H<1>}	H(C[6,6]C[3x6]C[6,6])	122.9339	0.109	7	123.0931	0.226	15	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(H){3|H<1>,4|C<4>}	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(H){3|H<1>,4|C<4>}	H(C[6,6]C[3x6]C[6,6])	122.8620	0.170	2	123.0931	0.226	15	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[6,6]2O)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(H){1|C<3>,1|O<2>,2|C<4>,3|H<1>}	C[6,6](C[3x6]C[6,6]2O)(C[6,6]C[3x6]H)(H){2|C<2>,2|C<4>,3|H<1>}	H(C[6,6]C[3x6]C[6,6])	122.6250	0.000	1	122.6250	0.000	1	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[6,6]N[6,6]C)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(H){1|C<2>,1|C<3>,1|N<3>,2|C<4>,2|H<1>}	C[6,6](C[3x6]C[6,6]N[6,6]C)(C[6,6]C[3x6]H)(H){1|C<2>,2|H<1>,3|C<4>}	H(C[6,6]C[3x6]C[6,6])	123.0750	0.000	1	122.7307	0.090	3	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[6,6]N[6,6]C)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(H){1|N<4>,3|C<4>,3|H<1>}	C[6,6](C[3x6]C[6,6]N[6,6]C)(C[6,6]C[3x6]H)(H){1|C<2>,3|C<4>,3|H<1>}	H(C[6,6]C[3x6]C[6,6])	122.5920	0.000	1	122.7307	0.090	3	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[6,6]N[6,6]C)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(H){1|N<4>,3|C<4>,3|H<1>}	C[6,6](C[3x6]C[6,6]N[6,6]C)(C[6,6]C[3x6]H)(H){1|C<3>,3|C<4>,3|H<1>}	H(C[6,6]C[3x6]C[6,6])	122.5250	0.000	1	122.7307	0.090	3	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[6,6]N[6,6]H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(H){1|C<3>,1|C<4>,1|N<3>,4|H<1>}	C[6,6](C[3x6]C[6,6]N[6,6]H)(C[6,6]C[3x6]H)(H){1|S<4>,2|C<4>,3|H<1>}	H(C[6,6]C[3x6]C[6,6])	123.2080	0.000	1	122.9096	0.084	5	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[6,6]N[6,6]H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(H){1|C<3>,1|N<3>,5|H<1>}	C[6,6](C[3x6]C[6,6]N[6,6]H)(C[6,6]C[3x6]H)(H){1|C<3>,1|H<1>,1|O<1>,2|C<4>}	H(C[6,6]C[3x6]C[6,6])	122.6625	0.302	2	122.9096	0.084	5	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[6,6]N[6,6]H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(H){1|N<3>,2|C<4>,4|H<1>}	C[6,6](C[3x6]C[6,6]N[6,6]H)(C[6,6]C[3x6]H)(H){1|C<3>,2|H<1>,3|C<4>}	H(C[6,6]C[3x6]C[6,6])	122.9200	0.000	1	122.9096	0.084	5	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[6,6]N[6,6]H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(H){1|N<3>,2|C<4>,4|H<1>}	C[6,6](C[3x6]C[6,6]N[6,6]H)(C[6,6]C[3x6]H)(H){1|H<1>,2|C<4>,3|C<3>}	H(C[6,6]C[3x6]C[6,6])	123.0950	0.000	1	122.9096	0.084	5	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[6,6]P[6,6]H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(H){1|H<1>,1|O<1>,1|P<4>,2|C<3>}	C[6,6](C[3x6]C[6,6]P[6,6]H)(C[6,6]C[3x6]H)(H){1|C<4>,1|H<1>,1|W<6>,3|C<3>}	H(C[6,6]C[3x6]C[6,6])	121.8830	0.000	1	121.8830	0.000	1	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[6,6]2O)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6]2O)(C[6,6]C[3x6]H)(H){2|C<2>,2|C<4>,3|H<1>}	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(H){1|C<3>,1|O<2>,2|C<4>,3|H<1>}	H(C[6,6]C[3x6]C[6,6])	122.7090	0.000	1	122.7090	0.000	1	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[6,6]2O)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[6,6]O[6,6]H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6]2O)(C[6,6]C[3x6]H)(H){1|C<3>,1|C<4>,1|O<1>,1|O<2>,2|H<1>}	C[6,6](C[3x6]C[6,6]O[6,6]H)(C[6,6]C[3x6]H)(H){1|C<4>,1|H<1>,1|O<2>,2|C<3>}	H(C[6,6]C[3x6]C[6,6])	122.8550	0.573	2	123.5455	4.117	13	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[6,6]2O)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[6,6]O[6,6]H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6]2O)(C[6,6]C[3x6]H)(H){1|Cl<1>,1|C<2>,1|C<4>,1|H<1>,1|O<1>,1|O<2>}	C[6,6](C[3x6]C[6,6]O[6,6]H)(C[6,6]C[3x6]H)(H){1|C<3>,1|C<4>,1|O<2>,2|H<1>}	H(C[6,6]C[3x6]C[6,6])	123.6711	2.190	11	123.5455	4.117	13	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[6,6]N[6,6]C)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6]N[6,6]C)(C[6,6]C[3x6]H)(H){1|C<2>,2|H<1>,3|C<4>}	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(H){1|C<2>,1|C<3>,1|N<3>,2|C<4>,2|H<1>}	H(C[6,6]C[3x6]C[6,6])	123.1580	0.000	1	123.2717	0.015	3	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[6,6]N[6,6]C)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6]N[6,6]C)(C[6,6]C[3x6]H)(H){1|C<2>,3|C<4>,3|H<1>}	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(H){1|N<4>,3|C<4>,3|H<1>}	H(C[6,6]C[3x6]C[6,6])	123.4010	0.000	1	123.2717	0.015	3	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[6,6]N[6,6]C)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6]N[6,6]C)(C[6,6]C[3x6]H)(H){1|C<3>,3|C<4>,3|H<1>}	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(H){1|N<4>,3|C<4>,3|H<1>}	H(C[6,6]C[3x6]C[6,6])	123.2560	0.000	1	123.2717	0.015	3	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[6,6]N[6,6]C)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[6,6]O[6,6]C)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6]N[6,6]C)(C[6,6]C[3x6]H)(H){1|C<5>,1|O<2>,2|C<4>,2|H<1>}	C[6,6](C[3x6]C[6,6]O[6,6]C)(C[6,6]C[3x6]H)(H){1|N<3>,2|C<4>,2|H<1>}	H(C[6,6]C[3x6]C[6,6])	122.5885	0.129	2	122.5885	0.017	2	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[6,6]N[6,6]H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6]N[6,6]H)(C[6,6]C[3x6]H)(H){1|C<3>,1|H<1>,1|O<1>,2|C<4>}	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(H){1|C<3>,1|N<3>,5|H<1>}	H(C[6,6]C[3x6]C[6,6])	123.1840	0.351	2	123.1934	0.065	5	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[6,6]N[6,6]H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6]N[6,6]H)(C[6,6]C[3x6]H)(H){1|C<3>,2|H<1>,3|C<4>}	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(H){1|N<3>,2|C<4>,4|H<1>}	H(C[6,6]C[3x6]C[6,6])	123.1770	0.000	1	123.1934	0.065	5	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[6,6]N[6,6]H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6]N[6,6]H)(C[6,6]C[3x6]H)(H){1|H<1>,2|C<4>,3|C<3>}	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(H){1|N<3>,2|C<4>,4|H<1>}	H(C[6,6]C[3x6]C[6,6])	123.4730	0.000	1	123.1934	0.065	5	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[6,6]N[6,6]H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6]N[6,6]H)(C[6,6]C[3x6]H)(H){1|S<4>,2|C<4>,3|H<1>}	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(H){1|C<3>,1|C<4>,1|N<3>,4|H<1>}	H(C[6,6]C[3x6]C[6,6])	122.9490	0.000	1	123.1934	0.065	5	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[6,6]N[6,6]H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[6,6]O[6,6]H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6]N[6,6]H)(C[6,6]C[3x6]H)(H){1|C<3>,1|C<4>,1|O<2>,3|H<1>}	C[6,6](C[3x6]C[6,6]O[6,6]H)(C[6,6]C[3x6]H)(H){1|C<4>,1|N<3>,3|H<1>}	H(C[6,6]C[3x6]C[6,6])	124.2790	0.913	5	123.9026	0.751	8	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[6,6]N[6,6]H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[6,6]O[6,6]H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6]N[6,6]H)(C[6,6]C[3x6]H)(H){1|C<4>,1|C<5>,1|O<2>,3|H<1>}	C[6,6](C[3x6]C[6,6]O[6,6]H)(C[6,6]C[3x6]H)(H){1|C<4>,1|N<3>,3|H<1>}	H(C[6,6]C[3x6]C[6,6])	123.3620	0.000	1	123.9026	0.751	8	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[6,6]N[6,6]H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[6,6]O[6,6]H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6]N[6,6]H)(C[6,6]C[3x6]H)(H){1|C<4>,1|O<2>,2|C<3>,2|H<1>}	C[6,6](C[3x6]C[6,6]O[6,6]H)(C[6,6]C[3x6]H)(H){1|C<4>,1|H<1>,1|N<2>,1|N<3>}	H(C[6,6]C[3x6]C[6,6])	123.3400	0.000	1	123.9026	0.751	8	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[6,6]N[6,6]H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[6,6]O[6,6]H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6]N[6,6]H)(C[6,6]C[3x6]H)(H){1|H<1>,2|C<3>,3|O<2>}	C[6,6](C[3x6]C[6,6]O[6,6]H)(C[6,6]C[3x6]H)(H){1|C<4>,1|H<1>,1|N<3>,1|O<1>}	H(C[6,6]C[3x6]C[6,6])	123.1240	0.000	1	123.9026	0.751	8	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[6,6]O[6,6]C)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[3,6,6]N[6,6]C)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6]O[6,6]C)(C[6,6]C[3x6]H)(H){1|N<3>,1|O<1>,2|C<4>}	C[6,6](C[3x6]C[3,6,6]N[6,6]C)(C[6,6]C[3x6]H)(H){2|C<3>,2|C<4>,2|O<2>}	H(C[6,6]C[3x6]C[6,6])	122.6760	0.000	1	122.6760	0.000	1	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[6,6]O[6,6]C)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[6,6]2C)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6]O[6,6]C)(C[6,6]C[3x6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6,6](C[3x6]C[6,6]2C)(C[6,6]C[3x6]H)(H){1|C<3>,1|O<2>,2|C<4>,2|H<1>}	H(C[6,6]C[3x6]C[6,6])	125.7760	0.000	1	125.7760	0.000	1	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[6,6]O[6,6]C)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[6,6]N[6,6]C)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6]O[6,6]C)(C[6,6]C[3x6]H)(H){1|N<3>,2|C<4>,2|H<1>}	C[6,6](C[3x6]C[6,6]N[6,6]C)(C[6,6]C[3x6]H)(H){1|C<5>,1|O<2>,2|C<4>,2|H<1>}	H(C[6,6]C[3x6]C[6,6])	122.7897	0.032	3	122.7897	0.001	3	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[6,6]O[6,6]H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[6,6]2C)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6]O[6,6]H)(C[6,6]C[3x6]H)(H){1|C<4>,2|C<3>,2|H<1>}	C[6,6](C[3x6]C[6,6]2C)(C[6,6]C[3x6]H)(H){1|C<4>,1|O<1>,2|H<1>,2|O<2>}	H(C[6,6]C[3x6]C[6,6])	122.9490	0.000	1	123.0990	0.045	2	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[6,6]O[6,6]H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[6,6]2C)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6]O[6,6]H)(C[6,6]C[3x6]H)(H){2|H<1>,3|C<4>}	C[6,6](C[3x6]C[6,6]2C)(C[6,6]C[3x6]H)(H){2|C<4>,2|O<2>,3|H<1>}	H(C[6,6]C[3x6]C[6,6])	123.2490	0.000	1	123.0990	0.045	2	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[6,6]O[6,6]H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[6,6]2O)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6]O[6,6]H)(C[6,6]C[3x6]H)(H){1|C<3>,1|C<4>,1|O<2>,2|H<1>}	C[6,6](C[3x6]C[6,6]2O)(C[6,6]C[3x6]H)(H){1|Cl<1>,1|C<2>,1|C<4>,1|H<1>,1|O<1>,1|O<2>}	H(C[6,6]C[3x6]C[6,6])	123.2946	0.492	11	123.3787	0.248	13	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[6,6]O[6,6]H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[6,6]2O)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6]O[6,6]H)(C[6,6]C[3x6]H)(H){1|C<4>,1|H<1>,1|O<2>,2|C<3>}	C[6,6](C[3x6]C[6,6]2O)(C[6,6]C[3x6]H)(H){1|C<3>,1|C<4>,1|O<1>,1|O<2>,2|H<1>}	H(C[6,6]C[3x6]C[6,6])	123.8410	0.215	2	123.3787	0.248	13	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[6,6]O[6,6]H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[6,6]N[6,6]H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6]O[6,6]H)(C[6,6]C[3x6]H)(H){1|C<4>,1|H<1>,1|N<2>,1|N<3>}	C[6,6](C[3x6]C[6,6]N[6,6]H)(C[6,6]C[3x6]H)(H){1|C<4>,1|O<2>,2|C<3>,2|H<1>}	H(C[6,6]C[3x6]C[6,6])	123.3400	0.000	1	123.9770	1.695	8	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[6,6]O[6,6]H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[6,6]N[6,6]H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6]O[6,6]H)(C[6,6]C[3x6]H)(H){1|C<4>,1|H<1>,1|N<3>,1|O<1>}	C[6,6](C[3x6]C[6,6]N[6,6]H)(C[6,6]C[3x6]H)(H){1|H<1>,2|C<3>,3|O<2>}	H(C[6,6]C[3x6]C[6,6])	123.5980	0.000	1	123.9770	1.695	8	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[6,6]O[6,6]H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[6,6]N[6,6]H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6]O[6,6]H)(C[6,6]C[3x6]H)(H){1|C<4>,1|N<3>,3|H<1>}	C[6,6](C[3x6]C[6,6]N[6,6]H)(C[6,6]C[3x6]H)(H){1|C<3>,1|C<4>,1|O<2>,3|H<1>}	H(C[6,6]C[3x6]C[6,6])	124.2416	1.648	5	123.9770	1.695	8	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[6,6]O[6,6]H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[6,6]N[6,6]H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6]O[6,6]H)(C[6,6]C[3x6]H)(H){1|C<4>,1|N<3>,3|H<1>}	C[6,6](C[3x6]C[6,6]N[6,6]H)(C[6,6]C[3x6]H)(H){1|C<4>,1|C<5>,1|O<2>,3|H<1>}	H(C[6,6]C[3x6]C[6,6])	123.6700	0.000	1	123.9770	1.695	8	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[6,6]O[6,6]H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[6,6]O[6,6]H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6]O[6,6]H)(C[6,6]C[3x6]H)(H){1|C<4>,1|N<3>,1|O<2>,2|H<1>}	C[6,6](C[3x6]C[6,6]O[6,6]H)(C[6,6]C[3x6]H)(H){1|C<4>,1|O<2>,3|H<1>}	H(C[6,6]C[3x6]C[6,6])	124.7370	1.706	2	125.0050	2.684	4	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[6,6]O[6,6]H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[6,6]O[6,6]H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6]O[6,6]H)(C[6,6]C[3x6]H)(H){1|C<4>,1|O<2>,3|H<1>}	C[6,6](C[3x6]C[6,6]O[6,6]H)(C[6,6]C[3x6]H)(H){1|C<4>,1|N<3>,1|O<2>,2|H<1>}	H(C[6,6]C[3x6]C[6,6])	125.2730	2.203	2	125.0050	2.684	4	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[6,6]O[6,6]H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[6,6]O[6,6]O)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6]O[6,6]H)(C[6,6]C[3x6]H)(H){1|H<1>,2|C<4>,2|O<2>}	C[6,6](C[3x6]C[6,6]O[6,6]O)(C[6,6]C[3x6]H)(H){1|H<1>,2|C<4>,2|O<2>}	H(C[6,6]C[3x6]C[6,6])	123.9305	0.788	2	123.9305	0.622	2	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[6,6]O[6,6]O)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[6,6]O[6,6]H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6]O[6,6]O)(C[6,6]C[3x6]H)(H){1|H<1>,2|C<4>,2|O<2>}	C[6,6](C[3x6]C[6,6]O[6,6]H)(C[6,6]C[3x6]H)(H){1|H<1>,2|C<4>,2|O<2>}	H(C[6,6]C[3x6]C[6,6])	123.0360	0.380	2	123.0360	0.145	2	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[6,6]P[4x6]H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]As[4x6]C[6,6]H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6]P[4x6]H)(C[6,6]C[3x6]H)(H){1|As<3>,1|W<6>,2|C<4>,3|H<1>}	C[6,6](C[3x6]As[4x6]C[6,6]H)(C[6,6]C[3x6]H)(H){1|P<4>,2|C<4>,3|H<1>}	H(C[6,6]C[3x6]C[6,6])	121.1590	0.031	2	121.1590	0.001	2	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[6,6]P[6,6]H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6]P[6,6]H)(C[6,6]C[3x6]H)(H){1|C<4>,1|H<1>,1|W<6>,3|C<3>}	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(H){1|H<1>,1|O<1>,1|P<4>,2|C<3>}	H(C[6,6]C[3x6]C[6,6])	121.8820	0.000	1	121.8820	0.000	1	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]N[5,6,6]C[6,6]H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]N[5,6,6]C[6,6]H)(C[6,6]C[3x6]H)(H){1|Cl<1>,1|C<2>,1|C<3>,1|H<1>,2|C<4>}	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]H)(H){1|C<3>,1|N<3>,2|C<4>,3|H<1>}	H(C[6,6]C[3x6]C[6,6])	122.9710	0.000	1	123.0157	0.035	3	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]N[5,6,6]C[6,6]H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]N[5,6,6]C[6,6]H)(C[6,6]C[3x6]H)(H){2|C<3>,2|C<4>,2|H<1>}	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]H)(H){1|C<3>,1|N<3>,2|H<1>,3|C<4>}	H(C[6,6]C[3x6]C[6,6])	123.0380	0.257	2	123.0157	0.035	3	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]N[5a,6,6]C[3,6,6]C)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]N[5a,6,6]C[3,6,6]H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]N[5a,6,6]C[3,6,6]C)(C[6,6]C[3x6]H)(H){1|C<4>,1|H<1>,1|N<3>,1|O<2>,2|C<3>}	C[6,6](C[3x6]N[5a,6,6]C[3,6,6]H)(C[6,6]C[3x6]H)(H){1|C<3>,1|H<1>,1|N<3>,1|O<2>,2|C<4>}	H(C[6,6]C[3x6]C[6,6])	123.2720	0.000	1	123.2720	0.000	1	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]N[5a,6,6]C[3,6,6]H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[3,5,6,6]N[5a,6,6]H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]N[5a,6,6]C[3,6,6]H)(C[6,6]C[3x6]H)(H){1|C<3>,1|N<3>,2|C<4>,2|H<1>}	C[6,6](C[3x6]C[3,5,6,6]N[5a,6,6]H)(C[6,6]C[3x6]H)(H){1|C<3>,1|H<1>,1|N<3>,3|C<4>}	H(C[6,6]C[3x6]C[6,6])	122.8150	0.000	1	122.8150	0.000	1	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]N[5a,6,6]C[3,6,6]H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]N[5a,6,6]C[3,6,6]C)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]N[5a,6,6]C[3,6,6]H)(C[6,6]C[3x6]H)(H){1|C<3>,1|H<1>,1|N<3>,1|O<2>,2|C<4>}	C[6,6](C[3x6]N[5a,6,6]C[3,6,6]C)(C[6,6]C[3x6]H)(H){1|C<4>,1|H<1>,1|N<3>,1|O<2>,2|C<3>}	H(C[6,6]C[3x6]C[6,6])	122.8370	0.000	1	122.8370	0.000	1	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]N[5a,6,6]C[3,6,6]H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]N[5a,6,6]C[3,6,6]H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]N[5a,6,6]C[3,6,6]H)(C[6,6]C[3x6]H)(H){1|C<3>,1|C<4>,1|N<3>,1|O<2>,2|H<1>}	C[6,6](C[3x6]N[5a,6,6]C[3,6,6]H)(C[6,6]C[3x6]H)(H){1|C<3>,1|C<4>,1|N<3>,1|O<2>,2|H<1>}	H(C[6,6]C[3x6]C[6,6])	123.0975	0.100	4	123.0883	0.012	6	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]N[5a,6,6]C[3,6,6]H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]N[5a,6,6]C[3,6,6]H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]N[5a,6,6]C[3,6,6]H)(C[6,6]C[3x6]H)(H){1|C<3>,1|H<1>,1|N<3>,1|O<2>,2|C<4>}	C[6,6](C[3x6]N[5a,6,6]C[3,6,6]H)(C[6,6]C[3x6]H)(H){1|C<3>,1|H<1>,1|N<3>,1|O<2>,2|C<4>}	H(C[6,6]C[3x6]C[6,6])	123.0700	0.174	2	123.0883	0.012	6	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]N[5a,6,6]C[5,6,6]Br)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]N[5a,6,6]C[5,6,6]H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]N[5a,6,6]C[5,6,6]Br)(C[6,6]C[3x6]H)(H){1|C<3>,1|C<4>,1|N<3>,1|O<2>,2|H<1>}	C[6,6](C[3x6]N[5a,6,6]C[5,6,6]H)(C[6,6]C[3x6]H)(H){1|Br<1>,1|C<4>,1|N<3>,1|O<2>,2|C<3>}	H(C[6,6]C[3x6]C[6,6])	123.7920	0.000	1	123.7920	0.000	1	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]N[5a,6,6]C[5,6,6]H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]N[5a,6,6]C[5,6,6]Br)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]N[5a,6,6]C[5,6,6]H)(C[6,6]C[3x6]H)(H){1|Br<1>,1|C<4>,1|N<3>,1|O<2>,2|C<3>}	C[6,6](C[3x6]N[5a,6,6]C[5,6,6]Br)(C[6,6]C[3x6]H)(H){1|C<3>,1|C<4>,1|N<3>,1|O<2>,2|H<1>}	H(C[6,6]C[3x6]C[6,6])	122.7910	0.000	1	122.7910	0.000	1	123.0186	1.683	365	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:I-1:	C[6,6]-3:	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]I)(H)	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(I)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]I)(H){1|C<4>,1|H<1>,1|O<1>,2|C<3>}	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(I){2|C<3>,2|H<1>,2|O<2>}	H(C[6,6]C[3x6]C[6,6])	130.5760	0.000	1	130.5760	0.000	1	130.5760	0.000	1	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[4x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[3,6,6]C[6,6]H)(C[6,6]C[4x6]H)(H)	C[6,6](C[4x6]C[3x6]C[6,6]C[6])(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[3,6,6]C[6,6]H)(C[6,6]C[4x6]H)(H){1|C<3>,1|O<2>,2|H<1>,3|C<4>}	C[6,6](C[4x6]C[3x6]C[6,6]C[6])(C[6,6]C[3x6]H)(H){1|O<1>,2|C<3>,3|C<4>,3|H<1>}	H(C[6,6]C[3x6]C[6,6])	122.8095	0.025	2	122.6997	0.036	3	122.7117	1.885	21	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[4x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[3,6,6]C[6,6]H)(C[6,6]C[4x6]H)(H)	C[6,6](C[4x6]C[3x6]C[6,6]C[6])(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[3,6,6]C[6,6]H)(C[6,6]C[4x6]H)(H){1|C<3>,1|O<2>,2|H<1>,3|C<4>}	C[6,6](C[4x6]C[3x6]C[6,6]C[6])(C[6,6]C[3x6]H)(H){1|O<1>,4|C<4>,4|H<1>}	H(C[6,6]C[3x6]C[6,6])	122.4800	0.000	1	122.6997	0.036	3	122.7117	1.885	21	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[4x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[4x6]H)(H)	C[6,6](C[4x6]C[5,6,6]C[3x6]C[6])(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[4x6]H)(H){1|O<2>,3|C<4>,3|H<1>}	C[6,6](C[4x6]C[5,6,6]C[3x6]C[6])(C[6,6]C[3x6]H)(H){1|O<2>,4|C<4>,5|H<1>}	H(C[6,6]C[3x6]C[6,6])	123.9590	2.895	4	123.9590	8.384	4	122.7117	1.885	21	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[4x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[6,6,6a]C[3x6]H)(C[6,6]C[4x6]H)(H)	C[6,6](C[4x6]C[6,6,6a]C[6,6a]C[4x6])(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6,6a]C[3x6]H)(C[6,6]C[4x6]H)(H){5|C<3>}	C[6,6](C[4x6]C[6,6,6a]C[6,6a]C[4x6])(C[6,6]C[3x6]H)(H){1|H<1>,6|C<3>}	H(C[6,6]C[3x6]C[6,6])	122.7210	0.008	2	122.7210	0.000	2	122.7117	1.885	21	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[4x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[6,6]2Br)(C[6,6]C[4x6]H)(H)	C[6,6](C[4x6]C[3x6]O[6,6]C[6])(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6]2Br)(C[6,6]C[4x6]H)(H){1|C<3>,1|O<1>,1|O<2>,3|C<4>}	C[6,6](C[4x6]C[3x6]O[6,6]C[6])(C[6,6]C[3x6]H)(H){1|Br<1>,1|H<1>,3|C<3>,3|C<4>}	H(C[6,6]C[3x6]C[6,6])	123.1970	0.000	1	123.1970	0.000	1	122.7117	1.885	21	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[4x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[6,6]2C)(C[6,6]C[4x6]H)(H)	C[6,6](C[4x6]C[3x6]C[6,6]C[6])(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6]2C)(C[6,6]C[4x6]H)(H){3|H<1>,4|C<4>}	C[6,6](C[4x6]C[3x6]C[6,6]C[6])(C[6,6]C[3x6]H)(H){1|Si<4>,4|H<1>,5|C<4>}	H(C[6,6]C[3x6]C[6,6])	122.2250	0.000	1	122.2250	0.000	1	122.7117	1.885	21	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[4x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[4x6]H)(H)	C[6,6](C[4x6]C[3x6]C[6,6]2)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[4x6]H)(H){1|C<3>,1|O<2>,2|H<1>,3|C<4>}	C[6,6](C[4x6]C[3x6]C[6,6]2)(C[6,6]C[3x6]H)(H){1|O<1>,2|C<3>,2|H<1>,4|C<4>}	H(C[6,6]C[3x6]C[6,6])	122.1130	0.137	2	122.1548	0.070	4	122.7117	1.885	21	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[4x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[4x6]H)(H)	C[6,6](C[4x6]C[3x6]C[6,6]2)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[4x6]H)(H){1|C<3>,1|O<2>,2|H<1>,3|C<4>}	C[6,6](C[4x6]C[3x6]C[6,6]2)(C[6,6]C[3x6]H)(H){1|O<2>,2|C<3>,2|H<1>,4|C<4>}	H(C[6,6]C[3x6]C[6,6])	122.1965	0.431	2	122.1548	0.070	4	122.7117	1.885	21	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[4x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[4x6]H)(H)	C[6,6](C[4x6]C[3x6]C[6,6]C[6])(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[4x6]H)(H){1|C<3>,2|C<4>,2|H<1>,2|O<2>}	C[6,6](C[4x6]C[3x6]C[6,6]C[6])(C[6,6]C[3x6]H)(H){1|O<1>,4|C<4>,4|H<1>}	H(C[6,6]C[3x6]C[6,6])	122.5753	0.419	3	122.5753	0.176	3	122.7117	1.885	21	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[4x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[4x6]H)(H)	C[6,6](C[4x6]C[3x6]P[3x6]C)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[4x6]H)(H){1|C<3>,1|P<3>,2|C<4>,2|H<1>}	C[6,6](C[4x6]C[3x6]P[3x6]C)(C[6,6]C[3x6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6,6]C[3x6]C[6,6])	122.5240	0.148	2	122.5240	0.022	2	122.7117	1.885	21	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[4x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]Si[4,6,6]C[6,6]H)(C[6,6]C[4x6]H)(H)	C[6,6](C[4x6]Si[4,3x6]C[3x6]H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]Si[4,6,6]C[6,6]H)(C[6,6]C[4x6]H)(H){1|Si<5>,2|Si<4>,1|C<3>,2|H<1>}	C[6,6](C[4x6]Si[4,3x6]C[3x6]H)(C[6,6]C[3x6]H)(H){1|Si<5>,2|Si<4>,1|H<1>,2|C<3>}	H(C[6,6]C[3x6]C[6,6])	120.7530	0.000	1	120.7530	0.000	1	122.7117	1.885	21	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[5,3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[5,6,6]C[6,6]C)(C[6,6]C[5,3x6]H)(H)	C[6,6](C[5,3x6]C[5,6,6]2C[5])(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[5,6,6]C[6,6]C)(C[6,6]C[5,3x6]H)(H){1|H<1>,1|O<2>,5|C<4>}	C[6,6](C[5,3x6]C[5,6,6]2C[5])(C[6,6]C[3x6]H)(H){1|O<2>,3|H<1>,6|C<4>}	H(C[6,6]C[3x6]C[6,6])	125.2360	0.000	1	123.6285	5.168	2	123.0649	1.073	17	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[5,3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[5,6,6]C[6,6]C)(C[6,6]C[5,3x6]H)(H)	C[6,6](C[5,3x6]C[5,6,6]2C[5])(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[5,6,6]C[6,6]C)(C[6,6]C[5,3x6]H)(H){1|H<1>,1|O<2>,5|C<4>}	C[6,6](C[5,3x6]C[5,6,6]2C[5])(C[6,6]C[3x6]H)(H){1|O<2>,4|H<1>,5|C<4>}	H(C[6,6]C[3x6]C[6,6])	122.0210	0.000	1	123.6285	5.168	2	123.0649	1.073	17	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[5,3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[5,3x6]H)(H)	C[6,6](C[5,3x6]C[5,6,6]2C[5])(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[5,3x6]H)(H){1|H<1>,1|O<2>,5|C<4>}	C[6,6](C[5,3x6]C[5,6,6]2C[5])(C[6,6]C[3x6]H)(H){1|C<3>,1|O<2>,3|C<4>,5|H<1>}	H(C[6,6]C[3x6]C[6,6])	122.7270	0.082	2	122.9575	2.103	6	123.0649	1.073	17	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[5,3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[5,3x6]H)(H)	C[6,6](C[5,3x6]C[5,6,6]2C[5])(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[5,3x6]H)(H){1|O<2>,3|C<4>,3|H<1>}	C[6,6](C[5,3x6]C[5,6,6]2C[5])(C[6,6]C[3x6]H)(H){1|C<3>,1|O<2>,3|C<4>,5|H<1>}	H(C[6,6]C[3x6]C[6,6])	123.6593	1.764	3	122.9575	2.103	6	123.0649	1.073	17	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[5,3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[5,3x6]H)(H)	C[6,6](C[5,3x6]C[5,6,6]2C[5])(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[5,3x6]H)(H){1|O<2>,3|C<4>,3|H<1>}	C[6,6](C[5,3x6]C[5,6,6]2C[5])(C[6,6]C[3x6]H)(H){1|O<2>,4|C<4>,5|H<1>}	H(C[6,6]C[3x6]C[6,6])	121.3130	0.000	1	122.9575	2.103	6	123.0649	1.073	17	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[5,3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[6,6,6a]C[6,6]H)(C[6,6]C[5,3x6]H)(H)	C[6,6](C[5,3x6]C[6,6,6a]C[5,6,6]C[5])(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6,6a]C[6,6]H)(C[6,6]C[5,3x6]H)(H){1|C<4>,2|H<1>,3|C<3>}	C[6,6](C[5,3x6]C[6,6,6a]C[5,6,6]C[5])(C[6,6]C[3x6]H)(H){2|C<4>,2|H<1>,4|C<3>}	H(C[6,6]C[3x6]C[6,6])	123.5230	0.236	2	123.5230	0.056	2	123.0649	1.073	17	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[5,3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[6,6,6a]C[6,6]H)(C[6,6]C[5,3x6]H)(H)	C[6,6](C[5,3x6]C[6,6,6a]C[5,6,6]Se[5])(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6,6a]C[6,6]H)(C[6,6]C[5,3x6]H)(H){1|Se<3>,4|C<3>}	C[6,6](C[5,3x6]C[6,6,6a]C[5,6,6]Se[5])(C[6,6]C[3x6]H)(H){1|H<1>,1|O<1>,5|C<3>}	H(C[6,6]C[3x6]C[6,6])	122.7900	0.000	1	122.7900	0.000	1	123.0649	1.073	17	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[5,3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[6,6]O[6,6]H)(C[6,6]C[5,3x6]H)(H)	C[6,6](C[5,3x6]C[5,3x6]O[6,6]C[5])(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6]O[6,6]H)(C[6,6]C[5,3x6]H)(H){1|O<2>,2|C<4>,2|H<1>}	C[6,6](C[5,3x6]C[5,3x6]O[6,6]C[5])(C[6,6]C[3x6]H)(H){1|C<4>,1|N<3>,1|O<2>,2|C<3>,3|H<1>}	H(C[6,6]C[3x6]C[6,6])	122.8775	0.067	6	122.8775	0.005	6	123.0649	1.073	17	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[5,4x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[3,6,6]C[6,6]H)(C[6,6]C[5,4x6]H)(H)	C[6,6](C[5,4x6]C[5,3x6]C[5,5,6]C[6,6])(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[3,6,6]C[6,6]H)(C[6,6]C[5,4x6]H)(H){1|C<3>,1|O<2>,2|H<1>,3|C<4>}	C[6,6](C[5,4x6]C[5,3x6]C[5,5,6]C[6,6])(C[6,6]C[3x6]H)(H){1|O<1>,3|H<1>,5|C<4>}	H(C[6,6]C[3x6]C[6,6])	122.9125	0.192	2	123.0253	0.057	3	123.5102	0.978	4	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[5,4x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[3,6,6]C[6,6]H)(C[6,6]C[5,4x6]H)(H)	C[6,6](C[5,4x6]C[5,3x6]C[5,5,6]C[6,6])(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[3,6,6]C[6,6]H)(C[6,6]C[5,4x6]H)(H){1|O<2>,2|H<1>,4|C<4>}	C[6,6](C[5,4x6]C[5,3x6]C[5,5,6]C[6,6])(C[6,6]C[3x6]H)(H){2|O<2>,3|H<1>,5|C<4>}	H(C[6,6]C[3x6]C[6,6])	123.2510	0.000	1	123.0253	0.057	3	123.5102	0.978	4	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[5,4x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[6,6]O[6,6]H)(C[6,6]C[5,4x6]H)(H)	C[6,6](C[5,4x6]C[5,3x6]C[5,6,6]C[6,6a])(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6]O[6,6]H)(C[6,6]C[5,4x6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6,6](C[5,4x6]C[5,3x6]C[5,6,6]C[6,6a])(C[6,6]C[3x6]H)(H){1|N<3>,1|O<2>,2|C<3>,2|C<4>,3|H<1>}	H(C[6,6]C[3x6]C[6,6])	124.9650	0.000	1	124.9650	0.000	1	123.5102	0.978	4	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[5x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[5,6,6]C[6,6]O)(C[6,6]C[5x6]H)(H)	C[6,6](C[5x6]C[5,4x6]C[6,6]2)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[5,6,6]C[6,6]O)(C[6,6]C[5x6]H)(H){1|C<3>,1|H<1>,1|O<2>,4|C<4>}	C[6,6](C[5x6]C[5,4x6]C[6,6]2)(C[6,6]C[3x6]H)(H){1|C<3>,1|N<3>,1|O<2>,3|H<1>,4|C<4>}	H(C[6,6]C[3x6]C[6,6])	122.7360	0.000	1	121.2787	6.766	6	121.5524	6.163	7	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[5x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[5,6,6]C[6,6]O)(C[6,6]C[5x6]H)(H)	C[6,6](C[5x6]C[5,4x6]C[6,6]2)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[5,6,6]C[6,6]O)(C[6,6]C[5x6]H)(H){1|C<3>,1|O<2>,2|H<1>,3|C<4>}	C[6,6](C[5x6]C[5,4x6]C[6,6]2)(C[6,6]C[3x6]H)(H){1|C<3>,1|N<3>,1|O<2>,3|H<1>,4|C<4>}	H(C[6,6]C[3x6]C[6,6])	122.1540	0.112	2	121.2787	6.766	6	121.5524	6.163	7	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[5x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[5,6,6]C[6,6]O)(C[6,6]C[5x6]H)(H)	C[6,6](C[5x6]C[5,4x6]C[6,6]2)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[5,6,6]C[6,6]O)(C[6,6]C[5x6]H)(H){1|Cl<1>,1|C<2>,1|H<1>,1|O<2>,3|C<4>}	C[6,6](C[5x6]C[5,4x6]C[6,6]2)(C[6,6]C[3x6]H)(H){1|C<3>,1|N<3>,1|O<2>,3|H<1>,4|C<4>}	H(C[6,6]C[3x6]C[6,6])	115.9920	0.000	1	121.2787	6.766	6	121.5524	6.163	7	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[5x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[5,6,6]C[6,6]O)(C[6,6]C[5x6]H)(H)	C[6,6](C[5x6]C[5,4x6]C[6,6]2)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[5,6,6]C[6,6]O)(C[6,6]C[5x6]H)(H){1|Cl<1>,1|O<2>,2|H<1>,3|C<4>}	C[6,6](C[5x6]C[5,4x6]C[6,6]2)(C[6,6]C[3x6]H)(H){1|C<3>,1|N<3>,1|O<2>,3|H<1>,4|C<4>}	H(C[6,6]C[3x6]C[6,6])	122.3180	0.225	2	121.2787	6.766	6	121.5524	6.163	7	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[5x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[5x6]H)(H)	C[6,6](C[5x6]C[3x6]2C[6,6])(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[5x6]H)(H){1|H<1>,2|C<3>,2|C<4>}	C[6,6](C[5x6]C[3x6]2C[6,6])(C[6,6]C[3x6]H)(H){2|C<3>,2|H<1>,2|O<2>,3|C<4>}	H(C[6,6]C[3x6]C[6,6])	123.1950	0.000	1	123.1950	0.000	1	121.5524	6.163	7	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6,6]-3:H-1:	N[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[3x6]C[6,6]2H)(C[6,6]N[3x6]H)(H)	C[6,6](N[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(H)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6]2H)(C[6,6]N[3x6]H)(H){1|C<2>,1|C<3>,1|C<4>,3|H<1>}	C[6,6](N[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(H){1|C<3>,2|C<4>,3|H<1>}	H(C[6,6]C[3x6]C[6,6])	110.3060	0.000	1	110.3060	0.000	1	110.3060	0.000	1	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[4,4,3x6]-4:C[6,6]-3:H-1:	C[4,4,6,6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[4,4,3x6]C[3,4,4,6]C[4,4,3x6]C[3,4,4])(C[6,6]C[4,4,6,6]H)(H)	C[6,6](C[4,4,6,6]C[3x4,6]2H)(C[6,6]C[4,4,3x6]H)(H)	H(C[6,6]C[4,4,3x6]C[6,6])	C[6,6](C[4,4,3x6]C[3,4,4,6]C[4,4,3x6]C[3,4,4])(C[6,6]C[4,4,6,6]H)(H){1|C<4>,1|H<1>,2|H<3>,3|C<3>}	C[6,6](C[4,4,6,6]C[3x4,6]2H)(C[6,6]C[4,4,3x6]H)(H){1|C<3>,1|H<1>,1|H<2>,2|C<4>}	H(C[6,6]C[4,4,3x6]C[6,6])	122.3610	0.000	1	122.3610	0.000	1	122.3610	0.000	1	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[4,4,6,6]-4:C[6,6]-3:H-1:	C[4,4,3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[4,4,6,6]C[3x4,6]2H)(C[6,6]C[4,4,3x6]H)(H)	C[6,6](C[4,4,3x6]C[3,4,4,6]C[4,4,3x6]C[3,4,4])(C[6,6]C[4,4,6,6]H)(H)	H(C[6,6]C[4,4,6,6]C[6,6])	C[6,6](C[4,4,6,6]C[3x4,6]2H)(C[6,6]C[4,4,3x6]H)(H){1|C<3>,1|H<1>,1|H<2>,2|C<4>}	C[6,6](C[4,4,3x6]C[3,4,4,6]C[4,4,3x6]C[3,4,4])(C[6,6]C[4,4,6,6]H)(H){1|C<4>,1|H<1>,2|H<3>,3|C<3>}	H(C[6,6]C[4,4,6,6]C[6,6])	115.8890	0.000	1	115.8890	0.000	1	115.8890	0.000	1	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[4x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[4x6]C[3x6]C[6,6]2)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[4x6]H)(H)	H(C[6,6]C[4x6]C[6,6])	C[6,6](C[4x6]C[3x6]C[6,6]2)(C[6,6]C[3x6]H)(H){1|O<1>,2|C<3>,2|H<1>,4|C<4>}	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[4x6]H)(H){1|C<3>,1|O<2>,2|H<1>,3|C<4>}	H(C[6,6]C[4x6]C[6,6])	122.5465	0.613	2	122.3402	0.197	4	122.1634	0.859	21	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[4x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[4x6]C[3x6]C[6,6]2)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[4x6]H)(H)	H(C[6,6]C[4x6]C[6,6])	C[6,6](C[4x6]C[3x6]C[6,6]2)(C[6,6]C[3x6]H)(H){1|O<2>,2|C<3>,2|H<1>,4|C<4>}	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[4x6]H)(H){1|C<3>,1|O<2>,2|H<1>,3|C<4>}	H(C[6,6]C[4x6]C[6,6])	122.1340	0.209	2	122.3402	0.197	4	122.1634	0.859	21	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[4x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[4x6]C[3x6]C[6,6]C[6])(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[3,6,6]C[6,6]H)(C[6,6]C[4x6]H)(H)	H(C[6,6]C[4x6]C[6,6])	C[6,6](C[4x6]C[3x6]C[6,6]C[6])(C[6,6]C[3x6]H)(H){1|O<1>,2|C<3>,3|C<4>,3|H<1>}	C[6,6](C[3x6]C[3,6,6]C[6,6]H)(C[6,6]C[4x6]H)(H){1|C<3>,1|O<2>,2|H<1>,3|C<4>}	H(C[6,6]C[4x6]C[6,6])	121.9295	0.080	2	121.9280	0.003	3	122.1634	0.859	21	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[4x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[4x6]C[3x6]C[6,6]C[6])(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[3,6,6]C[6,6]H)(C[6,6]C[4x6]H)(H)	H(C[6,6]C[4x6]C[6,6])	C[6,6](C[4x6]C[3x6]C[6,6]C[6])(C[6,6]C[3x6]H)(H){1|O<1>,4|C<4>,4|H<1>}	C[6,6](C[3x6]C[3,6,6]C[6,6]H)(C[6,6]C[4x6]H)(H){1|C<3>,1|O<2>,2|H<1>,3|C<4>}	H(C[6,6]C[4x6]C[6,6])	121.9250	0.000	1	121.9280	0.003	3	122.1634	0.859	21	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[4x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[4x6]C[3x6]C[6,6]C[6])(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[6,6]2C)(C[6,6]C[4x6]H)(H)	H(C[6,6]C[4x6]C[6,6])	C[6,6](C[4x6]C[3x6]C[6,6]C[6])(C[6,6]C[3x6]H)(H){1|Si<4>,4|H<1>,5|C<4>}	C[6,6](C[3x6]C[6,6]2C)(C[6,6]C[4x6]H)(H){3|H<1>,4|C<4>}	H(C[6,6]C[4x6]C[6,6])	122.0840	0.000	1	122.0840	0.000	1	122.1634	0.859	21	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[4x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[4x6]C[3x6]C[6,6]C[6])(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[4x6]H)(H)	H(C[6,6]C[4x6]C[6,6])	C[6,6](C[4x6]C[3x6]C[6,6]C[6])(C[6,6]C[3x6]H)(H){1|O<1>,4|C<4>,4|H<1>}	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[4x6]H)(H){1|C<3>,2|C<4>,2|H<1>,2|O<2>}	H(C[6,6]C[4x6]C[6,6])	121.8353	0.183	3	121.8353	0.033	3	122.1634	0.859	21	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[4x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[4x6]C[3x6]O[6,6]C[6])(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[6,6]2Br)(C[6,6]C[4x6]H)(H)	H(C[6,6]C[4x6]C[6,6])	C[6,6](C[4x6]C[3x6]O[6,6]C[6])(C[6,6]C[3x6]H)(H){1|Br<1>,1|H<1>,3|C<3>,3|C<4>}	C[6,6](C[3x6]C[6,6]2Br)(C[6,6]C[4x6]H)(H){1|C<3>,1|O<1>,1|O<2>,3|C<4>}	H(C[6,6]C[4x6]C[6,6])	122.8040	0.000	1	122.8040	0.000	1	122.1634	0.859	21	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[4x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[4x6]C[3x6]P[3x6]C)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[4x6]H)(H)	H(C[6,6]C[4x6]C[6,6])	C[6,6](C[4x6]C[3x6]P[3x6]C)(C[6,6]C[3x6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[4x6]H)(H){1|C<3>,1|P<3>,2|C<4>,2|H<1>}	H(C[6,6]C[4x6]C[6,6])	120.6635	0.026	2	120.6635	0.001	2	122.1634	0.859	21	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[4x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[4x6]C[5,6,6]C[3x6]C[6])(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[4x6]H)(H)	H(C[6,6]C[4x6]C[6,6])	C[6,6](C[4x6]C[5,6,6]C[3x6]C[6])(C[6,6]C[3x6]H)(H){1|O<2>,4|C<4>,5|H<1>}	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[4x6]H)(H){1|O<2>,3|C<4>,3|H<1>}	H(C[6,6]C[4x6]C[6,6])	123.0943	1.266	4	123.0943	1.603	4	122.1634	0.859	21	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[4x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[4x6]C[6,6,6a]C[6,6a]C[4x6])(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[6,6,6a]C[3x6]H)(C[6,6]C[4x6]H)(H)	H(C[6,6]C[4x6]C[6,6])	C[6,6](C[4x6]C[6,6,6a]C[6,6a]C[4x6])(C[6,6]C[3x6]H)(H){1|H<1>,6|C<3>}	C[6,6](C[3x6]C[6,6,6a]C[3x6]H)(C[6,6]C[4x6]H)(H){5|C<3>}	H(C[6,6]C[4x6]C[6,6])	122.7285	0.158	2	122.7285	0.025	2	122.1634	0.859	21	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[4x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[4x6]Si[4,3x6]C[3x6]H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]Si[4,6,6]C[6,6]H)(C[6,6]C[4x6]H)(H)	H(C[6,6]C[4x6]C[6,6])	C[6,6](C[4x6]Si[4,3x6]C[3x6]H)(C[6,6]C[3x6]H)(H){1|Si<5>,2|Si<4>,1|H<1>,2|C<3>}	C[6,6](C[3x6]Si[4,6,6]C[6,6]H)(C[6,6]C[4x6]H)(H){1|Si<5>,2|Si<4>,1|C<3>,2|H<1>}	H(C[6,6]C[4x6]C[6,6])	120.7320	0.000	1	120.7320	0.000	1	122.1634	0.859	21	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[4x6]-4:C[6,6]-3:H-1:	C[4x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[4x6]C[3x6]C[4x6]H)(C[6,6]C[4x6]H)(H)	C[6,6](C[4x6]C[3x6]C[4x6]H)(C[6,6]C[4x6]H)(H)	H(C[6,6]C[4x6]C[6,6])	C[6,6](C[4x6]C[3x6]C[4x6]H)(C[6,6]C[4x6]H)(H){1|C<3>,3|C<4>,3|H<1>}	C[6,6](C[4x6]C[3x6]C[4x6]H)(C[6,6]C[4x6]H)(H){3|C<4>,4|H<1>}	H(C[6,6]C[4x6]C[6,6])	123.7760	0.000	1	123.4177	0.108	4	122.9405	0.236	12	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[4x6]-4:C[6,6]-3:H-1:	C[4x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[4x6]C[3x6]C[4x6]H)(C[6,6]C[4x6]H)(H)	C[6,6](C[4x6]C[3x6]C[4x6]H)(C[6,6]C[4x6]H)(H)	H(C[6,6]C[4x6]C[6,6])	C[6,6](C[4x6]C[3x6]C[4x6]H)(C[6,6]C[4x6]H)(H){1|O<2>,2|H<1>,4|C<4>}	C[6,6](C[4x6]C[3x6]C[4x6]H)(C[6,6]C[4x6]H)(H){3|C<4>,4|H<1>}	H(C[6,6]C[4x6]C[6,6])	123.5940	0.000	1	123.4177	0.108	4	122.9405	0.236	12	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[4x6]-4:C[6,6]-3:H-1:	C[4x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[4x6]C[3x6]C[4x6]H)(C[6,6]C[4x6]H)(H)	C[6,6](C[4x6]C[3x6]C[4x6]H)(C[6,6]C[4x6]H)(H)	H(C[6,6]C[4x6]C[6,6])	C[6,6](C[4x6]C[3x6]C[4x6]H)(C[6,6]C[4x6]H)(H){3|C<4>,4|H<1>}	C[6,6](C[4x6]C[3x6]C[4x6]H)(C[6,6]C[4x6]H)(H){1|C<3>,3|C<4>,3|H<1>}	H(C[6,6]C[4x6]C[6,6])	123.2540	0.000	1	123.4177	0.108	4	122.9405	0.236	12	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[4x6]-4:C[6,6]-3:H-1:	C[4x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[4x6]C[3x6]C[4x6]H)(C[6,6]C[4x6]H)(H)	C[6,6](C[4x6]C[3x6]C[4x6]H)(C[6,6]C[4x6]H)(H)	H(C[6,6]C[4x6]C[6,6])	C[6,6](C[4x6]C[3x6]C[4x6]H)(C[6,6]C[4x6]H)(H){3|C<4>,4|H<1>}	C[6,6](C[4x6]C[3x6]C[4x6]H)(C[6,6]C[4x6]H)(H){1|O<2>,2|H<1>,4|C<4>}	H(C[6,6]C[4x6]C[6,6])	123.0470	0.000	1	123.4177	0.108	4	122.9405	0.236	12	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[4x6]-4:C[6,6]-3:H-1:	C[4x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[4x6]C[3x6]C[5,6]O[6,6])(C[6,6]C[4x6]H)(H)	C[6,6](C[4x6]C[3x6]O[6,6]C[6])(C[6,6]C[4x6]H)(H)	H(C[6,6]C[4x6]C[6,6])	C[6,6](C[4x6]C[3x6]C[5,6]O[6,6])(C[6,6]C[4x6]H)(H){1|O<2>,2|H<1>,5|C<4>}	C[6,6](C[4x6]C[3x6]O[6,6]C[6])(C[6,6]C[4x6]H)(H){1|O<2>,2|H<1>,5|C<4>}	H(C[6,6]C[4x6]C[6,6])	122.7390	0.000	1	122.7390	0.000	1	122.9405	0.236	12	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[4x6]-4:C[6,6]-3:H-1:	C[4x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[4x6]C[3x6]C[6,6]C[6])(C[6,6]C[4x6]H)(H)	C[6,6](C[4x6]C[3x6]C[6,6]C[6])(C[6,6]C[4x6]H)(H)	H(C[6,6]C[4x6]C[6,6])	C[6,6](C[4x6]C[3x6]C[6,6]C[6])(C[6,6]C[4x6]H)(H){1|O<2>,2|C<4>,3|C<3>,3|H<1>}	C[6,6](C[4x6]C[3x6]C[6,6]C[6])(C[6,6]C[4x6]H)(H){1|O<2>,2|C<4>,3|C<3>,3|H<1>}	H(C[6,6]C[4x6]C[6,6])	122.4335	0.156	2	122.4335	0.024	2	122.9405	0.236	12	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[4x6]-4:C[6,6]-3:H-1:	C[4x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[4x6]C[3x6]O[6,6]C[6])(C[6,6]C[4x6]H)(H)	C[6,6](C[4x6]C[3x6]C[5,6]O[6,6])(C[6,6]C[4x6]H)(H)	H(C[6,6]C[4x6]C[6,6])	C[6,6](C[4x6]C[3x6]O[6,6]C[6])(C[6,6]C[4x6]H)(H){1|O<2>,2|H<1>,5|C<4>}	C[6,6](C[4x6]C[3x6]C[5,6]O[6,6])(C[6,6]C[4x6]H)(H){1|O<2>,2|H<1>,5|C<4>}	H(C[6,6]C[4x6]C[6,6])	122.4940	0.000	1	122.4940	0.000	1	122.9405	0.236	12	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[4x6]-4:C[6,6]-3:H-1:	C[4x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[4x6]N[5a,6,6]C[3x6]C[6])(C[6,6]C[4x6]H)(H)	C[6,6](C[4x6]N[5a,6,6]C[3x6]C[6])(C[6,6]C[4x6]H)(H)	H(C[6,6]C[4x6]C[6,6])	C[6,6](C[4x6]N[5a,6,6]C[3x6]C[6])(C[6,6]C[4x6]H)(H){1|N<3>,1|O<1>,3|C<3>,3|C<4>}	C[6,6](C[4x6]N[5a,6,6]C[3x6]C[6])(C[6,6]C[4x6]H)(H){1|N<3>,2|C<3>,3|C<4>,3|H<1>}	H(C[6,6]C[4x6]C[6,6])	123.2515	0.005	2	122.8787	0.191	4	122.9405	0.236	12	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[4x6]-4:C[6,6]-3:H-1:	C[4x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[4x6]N[5a,6,6]C[3x6]C[6])(C[6,6]C[4x6]H)(H)	C[6,6](C[4x6]N[5a,6,6]C[3x6]C[6])(C[6,6]C[4x6]H)(H)	H(C[6,6]C[4x6]C[6,6])	C[6,6](C[4x6]N[5a,6,6]C[3x6]C[6])(C[6,6]C[4x6]H)(H){1|N<3>,2|C<3>,3|C<4>,3|H<1>}	C[6,6](C[4x6]N[5a,6,6]C[3x6]C[6])(C[6,6]C[4x6]H)(H){1|N<3>,1|O<1>,3|C<3>,3|C<4>}	H(C[6,6]C[4x6]C[6,6])	122.5060	0.127	2	122.8787	0.191	4	122.9405	0.236	12	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[5,3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[5,3x6]C[5,3x6]O[6,6]C[5])(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[6,6]O[6,6]H)(C[6,6]C[5,3x6]H)(H)	H(C[6,6]C[5,3x6]C[6,6])	C[6,6](C[5,3x6]C[5,3x6]O[6,6]C[5])(C[6,6]C[3x6]H)(H){1|C<4>,1|N<3>,1|O<2>,2|C<3>,3|H<1>}	C[6,6](C[3x6]C[6,6]O[6,6]H)(C[6,6]C[5,3x6]H)(H){1|O<2>,2|C<4>,2|H<1>}	H(C[6,6]C[5,3x6]C[6,6])	124.2285	0.087	6	124.2285	0.008	6	123.7800	0.779	17	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[5,3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[5,3x6]C[5,6,6]2C[5])(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[5,6,6]C[6,6]C)(C[6,6]C[5,3x6]H)(H)	H(C[6,6]C[5,3x6]C[6,6])	C[6,6](C[5,3x6]C[5,6,6]2C[5])(C[6,6]C[3x6]H)(H){1|O<2>,3|H<1>,6|C<4>}	C[6,6](C[3x6]C[5,6,6]C[6,6]C)(C[6,6]C[5,3x6]H)(H){1|H<1>,1|O<2>,5|C<4>}	H(C[6,6]C[5,3x6]C[6,6])	124.4530	0.000	1	123.2495	2.897	2	123.7800	0.779	17	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[5,3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[5,3x6]C[5,6,6]2C[5])(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[5,6,6]C[6,6]C)(C[6,6]C[5,3x6]H)(H)	H(C[6,6]C[5,3x6]C[6,6])	C[6,6](C[5,3x6]C[5,6,6]2C[5])(C[6,6]C[3x6]H)(H){1|O<2>,4|H<1>,5|C<4>}	C[6,6](C[3x6]C[5,6,6]C[6,6]C)(C[6,6]C[5,3x6]H)(H){1|H<1>,1|O<2>,5|C<4>}	H(C[6,6]C[5,3x6]C[6,6])	122.0460	0.000	1	123.2495	2.897	2	123.7800	0.779	17	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[5,3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[5,3x6]C[5,6,6]2C[5])(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[5,3x6]H)(H)	H(C[6,6]C[5,3x6]C[6,6])	C[6,6](C[5,3x6]C[5,6,6]2C[5])(C[6,6]C[3x6]H)(H){1|C<3>,1|O<2>,3|C<4>,5|H<1>}	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[5,3x6]H)(H){1|H<1>,1|O<2>,5|C<4>}	H(C[6,6]C[5,3x6]C[6,6])	122.7460	0.016	2	123.2300	0.691	6	123.7800	0.779	17	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[5,3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[5,3x6]C[5,6,6]2C[5])(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[5,3x6]H)(H)	H(C[6,6]C[5,3x6]C[6,6])	C[6,6](C[5,3x6]C[5,6,6]2C[5])(C[6,6]C[3x6]H)(H){1|C<3>,1|O<2>,3|C<4>,5|H<1>}	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[5,3x6]H)(H){1|O<2>,3|C<4>,3|H<1>}	H(C[6,6]C[5,3x6]C[6,6])	123.3437	1.130	3	123.2300	0.691	6	123.7800	0.779	17	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[5,3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[5,3x6]C[5,6,6]2C[5])(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[5,3x6]H)(H)	H(C[6,6]C[5,3x6]C[6,6])	C[6,6](C[5,3x6]C[5,6,6]2C[5])(C[6,6]C[3x6]H)(H){1|O<2>,4|C<4>,5|H<1>}	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[5,3x6]H)(H){1|O<2>,3|C<4>,3|H<1>}	H(C[6,6]C[5,3x6]C[6,6])	123.8570	0.000	1	123.2300	0.691	6	123.7800	0.779	17	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[5,3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[5,3x6]C[6,6,6a]C[5,6,6]C[5])(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[6,6,6a]C[6,6]H)(C[6,6]C[5,3x6]H)(H)	H(C[6,6]C[5,3x6]C[6,6])	C[6,6](C[5,3x6]C[6,6,6a]C[5,6,6]C[5])(C[6,6]C[3x6]H)(H){2|C<4>,2|H<1>,4|C<3>}	C[6,6](C[3x6]C[6,6,6a]C[6,6]H)(C[6,6]C[5,3x6]H)(H){1|C<4>,2|H<1>,3|C<3>}	H(C[6,6]C[5,3x6]C[6,6])	124.4545	1.216	2	124.4545	1.477	2	123.7800	0.779	17	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[5,3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[5,3x6]C[6,6,6a]C[5,6,6]Se[5])(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[6,6,6a]C[6,6]H)(C[6,6]C[5,3x6]H)(H)	H(C[6,6]C[5,3x6]C[6,6])	C[6,6](C[5,3x6]C[6,6,6a]C[5,6,6]Se[5])(C[6,6]C[3x6]H)(H){1|H<1>,1|O<1>,5|C<3>}	C[6,6](C[3x6]C[6,6,6a]C[6,6]H)(C[6,6]C[5,3x6]H)(H){1|Se<3>,4|C<3>}	H(C[6,6]C[5,3x6]C[6,6])	124.1010	0.000	1	124.1010	0.000	1	123.7800	0.779	17	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[5,4x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[5,4x6]C[5,3x6]C[5,5,6]C[6,6])(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[3,6,6]C[6,6]H)(C[6,6]C[5,4x6]H)(H)	H(C[6,6]C[5,4x6]C[6,6])	C[6,6](C[5,4x6]C[5,3x6]C[5,5,6]C[6,6])(C[6,6]C[3x6]H)(H){1|O<1>,3|H<1>,5|C<4>}	C[6,6](C[3x6]C[3,6,6]C[6,6]H)(C[6,6]C[5,4x6]H)(H){1|C<3>,1|O<2>,2|H<1>,3|C<4>}	H(C[6,6]C[5,4x6]C[6,6])	122.1205	0.069	2	122.0840	0.006	3	122.8828	2.556	4	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[5,4x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[5,4x6]C[5,3x6]C[5,5,6]C[6,6])(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[3,6,6]C[6,6]H)(C[6,6]C[5,4x6]H)(H)	H(C[6,6]C[5,4x6]C[6,6])	C[6,6](C[5,4x6]C[5,3x6]C[5,5,6]C[6,6])(C[6,6]C[3x6]H)(H){2|O<2>,3|H<1>,5|C<4>}	C[6,6](C[3x6]C[3,6,6]C[6,6]H)(C[6,6]C[5,4x6]H)(H){1|O<2>,2|H<1>,4|C<4>}	H(C[6,6]C[5,4x6]C[6,6])	122.0110	0.000	1	122.0840	0.006	3	122.8828	2.556	4	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[5,4x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[5,4x6]C[5,3x6]C[5,6,6]C[6,6a])(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[6,6]O[6,6]H)(C[6,6]C[5,4x6]H)(H)	H(C[6,6]C[5,4x6]C[6,6])	C[6,6](C[5,4x6]C[5,3x6]C[5,6,6]C[6,6a])(C[6,6]C[3x6]H)(H){1|N<3>,1|O<2>,2|C<3>,2|C<4>,3|H<1>}	C[6,6](C[3x6]C[6,6]O[6,6]H)(C[6,6]C[5,4x6]H)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6,6]C[5,4x6]C[6,6])	125.2790	0.000	1	125.2790	0.000	1	122.8828	2.556	4	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[5,5,6,6]-4:C[6,6]-3:H-1:	C[3,6,6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[5,5,6,6]C[5,5,6,6]2H)(C[6,6]C[3,6,6]H)(H)	C[6,6](C[3,6,6]C[3,5,6,6]2H)(C[6,6]C[5,5,6,6]H)(H)	H(C[6,6]C[5,5,6,6]C[6,6])	C[6,6](C[5,5,6,6]C[5,5,6,6]2H)(C[6,6]C[3,6,6]H)(H){1|Si<4>,2|C<3>,2|C<4>,2|H<1>}	C[6,6](C[3,6,6]C[3,5,6,6]2H)(C[6,6]C[5,5,6,6]H)(H){1|Si<4>,2|C<4>,2|H<1>}	H(C[6,6]C[5,5,6,6]C[6,6])	122.2230	0.000	1	122.2230	0.000	1	122.2230	0.000	1	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[5,6,6]-4:C[6,6]-3:H-1:	C[3,6,6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[5,6,6]C[5,6]2H)(C[6,6]C[3,6,6]H)(H)	C[6,6](C[3,6,6]C[3,5,6,6]2C)(C[6,6]C[5,6,6]H)(H)	H(C[6,6]C[5,6,6]C[6,6])	C[6,6](C[5,6,6]C[5,6]2H)(C[6,6]C[3,6,6]H)(H){1|C<3>,2|C<4>,4|H<1>}	C[6,6](C[3,6,6]C[3,5,6,6]2C)(C[6,6]C[5,6,6]H)(H){1|C<3>,1|H<1>,3|C<4>}	H(C[6,6]C[5,6,6]C[6,6])	122.2160	0.000	1	122.2160	0.000	1	122.7093	0.609	3	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[5,6,6]-4:C[6,6]-3:H-1:	C[3,6,6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[5,6,6]C[5,6]2H)(C[6,6]C[3,6,6]H)(H)	C[6,6](C[3,6,6]C[3,5,6]2H)(C[6,6]C[5,6,6]H)(H)	H(C[6,6]C[5,6,6]C[6,6])	C[6,6](C[5,6,6]C[5,6]2H)(C[6,6]C[3,6,6]H)(H){2|C<3>,2|C<4>,2|H<1>}	C[6,6](C[3,6,6]C[3,5,6]2H)(C[6,6]C[5,6,6]H)(H){1|C<4>,2|C<3>,2|H<1>}	H(C[6,6]C[5,6,6]C[6,6])	122.9560	0.923	2	122.9560	0.853	2	122.7093	0.609	3	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[5x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[5x6]C[3x6]2C[6,6])(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[5x6]H)(H)	H(C[6,6]C[5x6]C[6,6])	C[6,6](C[5x6]C[3x6]2C[6,6])(C[6,6]C[3x6]H)(H){2|C<3>,2|H<1>,2|O<2>,3|C<4>}	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[5x6]H)(H){1|H<1>,2|C<3>,2|C<4>}	H(C[6,6]C[5x6]C[6,6])	123.1620	0.000	1	123.1620	0.000	1	123.0573	2.347	7	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[5x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[5x6]C[5,4x6]C[6,6]2)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[5,6,6]C[6,6]O)(C[6,6]C[5x6]H)(H)	H(C[6,6]C[5x6]C[6,6])	C[6,6](C[5x6]C[5,4x6]C[6,6]2)(C[6,6]C[3x6]H)(H){1|C<3>,1|N<3>,1|O<2>,3|H<1>,4|C<4>}	C[6,6](C[3x6]C[5,6,6]C[6,6]O)(C[6,6]C[5x6]H)(H){1|C<3>,1|H<1>,1|O<2>,4|C<4>}	H(C[6,6]C[5x6]C[6,6])	121.7950	0.000	1	123.0398	2.814	6	123.0573	2.347	7	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[5x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[5x6]C[5,4x6]C[6,6]2)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[5,6,6]C[6,6]O)(C[6,6]C[5x6]H)(H)	H(C[6,6]C[5x6]C[6,6])	C[6,6](C[5x6]C[5,4x6]C[6,6]2)(C[6,6]C[3x6]H)(H){1|C<3>,1|N<3>,1|O<2>,3|H<1>,4|C<4>}	C[6,6](C[3x6]C[5,6,6]C[6,6]O)(C[6,6]C[5x6]H)(H){1|C<3>,1|O<2>,2|H<1>,3|C<4>}	H(C[6,6]C[5x6]C[6,6])	122.6040	0.042	2	123.0398	2.814	6	123.0573	2.347	7	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[5x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[5x6]C[5,4x6]C[6,6]2)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[5,6,6]C[6,6]O)(C[6,6]C[5x6]H)(H)	H(C[6,6]C[5x6]C[6,6])	C[6,6](C[5x6]C[5,4x6]C[6,6]2)(C[6,6]C[3x6]H)(H){1|C<3>,1|N<3>,1|O<2>,3|H<1>,4|C<4>}	C[6,6](C[3x6]C[5,6,6]C[6,6]O)(C[6,6]C[5x6]H)(H){1|Cl<1>,1|C<2>,1|H<1>,1|O<2>,3|C<4>}	H(C[6,6]C[5x6]C[6,6])	126.4050	0.000	1	123.0398	2.814	6	123.0573	2.347	7	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	C[5x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](C[5x6]C[5,4x6]C[6,6]2)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[5,6,6]C[6,6]O)(C[6,6]C[5x6]H)(H)	H(C[6,6]C[5x6]C[6,6])	C[6,6](C[5x6]C[5,4x6]C[6,6]2)(C[6,6]C[3x6]H)(H){1|C<3>,1|N<3>,1|O<2>,3|H<1>,4|C<4>}	C[6,6](C[3x6]C[5,6,6]C[6,6]O)(C[6,6]C[5x6]H)(H){1|Cl<1>,1|O<2>,2|H<1>,3|C<4>}	H(C[6,6]C[5x6]C[6,6])	122.4155	0.192	2	123.0398	2.814	6	123.0573	2.347	7	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:1:	3:	N[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:H-1:	C[6,6]-3:	C[6,6](N[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(H)	C[6,6](C[3x6]C[6,6]2H)(C[6,6]N[3x6]H)(H)	H(C[6,6]C[6,6]N[3x6])	C[6,6](N[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(H){1|C<3>,2|C<4>,3|H<1>}	C[6,6](C[3x6]C[6,6]2H)(C[6,6]N[3x6]H)(H){1|C<2>,1|C<3>,1|C<4>,3|H<1>}	H(C[6,6]C[6,6]N[3x6])	119.5810	0.000	1	119.5810	0.000	1	119.5810	0.000	1	122.9417	2.200	505	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:2:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:O-2:	C[6,6]-3:	C[6,6](C[3x6]C[3x6]C[6,6]C)(C[6,6]C[3x6]O)(H)	C[6,6](C[3x6]C[6,6]2Cl)(C[6,6]C[3x6]H)(OC)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[3x6]C[6,6]C)(C[6,6]C[3x6]O)(H){1|Cl<1>,1|C<3>,1|C<4>,2|H<1>,2|O<2>}	C[6,6](C[3x6]C[6,6]2Cl)(C[6,6]C[3x6]H)(OC){1|O<1>,2|C<3>,3|C<4>}	H(C[6,6]C[3x6]C[6,6])	122.7650	0.000	1	122.7650	0.000	1	122.9840	0.078	3	122.8975	0.047	6	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:2:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:O-2:	C[6,6]-3:	C[6,6](C[3x6]C[5,6,6]C[6,6]O)(C[6,6]C[3x6]O)(H)	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]H)(OC)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[5,6,6]C[6,6]O)(C[6,6]C[3x6]O)(H){1|C<3>,2|C<4>,4|H<1>}	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]H)(OC){1|C<3>,1|O<2>,2|C<4>,3|H<1>}	H(C[6,6]C[3x6]C[6,6])	122.8880	0.000	1	122.8880	0.000	1	122.9840	0.078	3	122.8975	0.047	6	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:2:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:O-2:	C[6,6]-3:	C[6,6](C[3x6]C[6,6]2O)(C[6,6]C[3x6]O)(H)	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(OC)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6]2O)(C[6,6]C[3x6]O)(H){1|C<2>,1|W<7>,2|C<4>,3|H<1>}	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(OC){1|O<2>,1|W<7>,2|C<4>,3|H<1>}	H(C[6,6]C[3x6]C[6,6])	123.2990	0.000	1	123.2990	0.000	1	122.9840	0.078	3	122.8975	0.047	6	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:2:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[5,3x6]-4:C[6,6]-3:O-2:	C[6,6]-3:	C[6,6](C[3x6]C[3x6]C[6,6]C)(C[6,6]C[5,3x6]O)(H)	C[6,6](C[5,3x6]C[5,6,6]2Cl)(C[6,6]C[3x6]H)(OC)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[3x6]C[6,6]C)(C[6,6]C[5,3x6]O)(H){1|Cl<1>,2|C<4>,2|H<1>,2|O<2>}	C[6,6](C[5,3x6]C[5,6,6]2Cl)(C[6,6]C[3x6]H)(OC){1|O<2>,3|C<3>,3|C<4>}	H(C[6,6]C[3x6]C[6,6])	122.8805	0.062	2	122.8805	0.004	2	122.8805	0.004	2	122.8975	0.047	6	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:2:	3:	C[4x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:O-2:	C[6,6]-3:	C[6,6](C[4x6]C[5,6,6]C[4x6]Si[6])(C[6,6]C[3x6]O)(H)	C[6,6](C[3x6]C[5,6,6]C[3x6]H)(C[6,6]C[4x6]H)(OC)	H(C[6,6]C[4x6]C[6,6])	C[6,6](C[4x6]C[5,6,6]C[4x6]Si[6])(C[6,6]C[3x6]O)(H){2|C<3>,2|H<1>,5|C<4>}	C[6,6](C[3x6]C[5,6,6]C[3x6]H)(C[6,6]C[4x6]H)(OC){1|Si<4>,2|C<3>,2|C<4>,2|H<1>}	H(C[6,6]C[4x6]C[6,6])	122.6720	0.000	1	122.6720	0.000	1	122.6720	0.000	1	122.8975	0.047	6	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:3:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:C-3:	C[6,6]-3:	C[6,6](C[3x6]C[5,3x6]C[6,6]H)(C[6,6]C[3x6]C)(H)	C[6,6](C[3x6]C[3x6]C[6,6]H)(C[6,6]C[3x6]H)(COO)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[5,3x6]C[6,6]H)(C[6,6]C[3x6]C)(H){1|C<3>,3|C<4>,3|H<1>}	C[6,6](C[3x6]C[3x6]C[6,6]H)(C[6,6]C[3x6]H)(COO){3|C<4>,4|H<1>}	H(C[6,6]C[3x6]C[6,6])	122.6430	0.000	1	122.6430	0.000	1	122.7449	0.285	20	121.7917	3.094	56	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:3:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:C-3:	C[6,6]-3:	C[6,6](C[3x6]C[5,6,6]C[6,6]Br)(C[6,6]C[3x6]C)(H)	C[6,6](C[3x6]C[5,6,6]O[6,6]H)(C[6,6]C[3x6]H)(CC[6a]O)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[5,6,6]C[6,6]Br)(C[6,6]C[3x6]C)(H){1|H<1>,1|O<1>,1|O<2>,3|C<4>}	C[6,6](C[3x6]C[5,6,6]O[6,6]H)(C[6,6]C[3x6]H)(CC[6a]O){1|Br<1>,1|C<3>,1|H<1>,2|C<4>}	H(C[6,6]C[3x6]C[6,6])	123.3350	0.000	1	123.3350	0.000	1	122.7449	0.285	20	121.7917	3.094	56	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:3:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:C-3:	C[6,6]-3:	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]C)(H)	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]H)(CCO)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]C)(H){1|C<3>,1|H<1>,1|O<1>,3|C<4>}	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]H)(CCO){1|C<3>,1|C<4>,1|N<3>,2|H<1>,2|O<2>}	H(C[6,6]C[3x6]C[6,6])	122.4690	0.000	1	122.4690	0.000	1	122.7449	0.285	20	121.7917	3.094	56	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:3:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:C-3:	C[6,6]-3:	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]C)(H)	C[6,6](C[3x6]C[5,6,6]O[6,6]H)(C[6,6]C[3x6]H)(COO)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]C)(H){1|C<3>,1|H<1>,1|O<1>,1|O<2>,2|C<4>}	C[6,6](C[3x6]C[5,6,6]O[6,6]H)(C[6,6]C[3x6]H)(COO){1|C<3>,2|C<4>,2|H<1>}	H(C[6,6]C[3x6]C[6,6])	123.5350	0.000	1	123.3225	0.028	4	122.7449	0.285	20	121.7917	3.094	56	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:3:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:C-3:	C[6,6]-3:	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]C)(H)	C[6,6](C[3x6]C[5,6,6]O[6,6]H)(C[6,6]C[3x6]H)(COO)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]C)(H){1|C<4>,1|N<3>,1|O<1>,1|O<2>,2|H<1>}	C[6,6](C[3x6]C[5,6,6]O[6,6]H)(C[6,6]C[3x6]H)(COO){1|C<3>,2|C<4>,2|H<1>}	H(C[6,6]C[3x6]C[6,6])	123.2270	0.000	1	123.3225	0.028	4	122.7449	0.285	20	121.7917	3.094	56	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:3:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:C-3:	C[6,6]-3:	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]C)(H)	C[6,6](C[3x6]C[5,6,6]O[6,6]H)(C[6,6]C[3x6]H)(COO)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]C)(H){1|H<1>,1|O<1>,1|O<2>,3|C<4>}	C[6,6](C[3x6]C[5,6,6]O[6,6]H)(C[6,6]C[3x6]H)(COO){1|C<3>,2|C<4>,2|H<1>}	H(C[6,6]C[3x6]C[6,6])	123.2640	0.147	2	123.3225	0.028	4	122.7449	0.285	20	121.7917	3.094	56	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:3:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:C-3:	C[6,6]-3:	C[6,6](C[3x6]C[6,6,6a]2H)(C[6,6]C[3x6]C)(H)	C[6,6](C[3x6]C[6,6,6a]2H)(C[6,6]C[3x6]H)(CNO)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6,6a]2H)(C[6,6]C[3x6]C)(H){1|H<1>,4|C<3>}	C[6,6](C[3x6]C[6,6,6a]2H)(C[6,6]C[3x6]H)(CNO){1|H<1>,4|C<3>}	H(C[6,6]C[3x6]C[6,6])	122.7160	0.000	1	122.7160	0.000	1	122.7449	0.285	20	121.7917	3.094	56	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:3:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:C-3:	C[6,6]-3:	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]C)(H)	C[6,6](C[3x6]C[5,6,6]C[6,6]C)(C[6,6]C[3x6]H)(COO)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]C)(H){1|C<3>,3|C<4>,3|H<1>}	C[6,6](C[3x6]C[5,6,6]C[6,6]C)(C[6,6]C[3x6]H)(COO){1|O<2>,3|C<4>,3|H<1>}	H(C[6,6]C[3x6]C[6,6])	122.0330	0.000	1	122.0330	0.000	1	122.7449	0.285	20	121.7917	3.094	56	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:3:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:C-3:	C[6,6]-3:	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]C)(H)	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(CCH)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]C)(H){1|C<3>,1|O<1>,2|C<4>,2|H<1>}	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(CCH){1|C<4>,2|C<3>,2|H<1>,2|O<2>}	H(C[6,6]C[3x6]C[6,6])	122.0820	0.000	1	122.0820	0.000	1	122.7449	0.285	20	121.7917	3.094	56	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:3:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:C-3:	C[6,6]-3:	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]C)(H)	C[6,6](C[3x6]C[6,6]O[6,6]H)(C[6,6]C[3x6]H)(COO)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]C)(H){1|C<3>,1|H<1>,1|O<1>,1|O<2>,2|C<4>}	C[6,6](C[3x6]C[6,6]O[6,6]H)(C[6,6]C[3x6]H)(COO){1|C<3>,1|C<4>,3|H<1>}	H(C[6,6]C[3x6]C[6,6])	123.1488	0.375	4	123.1488	0.141	4	122.7449	0.285	20	121.7917	3.094	56	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:3:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:C-3:	C[6,6]-3:	C[6,6](C[3x6]C[6,6]2N)(C[6,6]C[3x6]C)(H)	C[6,6](C[3x6]C[6,6]O[6,6]C)(C[6,6]C[3x6]H)(CCO)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6]2N)(C[6,6]C[3x6]C)(H){1|H<1>,1|N<3>,1|O<1>,1|O<2>,2|C<4>}	C[6,6](C[3x6]C[6,6]O[6,6]C)(C[6,6]C[3x6]H)(CCO){1|C<3>,1|C<4>,1|N<3>,2|H<1>}	H(C[6,6]C[3x6]C[6,6])	122.2510	0.304	2	122.1750	0.043	4	122.7449	0.285	20	121.7917	3.094	56	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:3:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:C-3:	C[6,6]-3:	C[6,6](C[3x6]C[6,6]2N)(C[6,6]C[3x6]C)(H)	C[6,6](C[3x6]C[6,6]O[6,6]C)(C[6,6]C[3x6]H)(CCO)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6]2N)(C[6,6]C[3x6]C)(H){1|H<1>,1|O<1>,2|C<4>,2|O<2>}	C[6,6](C[3x6]C[6,6]O[6,6]C)(C[6,6]C[3x6]H)(CCO){1|C<3>,1|C<4>,1|N<3>,2|H<1>}	H(C[6,6]C[3x6]C[6,6])	122.0990	0.116	2	122.1750	0.043	4	122.7449	0.285	20	121.7917	3.094	56	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:3:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:C-3:	C[6,6]-3:	C[6,6](C[3x6]C[6,6]2N)(C[6,6]C[3x6]C)(H)	C[6,6](C[3x6]C[6,6]O[6,6]C)(C[6,6]C[3x6]H)(CC[6a]O)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6]2N)(C[6,6]C[3x6]C)(H){1|H<1>,1|N<3>,1|O<1>,1|O<2>,2|C<4>}	C[6,6](C[3x6]C[6,6]O[6,6]C)(C[6,6]C[3x6]H)(CC[6a]O){1|C<3>,1|C<4>,1|N<3>,2|H<1>}	H(C[6,6]C[3x6]C[6,6])	122.6100	0.000	1	122.5175	0.017	2	122.7449	0.285	20	121.7917	3.094	56	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:3:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:C-3:	C[6,6]-3:	C[6,6](C[3x6]C[6,6]2N)(C[6,6]C[3x6]C)(H)	C[6,6](C[3x6]C[6,6]O[6,6]C)(C[6,6]C[3x6]H)(CC[6a]O)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6]2N)(C[6,6]C[3x6]C)(H){1|H<1>,1|O<1>,2|C<4>,2|O<2>}	C[6,6](C[3x6]C[6,6]O[6,6]C)(C[6,6]C[3x6]H)(CC[6a]O){1|C<3>,1|C<4>,1|N<3>,2|H<1>}	H(C[6,6]C[3x6]C[6,6])	122.4250	0.000	1	122.5175	0.017	2	122.7449	0.285	20	121.7917	3.094	56	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:3:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:C[6a]-3:	C[6,6]-3:	C[6,6](C[3x6]C[3x6]C[6,6]C)(C[6,6]C[3x6]C[6a])(H)	C[6,6](C[3x6]C[5,6,6]C[3x6]H)(C[6,6]C[3x6]H)(C[6a]C[6a]2)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[3x6]C[6,6]C)(C[6,6]C[3x6]C[6a])(H){1|H<1>,1|O<1>,2|C<4>,4|C<3>}	C[6,6](C[3x6]C[5,6,6]C[3x6]H)(C[6,6]C[3x6]H)(C[6a]C[6a]2){1|O<2>,3|C<3>,3|H<1>,4|C<4>}	H(C[6,6]C[3x6]C[6,6])	121.2830	0.000	1	121.2830	0.000	1	122.5418	0.512	5	121.7917	3.094	56	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:3:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:C[6a]-3:	C[6,6]-3:	C[6,6](C[3x6]C[6,6]O[6,6]H)(C[6,6]C[3x6]C[6a])(H)	C[6,6](C[3x6]C[6,6]N[6,6]H)(C[6,6]C[3x6]H)(C[6a]C[6a]2)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6]O[6,6]H)(C[6,6]C[3x6]C[6a])(H){1|C<4>,1|N<3>,2|C<3>,3|H<1>}	C[6,6](C[3x6]C[6,6]N[6,6]H)(C[6,6]C[3x6]H)(C[6a]C[6a]2){1|C<4>,1|O<2>,3|C<3>,5|H<1>}	H(C[6,6]C[3x6]C[6,6])	122.8565	0.150	4	122.8565	0.022	4	122.5418	0.512	5	121.7917	3.094	56	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:3:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:N-3:	C[6,6]-3:	C[6,6](C[3x6]C[5,6,6]N[3x6]H)(C[6,6]C[3x6]N)(H)	C[6,6](C[3x6]C[3x6]C[6,6]H)(C[6,6]C[3x6]H)(NCC)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[5,6,6]N[3x6]H)(C[6,6]C[3x6]N)(H){1|H<1>,2|C<4>,3|C<3>}	C[6,6](C[3x6]C[3x6]C[6,6]H)(C[6,6]C[3x6]H)(NCC){1|C<3>,1|N<3>,2|C<4>,3|H<1>}	H(C[6,6]C[3x6]C[6,6])	122.8170	0.000	1	122.8170	0.000	1	122.8170	0.000	1	121.7917	3.094	56	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:3:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:N[5]-3:	C[6,6]-3:	C[6,6](C[3x6]C[6,6]N[6,6]H)(C[6,6]C[3x6]N[5])(H)	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(N[5]C[5]2)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6]N[6,6]H)(C[6,6]C[3x6]N[5])(H){1|C<3>,1|S<4>,3|C<4>,3|H<1>}	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(N[5]C[5]2){1|N<3>,1|O<1>,1|O<2>,4|C<4>,5|H<1>}	H(C[6,6]C[3x6]C[6,6])	123.5060	0.000	1	123.5060	0.000	1	123.5060	0.000	1	121.7917	3.094	56	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:3:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[4x6]-4:C[6,6]-3:C-3:	C[6,6]-3:	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[4x6]C)(H)	C[6,6](C[4x6]C[3x6]O[6,6]C[6])(C[6,6]C[3x6]H)(CCH)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[4x6]C)(H){1|C<3>,1|O<1>,1|O<2>,3|C<4>}	C[6,6](C[4x6]C[3x6]O[6,6]C[6])(C[6,6]C[3x6]H)(CCH){2|C<3>,3|C<4>,3|H<1>}	H(C[6,6]C[3x6]C[6,6])	122.5290	0.000	1	122.5290	0.000	1	122.5290	0.000	1	121.7917	3.094	56	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:3:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[5,3x6]-4:C[6,6]-3:C-3:	C[6,6]-3:	C[6,6](C[3x6]C[3x6]C[6,6]H)(C[6,6]C[5,3x6]C)(H)	C[6,6](C[5,3x6]C[5,3x6]C[5,6,6]H)(C[6,6]C[3x6]H)(CCH)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[3x6]C[6,6]H)(C[6,6]C[5,3x6]C)(H){1|C<3>,1|O<2>,2|C<4>,3|H<1>}	C[6,6](C[5,3x6]C[5,3x6]C[5,6,6]H)(C[6,6]C[3x6]H)(CCH){1|C<3>,2|C<4>,2|H<1>,2|O<2>}	H(C[6,6]C[3x6]C[6,6])	122.3760	0.000	1	122.3760	0.000	1	122.3760	0.000	1	121.7917	3.094	56	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:3:	3:	C[3x6]-4:C[6,6]-3:H-1:	P[3x6]-4:C[6,6]-3:C[6a]-3:	C[6,6]-3:	C[6,6](C[3x6]C[6,6,6a]C[6,6]C[6a])(C[6,6]P[3x6]C[6a])(H)	C[6,6](P[3x6]C[6,6,6a]C[6,6]Fe)(C[6,6]C[3x6]H)(C[6a]C[6a]2)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6,6a]C[6,6]C[6a])(C[6,6]P[3x6]C[6a])(H){1|Fe<8>,1|H<1>,7|C<3>}	C[6,6](P[3x6]C[6,6,6a]C[6,6]Fe)(C[6,6]C[3x6]H)(C[6a]C[6a]2){1|C<4>,1|H<1>,7|C<3>}	H(C[6,6]C[3x6]C[6,6])	119.3885	0.107	2	119.3885	0.011	2	119.5150	0.092	8	121.7917	3.094	56	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:3:	3:	C[3x6]-4:C[6,6]-3:H-1:	P[3x6]-4:C[6,6]-3:C[6a]-3:	C[6,6]-3:	C[6,6](C[3x6]C[6,6,6a]C[6,6]C[6a])(C[6,6]P[3x6]C[6a])(H)	C[6,6](P[3x6]C[6,6,6a]C[6,6]Se)(C[6,6]C[3x6]H)(C[6a]C[6a]2)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6,6a]C[6,6]C[6a])(C[6,6]P[3x6]C[6a])(H){1|Se<1>,1|H<1>,7|C<3>}	C[6,6](P[3x6]C[6,6,6a]C[6,6]Se)(C[6,6]C[3x6]H)(C[6a]C[6a]2){2|H<1>,7|C<3>}	H(C[6,6]C[3x6]C[6,6])	119.4698	0.307	4	119.4698	0.094	4	119.5150	0.092	8	121.7917	3.094	56	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:3:	3:	C[3x6]-4:C[6,6]-3:H-1:	P[3x6]-4:C[6,6]-3:C[6a]-3:	C[6,6]-3:	C[6,6](C[3x6]C[6,6,6a]C[6,6]C[6a])(C[6,6]P[3x6]C[6a])(H)	C[6,6](P[3x6]C[6,6,6a]C[6,6]W)(C[6,6]C[3x6]H)(C[6a]C[6a]2)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6,6a]C[6,6]C[6a])(C[6,6]P[3x6]C[6a])(H){1|H<1>,1|W<6>,7|C<3>}	C[6,6](P[3x6]C[6,6,6a]C[6,6]W)(C[6,6]C[3x6]H)(C[6a]C[6a]2){2|H<1>,7|C<3>}	H(C[6,6]C[3x6]C[6,6])	119.7320	0.467	2	119.7320	0.218	2	119.5150	0.092	8	121.7917	3.094	56	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:3:	3:	C[4x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:C-3:	C[6,6]-3:	C[6,6](C[4x6]C[3x6]C[6,6]C[6])(C[6,6]C[3x6]C)(H)	C[6,6](C[3x6]C[6,6]2C)(C[6,6]C[4x6]H)(COO)	H(C[6,6]C[4x6]C[6,6])	C[6,6](C[4x6]C[3x6]C[6,6]C[6])(C[6,6]C[3x6]C)(H){1|C<3>,1|O<1>,2|H<1>,2|O<2>,3|C<4>}	C[6,6](C[3x6]C[6,6]2C)(C[6,6]C[4x6]H)(COO){1|C<3>,2|C<4>,4|H<1>}	H(C[6,6]C[4x6]C[6,6])	122.2340	0.000	1	122.2340	0.000	1	122.5990	0.266	2	121.7917	3.094	56	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:3:	3:	C[4x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:C-3:	C[6,6]-3:	C[6,6](C[4x6]C[3x6]C[6,6]C[6])(C[6,6]C[3x6]C)(H)	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[4x6]H)(COO)	H(C[6,6]C[4x6]C[6,6])	C[6,6](C[4x6]C[3x6]C[6,6]C[6])(C[6,6]C[3x6]C)(H){1|C<3>,1|O<1>,2|C<4>,2|O<2>,3|H<1>}	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[4x6]H)(COO){1|C<3>,2|C<4>,4|H<1>}	H(C[6,6]C[4x6]C[6,6])	122.9640	0.000	1	122.9640	0.000	1	122.5990	0.266	2	121.7917	3.094	56	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:3:	3:	C[4x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:N[5]-3:	C[6,6]-3:	C[6,6](C[4x6]C[3x6]C[6,6]C[6])(C[6,6]C[3x6]N[5])(H)	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[4x6]H)(N[5]C[5]2)	H(C[6,6]C[4x6]C[6,6])	C[6,6](C[4x6]C[3x6]C[6,6]C[6])(C[6,6]C[3x6]N[5])(H){1|C<3>,1|N<3>,4|C<4>,6|H<1>}	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[4x6]H)(N[5]C[5]2){1|O<1>,1|O<2>,4|C<4>,6|H<1>}	H(C[6,6]C[4x6]C[6,6])	123.1110	0.000	1	123.1110	0.000	1	123.1110	0.000	1	121.7917	3.094	56	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:3:	3:	C[5,4x6]-4:C[6,6]-3:H-1:	C[5x6]-4:C[6,6]-3:C[6a]-3:	C[6,6]-3:	C[6,6](C[5,4x6]P[5,5,3x6]C[5,5x6]C[6a])(C[6,6]C[5x6]C[6a])(H)	C[6,6](C[5x6]C[5,5x6]C[5x6]H)(C[6,6]C[5,4x6]H)(C[6a]C[6a]2)	H(C[6,6]C[5,4x6]C[6,6])	C[6,6](C[5,4x6]P[5,5,3x6]C[5,5x6]C[6a])(C[6,6]C[5x6]C[6a])(H){1|H<1>,1|O<1>,1|O<2>,1|P<4>,2|C<4>,5|C<3>}	C[6,6](C[5x6]C[5,5x6]C[5x6]H)(C[6,6]C[5,4x6]H)(C[6a]C[6a]2){1|P<4>,2|C<4>,3|H<1>,5|C<3>}	H(C[6,6]C[5,4x6]C[6,6])	124.0215	3.252	4	124.0215	10.576	4	124.0215	10.576	4	121.7917	3.094	56	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:3:	3:	C[6,6]-4:C[6,6]-3:H-1:	C[4,6,6]-4:C[6,6]-3:C-3:	C[6,6]-3:	C[6,6](C[6,6]C[4,6,6]HH)(C[6,6]C[4,6,6]C)(H)	C[6,6](C[4,6,6]C[4,6]2H)(C[6,6]C[6,6]H)(CCH)	H(C[6,6]C[6,6]2)	C[6,6](C[6,6]C[4,6,6]HH)(C[6,6]C[4,6,6]C)(H){2|C<4>,2|H<1>}	C[6,6](C[4,6,6]C[4,6]2H)(C[6,6]C[6,6]H)(CCH){3|C<4>,4|H<1>}	H(C[6,6]C[6,6]2)	119.9980	0.337	2	119.9980	0.113	2	120.0819	0.430	12	121.7917	3.094	56	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:3:	3:	C[6,6]-4:C[6,6]-3:H-1:	C[4,6,6]-4:C[6,6]-3:C-3:	C[6,6]-3:	C[6,6](C[6,6]C[4,6,6]HH)(C[6,6]C[4,6,6]C)(H)	C[6,6](C[4,6,6]C[4,6]2H)(C[6,6]C[6,6]H)(CHN)	H(C[6,6]C[6,6]2)	C[6,6](C[6,6]C[4,6,6]HH)(C[6,6]C[4,6,6]C)(H){2|C<4>,2|H<1>}	C[6,6](C[4,6,6]C[4,6]2H)(C[6,6]C[6,6]H)(CHN){3|C<4>,4|H<1>}	H(C[6,6]C[6,6]2)	120.0987	0.715	10	120.0987	0.511	10	120.0819	0.430	12	121.7917	3.094	56	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:4:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:C-4:	C[6,6]-3:	C[6,6](C[3x6]C[3,6,6]C[3x6]H)(C[6,6]C[3x6]C)(H)	C[6,6](C[3x6]C[3x6]C[6,6]C)(C[6,6]C[3x6]H)(CH3)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[3,6,6]C[3x6]H)(C[6,6]C[3x6]C)(H){1|C<3>,1|H<1>,1|O<2>,4|C<4>}	C[6,6](C[3x6]C[3x6]C[6,6]C)(C[6,6]C[3x6]H)(CH3){1|C<3>,1|O<1>,2|C<4>,2|H<1>}	H(C[6,6]C[3x6]C[6,6])	122.1680	0.000	1	122.1680	0.000	1	122.3962	0.501	24	121.4405	2.287	66	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:4:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:C-4:	C[6,6]-3:	C[6,6](C[3x6]C[3x6]C[6,6]C)(C[6,6]C[3x6]C)(H)	C[6,6](C[3x6]C[3x6]C[6,6]H)(C[6,6]C[3x6]H)(CH3)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[3x6]C[6,6]C)(C[6,6]C[3x6]C)(H){1|C<3>,1|H<1>,1|O<1>,3|C<4>}	C[6,6](C[3x6]C[3x6]C[6,6]H)(C[6,6]C[3x6]H)(CH3){1|C<3>,1|H<1>,1|O<2>,4|C<4>}	H(C[6,6]C[3x6]C[6,6])	121.4360	0.000	1	121.4360	0.000	1	122.3962	0.501	24	121.4405	2.287	66	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:4:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:C-4:	C[6,6]-3:	C[6,6](C[3x6]C[3x6]C[6,6]C)(C[6,6]C[3x6]C)(H)	C[6,6](C[3x6]C[5,6,6]C[3x6]H)(C[6,6]C[3x6]H)(CH3)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[3x6]C[6,6]C)(C[6,6]C[3x6]C)(H){1|C<3>,1|H<1>,1|O<1>,3|C<4>}	C[6,6](C[3x6]C[5,6,6]C[3x6]H)(C[6,6]C[3x6]H)(CH3){1|C<3>,1|H<1>,1|O<2>,4|C<4>}	H(C[6,6]C[3x6]C[6,6])	121.6710	0.000	1	121.6710	0.000	1	122.3962	0.501	24	121.4405	2.287	66	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:4:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:C-4:	C[6,6]-3:	C[6,6](C[3x6]C[3x6]C[6,6]H)(C[6,6]C[3x6]C)(H)	C[6,6](C[3x6]C[3x6]C[6,6]H)(C[6,6]C[3x6]H)(CH3)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[3x6]C[6,6]H)(C[6,6]C[3x6]C)(H){1|C<3>,1|O<2>,2|H<1>,3|C<4>}	C[6,6](C[3x6]C[3x6]C[6,6]H)(C[6,6]C[3x6]H)(CH3){1|C<3>,1|O<1>,2|C<4>,2|H<1>}	H(C[6,6]C[3x6]C[6,6])	122.2170	0.308	3	122.2170	0.095	3	122.3962	0.501	24	121.4405	2.287	66	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:4:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:C-4:	C[6,6]-3:	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]C)(H)	C[6,6](C[3x6]C[5,6,6]C[6,6]C)(C[6,6]C[3x6]H)(CCHH)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]C)(H){1|C<3>,2|C<2>,4|C<4>}	C[6,6](C[3x6]C[5,6,6]C[6,6]C)(C[6,6]C[3x6]H)(CCHH){1|H<1>,2|C<2>,4|C<4>}	H(C[6,6]C[3x6]C[6,6])	123.3130	0.000	1	123.3130	0.000	1	122.3962	0.501	24	121.4405	2.287	66	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:4:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:C-4:	C[6,6]-3:	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]C)(H)	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]H)(CCCH)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]C)(H){1|C<3>,2|C<4>,2|H<1>,2|O<2>}	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]H)(CCCH){1|O<1>,1|O<2>,2|C<4>,2|H<1>}	H(C[6,6]C[3x6]C[6,6])	122.7330	0.000	1	122.7330	0.000	1	122.3962	0.501	24	121.4405	2.287	66	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:4:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:C-4:	C[6,6]-3:	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]C)(H)	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]H)(CH3)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]C)(H){1|C<3>,3|C<4>,3|H<1>}	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]H)(CH3){1|C<3>,2|C<4>,4|H<1>}	H(C[6,6]C[3x6]C[6,6])	122.2010	0.000	1	122.2010	0.000	1	122.3962	0.501	24	121.4405	2.287	66	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:4:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:C-4:	C[6,6]-3:	C[6,6](C[3x6]C[5,6,6]O[6,6]C[6a])(C[6,6]C[3x6]C)(H)	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]H)(CH3)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[5,6,6]O[6,6]C[6a])(C[6,6]C[3x6]C)(H){2|C<4>,2|H<1>,3|C<3>}	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[3x6]H)(CH3){1|C<4>,1|O<2>,2|C<3>,3|H<1>}	H(C[6,6]C[3x6]C[6,6])	122.6180	0.000	1	122.6180	0.000	1	122.3962	0.501	24	121.4405	2.287	66	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:4:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:C-4:	C[6,6]-3:	C[6,6](C[3x6]C[6,6]2C)(C[6,6]C[3x6]C)(H)	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(CH3)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6]2C)(C[6,6]C[3x6]C)(H){1|C<3>,1|H<1>,1|O<1>,3|C<4>}	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(CH3){1|C<3>,1|O<2>,2|H<1>,3|C<4>}	H(C[6,6]C[3x6]C[6,6])	124.4040	0.000	1	122.9627	1.663	4	122.3962	0.501	24	121.4405	2.287	66	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:4:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:C-4:	C[6,6]-3:	C[6,6](C[3x6]C[6,6]2C)(C[6,6]C[3x6]C)(H)	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(CH3)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6]2C)(C[6,6]C[3x6]C)(H){1|C<3>,1|O<1>,2|C<4>,2|H<1>}	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(CH3){1|C<3>,1|O<2>,2|H<1>,3|C<4>}	H(C[6,6]C[3x6]C[6,6])	121.6560	0.000	1	122.9627	1.663	4	122.3962	0.501	24	121.4405	2.287	66	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:4:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:C-4:	C[6,6]-3:	C[6,6](C[3x6]C[6,6]2C)(C[6,6]C[3x6]C)(H)	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(CH3)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6]2C)(C[6,6]C[3x6]C)(H){1|C<3>,2|C<4>,4|H<1>}	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(CH3){1|C<3>,3|C<4>,3|H<1>}	H(C[6,6]C[3x6]C[6,6])	122.1220	0.000	1	122.9627	1.663	4	122.3962	0.501	24	121.4405	2.287	66	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:4:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:C-4:	C[6,6]-3:	C[6,6](C[3x6]C[6,6]2C)(C[6,6]C[3x6]C)(H)	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(CH3)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6]2C)(C[6,6]C[3x6]C)(H){1|O<1>,2|H<1>,3|C<4>}	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(CH3){1|C<3>,2|C<4>,4|H<1>}	H(C[6,6]C[3x6]C[6,6])	123.6690	0.000	1	122.9627	1.663	4	122.3962	0.501	24	121.4405	2.287	66	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:4:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:C-4:	C[6,6]-3:	C[6,6](C[3x6]C[6,6]2C)(C[6,6]C[3x6]C)(H)	C[6,6](C[3x6]C[6,6]N[6,6]H)(C[6,6]C[3x6]H)(CH3)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6]2C)(C[6,6]C[3x6]C)(H){1|C<4>,1|N<3>,5|H<1>}	C[6,6](C[3x6]C[6,6]N[6,6]H)(C[6,6]C[3x6]H)(CH3){1|H<1>,2|C<3>,3|C<4>}	H(C[6,6]C[3x6]C[6,6])	122.2120	0.000	1	122.2120	0.000	1	122.3962	0.501	24	121.4405	2.287	66	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:4:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:C-4:	C[6,6]-3:	C[6,6](C[3x6]C[6,6]2C[6])(C[6,6]C[3x6]C)(H)	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(CH3)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6]2C[6])(C[6,6]C[3x6]C)(H){1|O<1>,2|C<3>,2|C<4>,3|H<1>}	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(CH3){1|C<4>,2|C<3>,4|H<1>}	H(C[6,6]C[3x6]C[6,6])	122.0300	0.102	2	121.8032	0.077	4	122.3962	0.501	24	121.4405	2.287	66	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:4:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:C-4:	C[6,6]-3:	C[6,6](C[3x6]C[6,6]2C[6])(C[6,6]C[3x6]C)(H)	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(CH3)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6]2C[6])(C[6,6]C[3x6]C)(H){1|O<1>,2|C<3>,3|C<4>,3|H<1>}	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]H)(CH3){1|C<3>,2|C<4>,4|H<1>}	H(C[6,6]C[3x6]C[6,6])	121.5765	0.118	2	121.8032	0.077	4	122.3962	0.501	24	121.4405	2.287	66	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:4:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:C-4:	C[6,6]-3:	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]C)(H)	C[6,6](C[3x6]C[6,6]N[6,6]H)(C[6,6]C[3x6]H)(CCHH)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]C)(H){1|C<4>,1|N<3>,5|H<1>}	C[6,6](C[3x6]C[6,6]N[6,6]H)(C[6,6]C[3x6]H)(CCHH){1|C<3>,1|H<1>,4|C<4>}	H(C[6,6]C[3x6]C[6,6])	122.8830	0.000	1	122.5490	0.084	3	122.3962	0.501	24	121.4405	2.287	66	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:4:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:C-4:	C[6,6]-3:	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]C)(H)	C[6,6](C[3x6]C[6,6]N[6,6]H)(C[6,6]C[3x6]H)(CCHH)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[3x6]C)(H){1|C<4>,1|N<4>,5|H<1>}	C[6,6](C[3x6]C[6,6]N[6,6]H)(C[6,6]C[3x6]H)(CCHH){2|C<3>,2|H<1>,3|C<4>}	H(C[6,6]C[3x6]C[6,6])	122.3820	0.030	2	122.5490	0.084	3	122.3962	0.501	24	121.4405	2.287	66	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:4:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:C-4:	C[6,6]-3:	C[6,6](C[3x6]C[6,6]O[6,6]H)(C[6,6]C[3x6]C)(H)	C[6,6](C[3x6]C[6,6]N[6,6]H)(C[6,6]C[3x6]H)(CH3)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6]O[6,6]H)(C[6,6]C[3x6]C)(H){1|C<4>,1|N<3>,3|H<1>}	C[6,6](C[3x6]C[6,6]N[6,6]H)(C[6,6]C[3x6]H)(CH3){1|C<3>,1|C<4>,1|O<2>,3|H<1>}	H(C[6,6]C[3x6]C[6,6])	122.9840	0.000	1	122.9840	0.000	1	122.3962	0.501	24	121.4405	2.287	66	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:4:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:C-4:	C[6,6]-3:	C[6,6](C[3x6]N[5a,6,6]C[3,6,6]H)(C[6,6]C[3x6]C)(H)	C[6,6](C[3x6]N[5a,6,6]C[3,6,6]H)(C[6,6]C[3x6]H)(CH3)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]N[5a,6,6]C[3,6,6]H)(C[6,6]C[3x6]C)(H){1|C<3>,1|N<3>,2|C<4>,2|H<1>}	C[6,6](C[3x6]N[5a,6,6]C[3,6,6]H)(C[6,6]C[3x6]H)(CH3){1|C<3>,1|N<3>,2|C<4>,2|H<1>}	H(C[6,6]C[3x6]C[6,6])	122.8110	0.000	1	122.8110	0.000	1	122.3962	0.501	24	121.4405	2.287	66	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:4:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:C[5]-4:	C[6,6]-3:	C[6,6](C[3x6]C[3x6]C[6,6]H)(C[6,6]C[3x6]C[5])(H)	C[6,6](C[3x6]C[3x6]C[6,6]H)(C[6,6]C[3x6]H)(C[5]C[5]2C)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[3x6]C[6,6]H)(C[6,6]C[3x6]C[5])(H){1|C<3>,1|O<2>,2|H<1>,6|C<4>}	C[6,6](C[3x6]C[3x6]C[6,6]H)(C[6,6]C[3x6]H)(C[5]C[5]2C){1|C<3>,1|O<1>,4|H<1>,6|C<4>}	H(C[6,6]C[3x6]C[6,6])	123.8900	0.000	1	123.8900	0.000	1	123.8900	0.000	1	121.4405	2.287	66	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:4:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[4x6]-4:C[6,6]-3:C-4:	C[6,6]-3:	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[4x6]C)(H)	C[6,6](C[4x6]C[5,3x6]C[6,6]C[6])(C[6,6]C[3x6]H)(CCHH)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[4x6]C)(H){1|C<3>,2|C<2>,4|C<4>}	C[6,6](C[4x6]C[5,3x6]C[6,6]C[6])(C[6,6]C[3x6]H)(CCHH){2|C<2>,3|H<1>,5|C<4>}	H(C[6,6]C[3x6]C[6,6])	125.3680	0.000	1	125.3680	0.000	1	125.3680	0.000	1	121.4405	2.287	66	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:4:	3:	C[3x6]-4:C[6,6]-3:H-1:	C[5,3x6]-4:C[6,6]-3:C-4:	C[6,6]-3:	C[6,6](C[3x6]C[6,6]O[6,6]C)(C[6,6]C[5,3x6]C)(H)	C[6,6](C[5,3x6]C[5,3x6]C[6,6]O[5])(C[6,6]C[3x6]H)(CC3)	H(C[6,6]C[3x6]C[6,6])	C[6,6](C[3x6]C[6,6]O[6,6]C)(C[6,6]C[5,3x6]C)(H){1|C<3>,1|H<1>,1|O<2>,2|C<4>}	C[6,6](C[5,3x6]C[5,3x6]C[6,6]O[5])(C[6,6]C[3x6]H)(CC3){1|C<3>,1|O<1>,1|O<2>,4|C<4>}	H(C[6,6]C[3x6]C[6,6])	120.5090	0.000	1	120.5090	0.000	1	120.5090	0.000	1	121.4405	2.287	66	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:4:	3:	C[4,4x6]-4:C[6,6]-3:H-1:	C[4,4x6]-4:C[6,6]-3:C-4:	C[6,6]-3:	C[6,6](C[4,4x6]C[4,4,4x6]2H)(C[6,6]C[4,4x6]C)(H)	C[6,6](C[4,4x6]C[4,4,4x6]2H)(C[6,6]C[4,4x6]H)(CCHH)	H(C[6,6]C[4,4x6]C[6,6])	C[6,6](C[4,4x6]C[4,4,4x6]2H)(C[6,6]C[4,4x6]C)(H){2|H<1>,4|C<4>}	C[6,6](C[4,4x6]C[4,4,4x6]2H)(C[6,6]C[4,4x6]H)(CCHH){1|C<2>,2|H<1>,3|C<4>}	H(C[6,6]C[4,4x6]C[6,6])	121.4790	0.000	1	121.4790	0.000	1	121.4790	0.000	1	121.4405	2.287	66	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:4:	3:	C[4x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:C-4:	C[6,6]-3:	C[6,6](C[4x6]C[3x6]C[6,6]C[6])(C[6,6]C[3x6]C)(H)	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[4x6]H)(CCCH)	H(C[6,6]C[4x6]C[6,6])	C[6,6](C[4x6]C[3x6]C[6,6]C[6])(C[6,6]C[3x6]C)(H){1|C<3>,4|C<4>,5|H<1>}	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[4x6]H)(CCCH){1|C<3>,3|C<4>,3|H<1>}	H(C[6,6]C[4x6]C[6,6])	121.6597	0.043	3	121.9123	0.319	9	121.8262	0.237	15	121.4405	2.287	66	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:4:	3:	C[4x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:C-4:	C[6,6]-3:	C[6,6](C[4x6]C[3x6]C[6,6]C[6])(C[6,6]C[3x6]C)(H)	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[4x6]H)(CCCH)	H(C[6,6]C[4x6]C[6,6])	C[6,6](C[4x6]C[3x6]C[6,6]C[6])(C[6,6]C[3x6]C)(H){1|C<3>,4|C<4>,5|H<1>}	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[4x6]H)(CCCH){3|C<4>,4|H<1>}	H(C[6,6]C[4x6]C[6,6])	121.9105	0.258	2	121.9123	0.319	9	121.8262	0.237	15	121.4405	2.287	66	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:4:	3:	C[4x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:C-4:	C[6,6]-3:	C[6,6](C[4x6]C[3x6]C[6,6]C[6])(C[6,6]C[3x6]C)(H)	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[4x6]H)(CCCH)	H(C[6,6]C[4x6]C[6,6])	C[6,6](C[4x6]C[3x6]C[6,6]C[6])(C[6,6]C[3x6]C)(H){5|C<4>,5|H<1>}	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[4x6]H)(CCCH){3|C<4>,4|H<1>}	H(C[6,6]C[4x6]C[6,6])	122.1997	1.008	3	121.9123	0.319	9	121.8262	0.237	15	121.4405	2.287	66	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:4:	3:	C[4x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:C-4:	C[6,6]-3:	C[6,6](C[4x6]C[3x6]C[6,6]C[6])(C[6,6]C[3x6]C)(H)	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[4x6]H)(CCCH)	H(C[6,6]C[4x6]C[6,6])	C[6,6](C[4x6]C[3x6]C[6,6]C[6])(C[6,6]C[3x6]C)(H){5|C<4>,5|H<1>}	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[4x6]H)(CCCH){3|H<1>,4|C<4>}	H(C[6,6]C[4x6]C[6,6])	121.8120	0.000	1	121.9123	0.319	9	121.8262	0.237	15	121.4405	2.287	66	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:4:	3:	C[4x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:C-4:	C[6,6]-3:	C[6,6](C[4x6]C[3x6]C[6,6]C[6])(C[6,6]C[3x6]C)(H)	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[4x6]H)(CH3)	H(C[6,6]C[4x6]C[6,6])	C[6,6](C[4x6]C[3x6]C[6,6]C[6])(C[6,6]C[3x6]C)(H){1|O<1>,2|C<3>,2|C<4>,4|H<1>}	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[4x6]H)(CH3){1|C<3>,2|C<4>,4|H<1>}	H(C[6,6]C[4x6]C[6,6])	121.6290	0.000	1	121.6290	0.000	1	121.8262	0.237	15	121.4405	2.287	66	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:4:	3:	C[4x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:C-4:	C[6,6]-3:	C[6,6](C[4x6]C[3x6]C[6,6]C[6])(C[6,6]C[3x6]C)(H)	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[4x6]H)(CHHO)	H(C[6,6]C[4x6]C[6,6])	C[6,6](C[4x6]C[3x6]C[6,6]C[6])(C[6,6]C[3x6]C)(H){1|O<1>,2|C<3>,2|C<4>,3|H<1>}	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[4x6]H)(CHHO){1|C<4>,1|H<1>,1|O<1>,2|C<3>}	H(C[6,6]C[4x6]C[6,6])	121.7060	0.000	1	121.7060	0.000	1	121.8262	0.237	15	121.4405	2.287	66	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:4:	3:	C[4x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:C-4:	C[6,6]-3:	C[6,6](C[4x6]C[5,6,6]C[3x6]C[6])(C[6,6]C[3x6]C)(H)	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[4x6]H)(CCCH)	H(C[6,6]C[4x6]C[6,6])	C[6,6](C[4x6]C[5,6,6]C[3x6]C[6])(C[6,6]C[3x6]C)(H){1|C<3>,4|C<4>,5|H<1>}	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6,6]C[4x6]H)(CCCH){1|C<3>,3|C<4>,3|H<1>}	H(C[6,6]C[4x6]C[6,6])	121.7117	0.445	4	121.7117	0.198	4	121.8262	0.237	15	121.4405	2.287	66	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:4:	3:	C[4x6]-4:C[6,6]-3:H-1:	C[3x6]-4:C[6,6]-3:Si-4:	C[6,6]-3:	C[6,6](C[4x6]C[3x6]C[6,6]C[6])(C[6,6]C[3x6]Si)(H)	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[4x6]H)(SiC3)	H(C[6,6]C[4x6]C[6,6])	C[6,6](C[4x6]C[3x6]C[6,6]C[6])(C[6,6]C[3x6]Si)(H){1|C<3>,1|O<1>,3|C<4>,3|H<1>}	C[6,6](C[3x6]C[6,6]2H)(C[6,6]C[4x6]H)(SiC3){1|C<4>,1|H<1>,2|C<3>,2|O<2>}	H(C[6,6]C[4x6]C[6,6])	121.1860	0.000	1	121.1860	0.000	1	121.1860	0.000	1	121.4405	2.287	66	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:4:	3:	C[5,6,6]-4:C[6,6]-3:H-1:	C[3,6,6]-4:C[6,6]-3:C-4:	C[6,6]-3:	C[6,6](C[5,6,6]C[5,6]2C)(C[6,6]C[3,6,6]C)(H)	C[6,6](C[3,6,6]C[3,5,6]2H)(C[6,6]C[5,6,6]H)(CH3)	H(C[6,6]C[5,6,6]C[6,6])	C[6,6](C[5,6,6]C[5,6]2C)(C[6,6]C[3,6,6]C)(H){1|C<3>,3|C<4>,3|H<1>}	C[6,6](C[3,6,6]C[3,5,6]2H)(C[6,6]C[5,6,6]H)(CH3){1|H<1>,4|C<4>}	H(C[6,6]C[5,6,6]C[6,6])	121.4290	0.000	1	121.4290	0.000	1	121.4290	0.000	1	121.4405	2.287	66	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:4:	3:	C[6,6]-4:C[6,6]-3:H-1:	C[4,6,6]-4:C[6,6]-3:C-4:	C[6,6]-3:	C[6,6](C[6,6]C[4,6,6]CH)(C[6,6]C[4,6,6]C)(H)	C[6,6](C[4,6,6]C[4,6]2H)(C[6,6]C[6,6]H)(CH3)	H(C[6,6]C[6,6]2)	C[6,6](C[6,6]C[4,6,6]CH)(C[6,6]C[4,6,6]C)(H){2|C<4>,2|H<1>}	C[6,6](C[4,6,6]C[4,6]2H)(C[6,6]C[6,6]H)(CH3){3|H<1>,4|C<4>}	H(C[6,6]C[6,6]2)	120.5570	0.287	2	120.5570	0.082	2	120.0485	1.217	19	121.4405	2.287	66	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:4:	3:	C[6,6]-4:C[6,6]-3:H-1:	C[4,6,6]-4:C[6,6]-3:C-4:	C[6,6]-3:	C[6,6](C[6,6]C[4,6,6]HH)(C[6,6]C[4,6,6]C)(H)	C[6,6](C[4,6,6]C[4,6]2H)(C[6,6]C[6,6]H)(CCHN)	H(C[6,6]C[6,6]2)	C[6,6](C[6,6]C[4,6,6]HH)(C[6,6]C[4,6,6]C)(H){2|C<4>,2|H<1>}	C[6,6](C[4,6,6]C[4,6]2H)(C[6,6]C[6,6]H)(CCHN){3|C<4>,4|H<1>}	H(C[6,6]C[6,6]2)	119.9950	2.257	5	119.9950	5.095	5	120.0485	1.217	19	121.4405	2.287	66	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:4:	3:	C[6,6]-4:C[6,6]-3:H-1:	C[4,6,6]-4:C[6,6]-3:C-4:	C[6,6]-3:	C[6,6](C[6,6]C[4,6,6]HH)(C[6,6]C[4,6,6]C)(H)	C[6,6](C[4,6,6]C[4,6]2H)(C[6,6]C[6,6]H)(CCHO)	H(C[6,6]C[6,6]2)	C[6,6](C[6,6]C[4,6,6]HH)(C[6,6]C[4,6,6]C)(H){2|C<4>,2|H<1>}	C[6,6](C[4,6,6]C[4,6]2H)(C[6,6]C[6,6]H)(CCHO){3|C<4>,4|H<1>}	H(C[6,6]C[6,6]2)	120.3170	0.000	1	120.3170	0.000	1	120.0485	1.217	19	121.4405	2.287	66	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:4:	3:	C[6,6]-4:C[6,6]-3:H-1:	C[4,6,6]-4:C[6,6]-3:C-4:	C[6,6]-3:	C[6,6](C[6,6]C[4,6,6]HH)(C[6,6]C[4,6,6]C)(H)	C[6,6](C[4,6,6]C[4,6]2H)(C[6,6]C[6,6]H)(CC[5]CH)	H(C[6,6]C[6,6]2)	C[6,6](C[6,6]C[4,6,6]HH)(C[6,6]C[4,6,6]C)(H){2|C<4>,2|H<1>}	C[6,6](C[4,6,6]C[4,6]2H)(C[6,6]C[6,6]H)(CC[5]CH){3|C<4>,4|H<1>}	H(C[6,6]C[6,6]2)	119.4960	0.000	1	119.4960	0.000	1	120.0485	1.217	19	121.4405	2.287	66	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:4:	3:	C[6,6]-4:C[6,6]-3:H-1:	C[4,6,6]-4:C[6,6]-3:C-4:	C[6,6]-3:	C[6,6](C[6,6]C[4,6,6]HH)(C[6,6]C[4,6,6]C)(H)	C[6,6](C[4,6,6]C[4,6]2H)(C[6,6]C[6,6]H)(CH3)	H(C[6,6]C[6,6]2)	C[6,6](C[6,6]C[4,6,6]HH)(C[6,6]C[4,6,6]C)(H){2|C<4>,2|H<1>}	C[6,6](C[4,6,6]C[4,6]2H)(C[6,6]C[6,6]H)(CH3){3|C<4>,4|H<1>}	H(C[6,6]C[6,6]2)	119.8360	0.000	1	119.6650	0.058	2	120.0485	1.217	19	121.4405	2.287	66	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:4:	3:	C[6,6]-4:C[6,6]-3:H-1:	C[4,6,6]-4:C[6,6]-3:C-4:	C[6,6]-3:	C[6,6](C[6,6]C[4,6,6]HH)(C[6,6]C[4,6,6]C)(H)	C[6,6](C[4,6,6]C[4,6]2H)(C[6,6]C[6,6]H)(CH3)	H(C[6,6]C[6,6]2)	C[6,6](C[6,6]C[4,6,6]HH)(C[6,6]C[4,6,6]C)(H){2|C<4>,2|H<1>}	C[6,6](C[4,6,6]C[4,6]2H)(C[6,6]C[6,6]H)(CH3){3|H<1>,4|C<4>}	H(C[6,6]C[6,6]2)	119.4940	0.000	1	119.6650	0.058	2	120.0485	1.217	19	121.4405	2.287	66	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:4:	3:	C[6,6]-4:C[6,6]-3:H-1:	C[4,6,6]-4:C[6,6]-3:C-4:	C[6,6]-3:	C[6,6](C[6,6]C[4,6,6]HH)(C[6,6]C[4,6,6]C)(H)	C[6,6](C[4,6,6]C[4,6]2H)(C[6,6]C[6,6]H)(CSeHH)	H(C[6,6]C[6,6]2)	C[6,6](C[6,6]C[4,6,6]HH)(C[6,6]C[4,6,6]C)(H){2|C<4>,2|H<1>}	C[6,6](C[4,6,6]C[4,6]2H)(C[6,6]C[6,6]H)(CSeHH){3|C<4>,4|H<1>}	H(C[6,6]C[6,6]2)	120.2480	0.000	1	120.2480	0.000	1	120.0485	1.217	19	121.4405	2.287	66	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:4:	3:	C[6,6]-4:C[6,6]-3:H-1:	C[4,6,6]-4:C[6,6]-3:C-4:	C[6,6]-3:	C[6,6](C[6,6]C[4,6,6]HH)(C[6,6]C[4,6,6]C)(H)	C[6,6](C[4,6,6]C[4,6]2O)(C[6,6]C[6,6]H)(CH3)	H(C[6,6]C[6,6]2)	C[6,6](C[6,6]C[4,6,6]HH)(C[6,6]C[4,6,6]C)(H){1|H<1>,1|O<2>,2|C<4>}	C[6,6](C[4,6,6]C[4,6]2O)(C[6,6]C[6,6]H)(CH3){3|C<4>,4|H<1>}	H(C[6,6]C[6,6]2)	119.9597	0.111	3	119.9597	0.012	3	120.0485	1.217	19	121.4405	2.287	66	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:4:	3:	C[6,6]-4:C[6,6]-3:H-1:	C[4,6,6]-4:C[6,6]-3:C-4:	C[6,6]-3:	C[6,6](C[6,6]C[4,6,6]HN)(C[6,6]C[4,6,6]C)(H)	C[6,6](C[4,6,6]C[4,6]2H)(C[6,6]C[6,6]H)(CH3)	H(C[6,6]C[6,6]2)	C[6,6](C[6,6]C[4,6,6]HN)(C[6,6]C[4,6,6]C)(H){2|C<4>,2|H<1>}	C[6,6](C[4,6,6]C[4,6]2H)(C[6,6]C[6,6]H)(CH3){1|N<3>,3|C<4>,3|H<1>}	H(C[6,6]C[6,6]2)	120.0140	0.000	1	120.0140	0.000	1	120.0485	1.217	19	121.4405	2.287	66	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:4:	3:	C[6,6]-4:C[6,6]-3:H-1:	C[4,6,6]-4:C[6,6]-3:C-4:	C[6,6]-3:	C[6,6](C[6,6]C[4,6,6]HO)(C[6,6]C[4,6,6]C)(H)	C[6,6](C[4,6,6]C[4,6]2H)(C[6,6]C[6,6]H)(CH3)	H(C[6,6]C[6,6]2)	C[6,6](C[6,6]C[4,6,6]HO)(C[6,6]C[4,6,6]C)(H){2|C<4>,2|H<1>}	C[6,6](C[4,6,6]C[4,6]2H)(C[6,6]C[6,6]H)(CH3){1|O<2>,3|C<4>,3|H<1>}	H(C[6,6]C[6,6]2)	120.1830	0.142	3	120.1830	0.020	3	120.0485	1.217	19	121.4405	2.287	66	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:4:	3:	Ge[3x6]-4:C[6,6]-3:H-1:	Ge[5,3x6]-4:C[6,6]-3:C[3]-4:	C[6,6]-3:	C[6,6](Ge[3x6]C[3x6]C[6,6]C[6a])(C[6,6]Ge[5,3x6]C[3])(H)	C[6,6](Ge[5,3x6]C[5,3x6]C[5,6a]C[6,6])(C[6,6]Ge[3x6]H)(C[3]C[3]2C)	H(C[6,6]Ge[3x6]C[6,6])	C[6,6](Ge[3x6]C[3x6]C[6,6]C[6a])(C[6,6]Ge[5,3x6]C[3])(H){1|H<1>,5|C<3>,5|C<4>}	C[6,6](Ge[5,3x6]C[5,3x6]C[5,6a]C[6,6])(C[6,6]Ge[3x6]H)(C[3]C[3]2C){1|O<2>,2|C<4>,3|H<1>,6|C<3>}	H(C[6,6]Ge[3x6]C[6,6])	117.1680	0.000	1	117.1680	0.000	1	117.1680	0.000	1	121.4405	2.287	66	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6,6]	C[6,6]	H	4:3:1:	4:3:4:	3:	Ge[5,3x6]-4:C[6,6]-3:H-1:	Ge[3x6]-4:C[6,6]-3:C[3]-4:	C[6,6]-3:	C[6,6](Ge[5,3x6]C[5,3x6]C[5,6a]C[6,6])(C[6,6]Ge[3x6]C[3])(H)	C[6,6](Ge[3x6]C[3x6]C[6,6]C[6a])(C[6,6]Ge[5,3x6]H)(C[3]C[3]2C)	H(C[6,6]Ge[5,3x6]C[6,6])	C[6,6](Ge[5,3x6]C[5,3x6]C[5,6a]C[6,6])(C[6,6]Ge[3x6]C[3])(H){5|C<3>,6|C<4>}	C[6,6](Ge[3x6]C[3x6]C[6,6]C[6a])(C[6,6]Ge[5,3x6]H)(C[3]C[3]2C){1|C<4>,1|O<2>,4|H<1>,6|C<3>}	H(C[6,6]Ge[5,3x6]C[6,6])	118.2230	0.000	1	118.2230	0.000	1	118.2230	0.000	1	121.4405	2.287	66	122.6691	2.507	700	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[3x6]	H	3:3:1:	3:3:3:	3:	C[3x6]-3:C[6]-3:H-1:	N[3x6]-3:P[3x6]-3:C[6]-3:	C[6]-3:	C[6](C[3x6]N[3x6]P[3x6])(C[6]C[6]H)(H)	C[3x6](N[3x6]As[3x6]C[6])(P[3x6]C[3x6]2)(C[6]C[6]H)	H(C[6]C[3x6]C[6])	C[6](C[3x6]N[3x6]P[3x6])(C[6]C[6]H)(H){1|As<3>,1|H<1>,3|C<3>}	C[3x6](N[3x6]As[3x6]C[6])(P[3x6]C[3x6]2)(C[6]C[6]H){2|H<1>,2|N<3>,3|C<3>}	H(C[6]C[3x6]C[6])	120.1403	0.072	3	120.1403	0.005	3	120.1403	0.005	3	120.1403	0.005	3	119.5118	0.954	105	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[3x6]	H	3:3:1:	3:4:3:	3:	C[3x6]-3:C[6]-3:H-1:	C[3x6]-3:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[3x6]C[3x6]C[6,6])(C[6]C[6]N[6])(H)	C[3x6](C[3x6]C[4,6,6]C[6])(C[6,6]C[4,6,6]HH)(C[6]C[6]H)	H(C[6]C[3x6]C[6])	C[6](C[3x6]C[3x6]C[6,6])(C[6]C[6]N[6])(H){1|Os<6>,1|N<3>,2|C<3>,2|C<4>,2|H<1>}	C[3x6](C[3x6]C[4,6,6]C[6])(C[6,6]C[4,6,6]HH)(C[6]C[6]H){1|C<3>,1|N<3>,2|C<4>,3|H<1>}	H(C[6]C[3x6]C[6])	120.2140	0.343	5	119.7703	0.373	9	119.8106	0.201	28	119.8474	0.182	34	119.5118	0.954	105	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[3x6]	H	3:3:1:	3:4:3:	3:	C[3x6]-3:C[6]-3:H-1:	C[3x6]-3:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[3x6]C[3x6]C[6,6])(C[6]C[6]N[6])(H)	C[3x6](C[3x6]C[4,6,6]C[6])(C[6,6]C[4,6,6]HH)(C[6]C[6]H)	H(C[6]C[3x6]C[6])	C[6](C[3x6]C[3x6]C[6,6])(C[6]C[6]N[6])(H){1|Pt<4>,1|N<3>,2|C<3>,2|C<4>,2|H<1>}	C[3x6](C[3x6]C[4,6,6]C[6])(C[6,6]C[4,6,6]HH)(C[6]C[6]H){1|C<3>,1|N<3>,2|C<4>,3|H<1>}	H(C[6]C[3x6]C[6])	119.2157	0.317	4	119.7703	0.373	9	119.8106	0.201	28	119.8474	0.182	34	119.5118	0.954	105	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[3x6]	H	3:3:1:	3:4:3:	3:	C[3x6]-3:C[6]-3:H-1:	C[3x6]-3:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[3x6]C[3x6]C[6,6])(C[6]C[6a]N[6])(H)	C[3x6](C[3x6]C[4,6,6]C[6])(C[6,6]C[4,6,6]HH)(C[6]C[6]H)	H(C[6]C[3x6]C[6])	C[6](C[3x6]C[3x6]C[6,6])(C[6]C[6a]N[6])(H){1|N<2>,2|C<3>,2|C<4>,3|H<1>}	C[3x6](C[3x6]C[4,6,6]C[6])(C[6,6]C[4,6,6]HH)(C[6]C[6]H){1|C<3>,1|N<3>,2|C<4>,3|H<1>}	H(C[6]C[3x6]C[6])	119.9700	0.118	7	119.7879	0.097	15	119.8106	0.201	28	119.8474	0.182	34	119.5118	0.954	105	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[3x6]	H	3:3:1:	3:4:3:	3:	C[3x6]-3:C[6]-3:H-1:	C[3x6]-3:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[3x6]C[3x6]C[6,6])(C[6]C[6a]N[6])(H)	C[3x6](C[3x6]C[4,6,6]C[6])(C[6,6]C[4,6,6]HH)(C[6]C[6]H)	H(C[6]C[3x6]C[6])	C[6](C[3x6]C[3x6]C[6,6])(C[6]C[6a]N[6])(H){1|Pt<4>,2|C<4>,2|H<1>,3|C<3>}	C[3x6](C[3x6]C[4,6,6]C[6])(C[6,6]C[4,6,6]HH)(C[6]C[6]H){1|C<3>,1|N<3>,2|C<4>,3|H<1>}	H(C[6]C[3x6]C[6])	119.5366	0.407	5	119.7879	0.097	15	119.8106	0.201	28	119.8474	0.182	34	119.5118	0.954	105	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[3x6]	H	3:3:1:	3:4:3:	3:	C[3x6]-3:C[6]-3:H-1:	C[3x6]-3:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[3x6]C[3x6]C[6,6])(C[6]C[6a]N[6])(H)	C[3x6](C[3x6]C[4,6,6]C[6])(C[6,6]C[4,6,6]HH)(C[6]C[6]H)	H(C[6]C[3x6]C[6])	C[6](C[3x6]C[3x6]C[6,6])(C[6]C[6a]N[6])(H){1|Ru<6>,2|C<4>,2|H<1>,3|C<3>}	C[3x6](C[3x6]C[4,6,6]C[6])(C[6,6]C[4,6,6]HH)(C[6]C[6]H){1|C<3>,1|N<3>,2|C<4>,3|H<1>}	H(C[6]C[3x6]C[6])	119.7817	0.170	3	119.7879	0.097	15	119.8106	0.201	28	119.8474	0.182	34	119.5118	0.954	105	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[3x6]	H	3:3:1:	3:4:3:	3:	C[3x6]-3:C[6]-3:H-1:	C[3x6]-3:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[3x6]C[3x6]C[6,6])(C[6]N[6]C)(H)	C[3x6](C[3x6]C[4,6,6]C[6])(C[6,6]C[4,6,6]HH)(C[6]C[6]H)	H(C[6]C[3x6]C[6])	C[6](C[3x6]C[3x6]C[6,6])(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,2|C<4>,2|H<1>}	C[3x6](C[3x6]C[4,6,6]C[6])(C[6,6]C[4,6,6]HH)(C[6]C[6]H){1|N<3>,3|C<4>,3|H<1>}	H(C[6]C[3x6]C[6])	119.9868	0.559	4	119.9868	0.312	4	119.8106	0.201	28	119.8474	0.182	34	119.5118	0.954	105	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[3x6]	H	3:3:1:	3:4:3:	3:	C[3x6]-3:C[6]-3:H-1:	N[3x6]-3:C[3x6]-4:C[6]-3:	C[6]-3:	C[6](C[3x6]C[3x6]N[3x6])(C[6]C[6]H)(H)	C[3x6](N[3x6]Nb[3,3,3x6]C[6])(C[3x6]C[6,6]2C)(C[6]C[6]H)	H(C[6]C[3x6]C[6])	C[6](C[3x6]C[3x6]N[3x6])(C[6]C[6]H)(H){1|Nb<7>,1|C<3>,1|H<1>,3|C<4>}	C[3x6](N[3x6]Nb[3,3,3x6]C[6])(C[3x6]C[6,6]2C)(C[6]C[6]H){1|Cl<1>,1|C<3>,1|C<4>,1|N<2>,3|N<3>,6|H<1>}	H(C[6]C[3x6]C[6])	119.9010	0.182	4	119.9010	0.033	4	120.0192	0.072	6	119.8474	0.182	34	119.5118	0.954	105	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[3x6]	H	3:3:1:	3:4:3:	3:	C[3x6]-3:C[6]-3:H-1:	N[3x6]-3:C[3x6]-4:C[6]-3:	C[6]-3:	C[6](C[3x6]C[3x6]N[3x6])(C[6]C[6]H)(H)	C[3x6](N[3x6]Nb[3x6]C[6])(C[3x6]C[6,6]2C)(C[6]C[6]H)	H(C[6]C[3x6]C[6])	C[6](C[3x6]C[3x6]N[3x6])(C[6]C[6]H)(H){1|Nb<5>,1|C<3>,1|H<1>,3|C<4>}	C[3x6](N[3x6]Nb[3x6]C[6])(C[3x6]C[6,6]2C)(C[6]C[6]H){1|C<3>,1|N<2>,1|O<2>,2|N<3>,6|H<1>}	H(C[6]C[3x6]C[6])	120.0410	0.000	1	120.2555	0.092	2	120.0192	0.072	6	119.8474	0.182	34	119.5118	0.954	105	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[3x6]	H	3:3:1:	3:4:3:	3:	C[3x6]-3:C[6]-3:H-1:	N[3x6]-3:C[3x6]-4:C[6]-3:	C[6]-3:	C[6](C[3x6]C[3x6]N[3x6])(C[6]C[6]H)(H)	C[3x6](N[3x6]Nb[3x6]C[6])(C[3x6]C[6,6]2C)(C[6]C[6]H)	H(C[6]C[3x6]C[6])	C[6](C[3x6]C[3x6]N[3x6])(C[6]C[6]H)(H){1|Nb<6>,1|C<3>,1|H<1>,3|C<4>}	C[3x6](N[3x6]Nb[3x6]C[6])(C[3x6]C[6,6]2C)(C[6]C[6]H){1|Cl<1>,1|C<3>,1|N<2>,3|N<3>,6|H<1>}	H(C[6]C[3x6]C[6])	120.4700	0.000	1	120.2555	0.092	2	120.0192	0.072	6	119.8474	0.182	34	119.5118	0.954	105	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[3x6]	H	3:3:1:	4:3:3:	3:	C[3x6]-3:C[6]-3:H-1:	C[3x6]-4:C[3x6]-3:C[6]-3:	C[6]-3:	C[6](C[3x6]C[3x6]2)(C[6]C[6]O)(H)	C[3x6](C[3x6]C[6,6,6a]2C)(C[3x6]C[3x6]C[6])(C[6]C[6]H)	H(C[6]C[3x6]C[6])	C[6](C[3x6]C[3x6]2)(C[6]C[6]O)(H){1|O<1>,2|C<4>,3|C<3>}	C[3x6](C[3x6]C[6,6,6a]2C)(C[3x6]C[3x6]C[6])(C[6]C[6]H){1|C<4>,1|H<1>,1|O<1>,5|C<3>}	H(C[6]C[3x6]C[6])	119.4790	1.867	4	119.4790	3.487	4	119.8135	1.631	8	119.3671	1.358	53	119.5118	0.954	105	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[3x6]	H	3:3:1:	4:3:3:	3:	C[3x6]-3:C[6]-3:H-1:	C[3x6]-4:C[3x6]-3:C[6]-3:	C[6]-3:	C[6](C[3x6]C[3x6]2)(C[6]C[6]O)(H)	C[3x6](C[3x6]C[6,6,6a]C[3x6]H)(C[3x6]C[3x6]C[6])(C[6]C[6]H)	H(C[6]C[3x6]C[6])	C[6](C[3x6]C[3x6]2)(C[6]C[6]O)(H){1|C<4>,1|H<1>,1|O<1>,3|C<3>}	C[3x6](C[3x6]C[6,6,6a]C[3x6]H)(C[3x6]C[3x6]C[6])(C[6]C[6]H){1|O<1>,2|H<1>,5|C<3>}	H(C[6]C[3x6]C[6])	120.1480	0.147	4	120.1480	0.022	4	119.8135	1.631	8	119.3671	1.358	53	119.5118	0.954	105	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[3x6]	H	3:3:1:	4:3:3:	3:	C[3x6]-3:C[6]-3:H-1:	C[3x6]-4:N[3x6]-3:C[6]-3:	C[6]-3:	C[6](C[3x6]C[3x6]N[3x6])(C[6]C[6]H)(H)	C[3x6](C[3x6]Ge[4,6,6]P[6,6]H)(N[3x6]Ge[3x6]C[6])(C[6]C[6]H)	H(C[6]C[3x6]C[6])	C[6](C[3x6]C[3x6]N[3x6])(C[6]C[6]H)(H){2|Ge<3>,1|C<3>,1|P<4>,2|H<1>}	C[3x6](C[3x6]Ge[4,6,6]P[6,6]H)(N[3x6]Ge[3x6]C[6])(C[6]C[6]H){1|H<1>,2|C<3>,2|N<3>,3|C<4>}	H(C[6]C[3x6]C[6])	120.5610	0.000	1	120.5610	0.000	1	120.5610	0.000	1	119.3671	1.358	53	119.5118	0.954	105	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[3x6]	H	3:3:1:	4:3:3:	3:	C[3x6]-3:C[6]-3:H-1:	C[4,6,6]-4:C[3x6]-3:C[6]-3:	C[6]-3:	C[6](C[3x6]C[4,6,6]C[3x6])(C[6]C[6]H)(H)	C[3x6](C[4,6,6]C[4,6]2H)(C[3x6]C[6,6]N[6])(C[6]C[6]H)	H(C[6]C[3x6]C[6])	C[6](C[3x6]C[4,6,6]C[3x6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>,3|C<4>}	C[3x6](C[4,6,6]C[4,6]2H)(C[3x6]C[6,6]N[6])(C[6]C[6]H){1|Mn<5>,1|C<3>,3|C<4>,5|H<1>}	H(C[6]C[3x6]C[6])	120.1620	0.489	3	120.2794	0.575	13	120.2794	0.575	13	119.3671	1.358	53	119.5118	0.954	105	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[3x6]	H	3:3:1:	4:3:3:	3:	C[3x6]-3:C[6]-3:H-1:	C[4,6,6]-4:C[3x6]-3:C[6]-3:	C[6]-3:	C[6](C[3x6]C[4,6,6]C[3x6])(C[6]C[6]H)(H)	C[3x6](C[4,6,6]C[4,6]2H)(C[3x6]C[6,6]N[6])(C[6]C[6]H)	H(C[6]C[3x6]C[6])	C[6](C[3x6]C[4,6,6]C[3x6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>,3|C<4>}	C[3x6](C[4,6,6]C[4,6]2H)(C[3x6]C[6,6]N[6])(C[6]C[6]H){1|Mn<6>,1|C<3>,3|C<4>,5|H<1>}	H(C[6]C[3x6]C[6])	120.5765	0.032	2	120.2794	0.575	13	120.2794	0.575	13	119.3671	1.358	53	119.5118	0.954	105	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[3x6]	H	3:3:1:	4:3:3:	3:	C[3x6]-3:C[6]-3:H-1:	C[4,6,6]-4:C[3x6]-3:C[6]-3:	C[6]-3:	C[6](C[3x6]C[4,6,6]C[3x6])(C[6]C[6]H)(H)	C[3x6](C[4,6,6]C[4,6]2H)(C[3x6]C[6,6]N[6])(C[6]C[6]H)	H(C[6]C[3x6]C[6])	C[6](C[3x6]C[4,6,6]C[3x6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>,3|C<4>}	C[3x6](C[4,6,6]C[4,6]2H)(C[3x6]C[6,6]N[6])(C[6]C[6]H){1|Re<6>,1|C<3>,3|C<4>,5|H<1>}	H(C[6]C[3x6]C[6])	120.2205	1.413	4	120.2794	0.575	13	120.2794	0.575	13	119.3671	1.358	53	119.5118	0.954	105	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[3x6]	H	3:3:1:	4:3:3:	3:	C[3x6]-3:C[6]-3:H-1:	C[4,6,6]-4:C[3x6]-3:C[6]-3:	C[6]-3:	C[6](C[3x6]C[4,6,6]C[3x6])(C[6]C[6]H)(H)	C[3x6](C[4,6,6]C[4,6]2H)(C[3x6]C[6,6]N[6])(C[6]C[6]H)	H(C[6]C[3x6]C[6])	C[6](C[3x6]C[4,6,6]C[3x6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>,3|C<4>}	C[3x6](C[4,6,6]C[4,6]2H)(C[3x6]C[6,6]N[6])(C[6]C[6]H){1|Re<6>,1|C<3>,4|C<4>,4|H<1>}	H(C[6]C[3x6]C[6])	120.6190	0.000	1	120.2794	0.575	13	120.2794	0.575	13	119.3671	1.358	53	119.5118	0.954	105	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[3x6]	H	3:3:1:	4:3:3:	3:	C[3x6]-3:C[6]-3:H-1:	C[4,6,6]-4:C[3x6]-3:C[6]-3:	C[6]-3:	C[6](C[3x6]C[4,6,6]C[3x6])(C[6]C[6]H)(H)	C[3x6](C[4,6,6]C[4,6]2H)(C[3x6]C[6,6]N[6])(C[6]C[6]H)	H(C[6]C[3x6]C[6])	C[6](C[3x6]C[4,6,6]C[3x6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,4|C<4>}	C[3x6](C[4,6,6]C[4,6]2H)(C[3x6]C[6,6]N[6])(C[6]C[6]H){1|Mn<5>,1|C<3>,3|C<4>,5|H<1>}	H(C[6]C[3x6]C[6])	120.1640	0.145	3	120.2794	0.575	13	120.2794	0.575	13	119.3671	1.358	53	119.5118	0.954	105	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[3x6]	H	3:3:1:	4:3:3:	3:	C[3x6]-3:C[6]-3:H-1:	C[5,3x6]-4:C[3x6]-3:C[6]-3:	C[6]-3:	C[6](C[3x6]C[5,3x6]C[3x6])(C[6]C[6]H)(H)	C[3x6](C[5,3x6]C[6,6,6a]C[5,6,6]C[5])(C[3x6]C[3x6]C[6])(C[6]C[6]H)	H(C[6]C[3x6]C[6])	C[6](C[3x6]C[5,3x6]C[3x6])(C[6]C[6]H)(H){1|C<2>,1|H<1>,2|C<3>,2|C<4>}	C[3x6](C[5,3x6]C[6,6,6a]C[5,6,6]C[5])(C[3x6]C[3x6]C[6])(C[6]C[6]H){1|O<2>,4|H<1>,5|C<3>}	H(C[6]C[3x6]C[6])	115.4340	0.000	1	115.4340	0.000	1	115.4340	0.000	1	119.3671	1.358	53	119.5118	0.954	105	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[3x6]	H	3:3:1:	4:3:3:	3:	C[3x6]-3:N[6]-3:H-1:	C[4,6,6]-4:C[3x6]-3:C[6]-3:	C[6]-3:	C[6](C[3x6]C[4,6,6]C[3x6])(N[6]C[6]Fe)(H)	C[3x6](C[4,6,6]C[4,6]2H)(C[3x6]C[6,6]C[6])(C[6]N[6]H)	H(C[6]C[3x6]N[6])	C[6](C[3x6]C[4,6,6]C[3x6])(N[6]C[6]Fe)(H){1|C<3>,1|H<1>,4|C<4>}	C[3x6](C[4,6,6]C[4,6]2H)(C[3x6]C[6,6]C[6])(C[6]N[6]H){1|Fe<6>,1|C<3>,3|C<4>,5|H<1>}	H(C[6]C[3x6]N[6])	118.3175	0.297	4	118.3175	0.088	4	118.9440	0.608	30	119.3671	1.358	53	119.5118	0.954	105	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[3x6]	H	3:3:1:	4:3:3:	3:	C[3x6]-3:N[6]-3:H-1:	C[4,6,6]-4:C[3x6]-3:C[6]-3:	C[6]-3:	C[6](C[3x6]C[4,6,6]C[3x6])(N[6]C[6]H)(H)	C[3x6](C[4,6,6]C[4,6]2H)(C[3x6]C[6,6]C[6])(C[6]N[6]H)	H(C[6]C[3x6]N[6])	C[6](C[3x6]C[4,6,6]C[3x6])(N[6]C[6]H)(H){1|H<1>,2|C<3>,3|C<4>}	C[3x6](C[4,6,6]C[4,6]2H)(C[3x6]C[6,6]C[6])(C[6]N[6]H){1|C<3>,3|C<4>,6|H<1>}	H(C[6]C[3x6]N[6])	119.8552	0.150	6	119.8552	0.022	6	118.9440	0.608	30	119.3671	1.358	53	119.5118	0.954	105	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[3x6]	H	3:3:1:	4:3:3:	3:	C[3x6]-3:N[6]-3:H-1:	C[4,6,6]-4:C[3x6]-3:C[6]-3:	C[6]-3:	C[6](C[3x6]C[4,6,6]C[3x6])(N[6]C[6]Os)(H)	C[3x6](C[4,6,6]C[4,6]2H)(C[3x6]C[6,6]C[6])(C[6]N[6]H)	H(C[6]C[3x6]N[6])	C[6](C[3x6]C[4,6,6]C[3x6])(N[6]C[6]Os)(H){1|H<1>,2|C<3>,3|C<4>}	C[3x6](C[4,6,6]C[4,6]2H)(C[3x6]C[6,6]C[6])(C[6]N[6]H){1|Os<6>,1|C<3>,3|C<4>,5|H<1>}	H(C[6]C[3x6]N[6])	118.7238	1.005	6	118.7238	1.010	6	118.9440	0.608	30	119.3671	1.358	53	119.5118	0.954	105	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[3x6]	H	3:3:1:	4:3:3:	3:	C[3x6]-3:N[6]-3:H-1:	C[4,6,6]-4:C[3x6]-3:C[6]-3:	C[6]-3:	C[6](C[3x6]C[4,6,6]C[3x6])(N[6]C[6]Pt)(H)	C[3x6](C[4,6,6]C[4,6]2H)(C[3x6]C[6,6]C[6])(C[6]N[6]H)	H(C[6]C[3x6]N[6])	C[6](C[3x6]C[4,6,6]C[3x6])(N[6]C[6]Pt)(H){1|H<1>,2|C<3>,3|C<4>}	C[3x6](C[4,6,6]C[4,6]2H)(C[3x6]C[6,6]C[6])(C[6]N[6]H){1|Pt<4>,1|C<3>,3|C<4>,5|H<1>}	H(C[6]C[3x6]N[6])	118.9313	0.707	10	118.9313	0.500	10	118.9440	0.608	30	119.3671	1.358	53	119.5118	0.954	105	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[3x6]	H	3:3:1:	4:3:3:	3:	C[3x6]-3:N[6]-3:H-1:	C[4,6,6]-4:C[3x6]-3:C[6]-3:	C[6]-3:	C[6](C[3x6]C[4,6,6]C[3x6])(N[6]C[6]Ru)(H)	C[3x6](C[4,6,6]C[4,6]2H)(C[3x6]C[6,6]C[6])(C[6]N[6]H)	H(C[6]C[3x6]N[6])	C[6](C[3x6]C[4,6,6]C[3x6])(N[6]C[6]Ru)(H){1|H<1>,2|C<3>,3|C<4>}	C[3x6](C[4,6,6]C[4,6]2H)(C[3x6]C[6,6]C[6])(C[6]N[6]H){1|Ru<6>,1|C<3>,3|C<4>,5|H<1>}	H(C[6]C[3x6]N[6])	118.5660	0.306	4	118.5660	0.094	4	118.9440	0.608	30	119.3671	1.358	53	119.5118	0.954	105	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[3x6]	H	3:3:1:	4:4:3:	3:	C[3x6]-3:C[6,6]-3:H-1:	C[3x6]-4:C[4,6,6]-4:C[6]-3:	C[6]-3:	C[6](C[3x6]C[4,6,6]C[3x6])(C[6,6]C[6,6]C[6])(H)	C[3x6](C[3x6]C[6,6]O[6]H)(C[4,6,6]C[4,6]2H)(C[6]C[6,6]H)	H(C[6]C[3x6]C[6,6])	C[6](C[3x6]C[4,6,6]C[3x6])(C[6,6]C[6,6]C[6])(H){1|O<1>,1|O<2>,2|H<1>,5|C<4>}	C[3x6](C[3x6]C[6,6]O[6]H)(C[4,6,6]C[4,6]2H)(C[6]C[6,6]H){2|C<3>,3|C<4>,4|H<1>}	H(C[6]C[3x6]C[6,6])	120.2680	0.000	1	120.2680	0.000	1	120.2680	0.000	1	118.8496	1.058	5	119.5118	0.954	105	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[3x6]	H	3:3:1:	4:4:3:	3:	C[3x6]-3:C[6]-3:H-1:	C[3x6]-4:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[3x6]C[3x6]C[6,6])(C[6]C[6]O)(H)	C[3x6](C[3x6]C[6,6a]C[6]2)(C[6,6]C[6]N[6]H)(C[6]C[6]H)	H(C[6]C[3x6]C[6])	C[6](C[3x6]C[3x6]C[6,6])(C[6]C[6]O)(H){1|H<1>,1|N<3>,1|O<2>,2|C<3>,2|C<4>}	C[3x6](C[3x6]C[6,6a]C[6]2)(C[6,6]C[6]N[6]H)(C[6]C[6]H){1|O<1>,2|C<4>,3|C<3>,5|H<1>}	H(C[6]C[3x6]C[6])	118.5960	0.000	1	118.5960	0.000	1	118.5960	0.000	1	118.8496	1.058	5	119.5118	0.954	105	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[3x6]	H	3:3:1:	4:4:3:	3:	C[3x6]-3:C[6]-3:H-1:	C[4x6]-4:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[3x6]C[4x6]C[6,6])(C[6]C[5,6]H)(H)	C[3x6](C[4x6]C[5,6]C[6,6]2)(C[6,6]C[5,3x6]CO)(C[6]C[6]H)	H(C[6]C[3x6]C[6])	C[6](C[3x6]C[4x6]C[6,6])(C[6]C[5,6]H)(H){1|O<2>,2|C<3>,4|C<4>}	C[3x6](C[4x6]C[5,6]C[6,6]2)(C[6,6]C[5,3x6]CO)(C[6]C[6]H){1|O<1>,2|C<3>,3|C<4>,4|H<1>}	H(C[6]C[3x6]C[6])	119.4210	0.000	1	119.4210	0.000	1	119.4210	0.000	1	118.8496	1.058	5	119.5118	0.954	105	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[3x6]	H	3:3:1:	4:4:3:	3:	C[3x6]-3:C[6]-3:H-1:	C[5,3x6]-4:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[3x6]C[5,3x6]C[6,6])(C[6]C[6]H)(H)	C[3x6](C[5,3x6]C[5,6,6a]C[5,6]C[6])(C[6,6]C[6]N[6]H)(C[6]C[6]H)	H(C[6]C[3x6]C[6])	C[6](C[3x6]C[5,3x6]C[6,6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>,1|O<2>,3|C<4>}	C[3x6](C[5,3x6]C[5,6,6a]C[5,6]C[6])(C[6,6]C[6]N[6]H)(C[6]C[6]H){1|O<2>,2|C<4>,3|C<3>,6|H<1>}	H(C[6]C[3x6]C[6])	117.5810	0.000	1	117.5810	0.000	1	117.5810	0.000	1	118.8496	1.058	5	119.5118	0.954	105	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[3x6]	H	3:3:1:	4:4:3:	3:	C[3x6]-3:C[6]-3:H-1:	C[5x6]-4:Si[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[3x6]Si[6,6]C[5x6])(C[6]C[6]H)(H)	C[3x6](C[5x6]C[5,6,6]C[3x6]C[6,6])(Si[6,6]C[3x6]CC)(C[6]C[6]H)	H(C[6]C[3x6]C[6])	C[6](C[3x6]Si[6,6]C[5x6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,5|C<4>}	C[3x6](C[5x6]C[5,6,6]C[3x6]C[6,6])(Si[6,6]C[3x6]CC)(C[6]C[6]H){3|C<3>,3|C<4>,4|H<1>}	H(C[6]C[3x6]C[6])	118.3820	0.000	1	118.3820	0.000	1	118.3820	0.000	1	118.8496	1.058	5	119.5118	0.954	105	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[3x6]	H	3:4:1:	4:4:3:	3:	C[3x6]-3:C[6]-4:H-1:	C[3x6]-4:C[3x6]-4:C[6]-3:	C[6]-3:	C[6](C[3x6]C[3x6]2)(C[6]C[6]HH)(H)	C[3x6](C[3x6]C[6,6]N[6,6]H)(C[3x6]C[3x6]C[6]H)(C[6]C[6]H)	H(C[6]C[3x6]C[6])	C[6](C[3x6]C[3x6]2)(C[6]C[6]HH)(H){1|N<3>,3|C<4>,4|H<1>}	C[3x6](C[3x6]C[6,6]N[6,6]H)(C[3x6]C[3x6]C[6]H)(C[6]C[6]H){3|C<3>,3|C<4>,5|H<1>}	H(C[6]C[3x6]C[6])	118.5240	0.000	1	118.5240	0.000	1	118.5240	0.000	1	118.7886	0.474	5	119.5118	0.954	105	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[3x6]	H	3:4:1:	4:4:3:	3:	C[3x6]-3:C[6]-4:H-1:	C[3x6]-4:C[4x6]-4:C[6]-3:	C[6]-3:	C[6](C[3x6]C[3x6]C[4x6])(C[6]C[6]CH)(H)	C[3x6](C[3x6]C[6,6]O[6,6]H)(C[4x6]C[4x6]C[6,6]H)(C[6]C[6]H)	H(C[6]C[3x6]C[6])	C[6](C[3x6]C[3x6]C[4x6])(C[6]C[6]CH)(H){1|O<2>,3|C<4>,4|H<1>}	C[3x6](C[3x6]C[6,6]O[6,6]H)(C[4x6]C[4x6]C[6,6]H)(C[6]C[6]H){1|Br<1>,2|C<3>,3|C<4>,4|H<1>}	H(C[6]C[3x6]C[6])	119.8850	0.000	1	119.8850	0.000	1	119.8850	0.000	1	118.7886	0.474	5	119.5118	0.954	105	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[3x6]	H	3:4:1:	4:4:3:	3:	C[3x6]-3:C[6]-4:H-1:	C[4x6]-4:C[3x6]-4:C[6]-3:	C[6]-3:	C[6](C[3x6]C[3x6]C[4x6])(C[6]O[6]HH)(H)	C[3x6](C[4x6]C[4x6]C[6]2)(C[3x6]C[6,6]2H)(C[6]C[6]H)	H(C[6]C[3x6]C[6])	C[6](C[3x6]C[3x6]C[4x6])(C[6]O[6]HH)(H){1|C<3>,1|H<1>,4|C<4>}	C[3x6](C[4x6]C[4x6]C[6]2)(C[3x6]C[6,6]2H)(C[6]C[6]H){1|O<1>,3|O<2>,4|C<4>,6|H<1>}	H(C[6]C[3x6]C[6])	118.6390	0.000	1	118.6390	0.000	1	118.6390	0.000	1	118.7886	0.474	5	119.5118	0.954	105	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[3x6]	H	3:4:1:	4:4:3:	3:	C[3x6]-3:C[6]-4:H-1:	C[4x6]-4:C[4x6]-4:C[6]-3:	C[6]-3:	C[6](C[3x6]C[4x6]2)(C[6]C[6]HH)(H)	C[3x6](C[4x6]C[6,6]C[6x6]H)(C[4x6]C[6,6]2C[6])(C[6]C[6]H)	H(C[6]C[3x6]C[6])	C[6](C[3x6]C[4x6]2)(C[6]C[6]HH)(H){1|C<3>,3|H<1>,4|C<4>}	C[3x6](C[4x6]C[6,6]C[6x6]H)(C[4x6]C[6,6]2C[6])(C[6]C[6]H){1|O<1>,2|C<3>,4|C<4>,7|H<1>}	H(C[6]C[3x6]C[6])	118.0170	0.000	1	118.0170	0.000	1	118.0170	0.000	1	118.7886	0.474	5	119.5118	0.954	105	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[3x6]	H	3:4:1:	4:4:3:	3:	C[3x6]-3:C[6]-4:H-1:	C[4x6]-4:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[3x6]C[4x6]C[6,6])(C[6]O[6]HH)(H)	C[3x6](C[4x6]C[6,6]2C[6])(C[6,6]C[6]2H)(C[6]C[6]H)	H(C[6]C[3x6]C[6])	C[6](C[3x6]C[4x6]C[6,6])(C[6]O[6]HH)(H){1|C<3>,1|H<1>,4|C<4>}	C[3x6](C[4x6]C[6,6]2C[6])(C[6,6]C[6]2H)(C[6]C[6]H){1|C<3>,1|O<1>,3|C<4>,3|O<2>,6|H<1>}	H(C[6]C[3x6]C[6])	118.8780	0.000	1	118.8780	0.000	1	118.8780	0.000	1	118.7886	0.474	5	119.5118	0.954	105	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[3x6]	H	4:3:1:	4:3:3:	3:	C[5,6]-4:C[3x6]-3:H-1:	C[3x6]-4:C[3x6]-3:C[6]-3:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Hf)(C[3x6]C[3x6]2)(H)	C[3x6](C[3x6]C[6,6,6a]2H)(C[3x6]C[3x6]C[6])(C[6]C[5,6]H)	H(C[6]C[3x6]C[5,6])	C[6](C[5,6]C[5,6]C[5]Hf)(C[3x6]C[3x6]2)(H){1|H<1>,3|C<3>,4|C<4>}	C[3x6](C[3x6]C[6,6,6a]2H)(C[3x6]C[3x6]C[6])(C[6]C[5,6]H){1|Hf<12>,2|C<4>,2|H<1>,4|C<3>}	H(C[6]C[3x6]C[5,6])	121.1220	0.000	1	121.0095	0.025	2	121.0095	0.025	2	121.0095	0.025	2	119.5118	0.954	105	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[3x6]	H	4:3:1:	4:3:3:	3:	C[5,6]-4:C[3x6]-3:H-1:	C[3x6]-4:C[3x6]-3:C[6]-3:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Hf)(C[3x6]C[3x6]2)(H)	C[3x6](C[3x6]C[6,6,6a]2H)(C[3x6]C[3x6]C[6])(C[6]C[5,6]H)	H(C[6]C[3x6]C[5,6])	C[6](C[5,6]C[5,6]C[5]Hf)(C[3x6]C[3x6]2)(H){2|H<1>,3|C<3>,3|C<4>}	C[3x6](C[3x6]C[6,6,6a]2H)(C[3x6]C[3x6]C[6])(C[6]C[5,6]H){1|Hf<12>,2|C<4>,2|H<1>,4|C<3>}	H(C[6]C[3x6]C[5,6])	120.8970	0.000	1	121.0095	0.025	2	121.0095	0.025	2	121.0095	0.025	2	119.5118	0.954	105	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[3x6]	H	4:3:1:	4:4:3:	3:	C[5,6]-4:C[3x6]-3:H-1:	C[6,6]-4:C[4x6]-4:C[6]-3:	C[6]-3:	C[6](C[5,6]C[5,6,6]O[5]H)(C[3x6]C[4x6]C[6,6])(H)	C[3x6](C[6,6]C[3x6]HH)(C[4x6]C[6,6]3)(C[6]C[5,6]H)	H(C[6]C[3x6]C[5,6])	C[6](C[5,6]C[5,6,6]O[5]H)(C[3x6]C[4x6]C[6,6])(H){1|C<3>,3|H<1>,5|C<4>}	C[3x6](C[6,6]C[3x6]HH)(C[4x6]C[6,6]3)(C[6]C[5,6]H){1|O<2>,5|H<1>,6|C<4>}	H(C[6]C[3x6]C[5,6])	118.9420	0.171	2	118.9470	0.015	3	118.9470	0.015	3	118.9470	0.015	3	119.5118	0.954	105	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[3x6]	H	4:3:1:	4:4:3:	3:	C[5,6]-4:C[3x6]-3:H-1:	C[6,6]-4:C[4x6]-4:C[6]-3:	C[6]-3:	C[6](C[5,6]C[5,6,6]O[5]H)(C[3x6]C[4x6]C[6,6])(H)	C[3x6](C[6,6]C[3x6]HH)(C[4x6]C[6,6]3)(C[6]C[5,6]H)	H(C[6]C[3x6]C[5,6])	C[6](C[5,6]C[5,6,6]O[5]H)(C[3x6]C[4x6]C[6,6])(H){3|H<1>,6|C<4>}	C[3x6](C[6,6]C[3x6]HH)(C[4x6]C[6,6]3)(C[6]C[5,6]H){1|O<2>,5|H<1>,6|C<4>}	H(C[6]C[3x6]C[5,6])	118.9570	0.000	1	118.9470	0.015	3	118.9470	0.015	3	118.9470	0.015	3	119.5118	0.954	105	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:2:1:	3:3:3:	3:	C[6,6]-3:C[6]-2:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6])(H)	C[6,6](C[6,6]C[6,6]N[6])(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6])(H){1|H<1>,1|N<3>,3|C<3>}	C[6,6](C[6,6]C[6,6]N[6])(C[6]C[6]H)2{1|Cu<5>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6,6]C[6])	120.2960	2.586	3	120.2960	6.685	3	120.4537	4.556	4	118.5580	2.468	15	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:2:1:	3:3:3:	3:	C[6,6]-3:C[6]-2:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6])(H)	C[6,6](C[6,6]C[6]2)(C[6]C[6]H)(C[6]C[6]I)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6])(H){1|C<3>,1|H<1>,1|I<2>,2|C<2>}	C[6,6](C[6,6]C[6]2)(C[6]C[6]H)(C[6]C[6]I){1|H<1>,2|C<3>}	H(C[6]C[6,6]C[6])	120.9270	0.000	1	120.9270	0.000	1	120.4537	4.556	4	118.5580	2.468	15	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:2:1:	3:3:3:	3:	C[6,6]-3:C[6]-2:H-1:	C[6]-3:C[6,6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6])(H)	C[6,6](C[6]C[6,6a]C[6a])(C[6,6]C[6]O[6])(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6])(H){1|N<3>,1|O<2>,3|C<3>}	C[6,6](C[6]C[6,6a]C[6a])(C[6,6]C[6]O[6])(C[6]C[6]H){1|H<1>,5|C<3>}	H(C[6]C[6,6]C[6])	118.1750	0.000	1	118.1750	0.000	1	118.1750	0.000	1	118.5580	2.468	15	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:2:1:	3:3:3:	3:	C[6,6]-3:N[6]-2:H-1:	N[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(N[6]C[6,6a])(H)	C[6,6](N[6,6]C[6,6a]B[6])(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6,6]N[6])	C[6](C[6,6]N[6,6]C[6])(N[6]C[6,6a])(H){1|B<4>,1|H<1>,3|C<3>}	C[6,6](N[6,6]C[6,6a]B[6])(C[6]C[6]H)(C[6]N[6]H){1|O<2>,2|F<1>,3|C<3>}	H(C[6]C[6,6]N[6])	117.7590	0.069	2	117.7590	0.005	2	117.7207	0.108	7	118.5580	2.468	15	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:2:1:	3:3:3:	3:	C[6,6]-3:N[6]-2:H-1:	N[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(N[6]C[6,6a])(H)	C[6,6](N[6,6]C[6,6a]C[6])(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6,6]N[6])	C[6](C[6,6]N[6,6]C[6])(N[6]C[6,6a])(H){1|H<1>,4|C<3>}	C[6,6](N[6,6]C[6,6a]C[6])(C[6]C[6]H)(C[6]N[6]H){2|H<1>,3|C<3>}	H(C[6]C[6,6]N[6])	117.6480	0.000	1	117.6480	0.000	1	117.7207	0.108	7	118.5580	2.468	15	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:2:1:	3:3:3:	3:	C[6,6]-3:N[6]-2:H-1:	N[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(N[6]C[6])(H)	C[6,6](N[6,6]B[6]C[6])(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6,6]N[6])	C[6](C[6,6]N[6,6]C[6])(N[6]C[6])(H){1|B<4>,1|C<4>,1|H<1>,2|C<3>}	C[6,6](N[6,6]B[6]C[6])(C[6]C[6]H)(C[6]N[6]H){1|H<1>,1|O<2>,2|C<3>,2|F<1>}	H(C[6]C[6,6]N[6])	118.0765	0.168	2	117.7198	0.211	4	117.7207	0.108	7	118.5580	2.468	15	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:2:1:	3:3:3:	3:	C[6,6]-3:N[6]-2:H-1:	N[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(N[6]C[6])(H)	C[6,6](N[6,6]B[6]C[6])(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6,6]N[6])	C[6](C[6,6]N[6,6]C[6])(N[6]C[6])(H){1|B<4>,1|C<4>,1|H<1>,2|C<3>}	C[6,6](N[6,6]B[6]C[6])(C[6]C[6]H)(C[6]N[6]H){1|H<1>,1|O<2>,4|C<3>}	H(C[6]C[6,6]N[6])	117.3630	0.311	2	117.7198	0.211	4	117.7207	0.108	7	118.5580	2.468	15	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:2:1:	3:3:3:	3:	C[6,6]-3:O[6]-2:H-1:	C[3x6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[3x6]C[6])(O[6]C[6])(H)	C[6,6](C[3x6]C[3x6]C[6,6])(C[6]O[6]H)(C[6]O[6]O)	H(C[6]C[6,6]O[6])	C[6](C[6,6]C[3x6]C[6])(O[6]C[6])(H){1|C<3>,1|C<4>,1|H<1>,1|O<1>,2|O<2>}	C[6,6](C[3x6]C[3x6]C[6,6])(C[6]O[6]H)(C[6]O[6]O){5|C<4>}	H(C[6]C[6,6]O[6])	118.4830	0.000	1	118.4830	0.000	1	118.4830	0.000	1	118.5580	2.468	15	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:2:1:	3:3:3:	3:	C[6,6]-3:O[6]-2:H-1:	C[5,6]-3:C[6,6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[5,6]C[6,6])(O[6]C[6])(H)	C[6,6](C[5,6]C[5,6]C[5])(C[6,6]C[6]2)(C[6]O[6]H)	H(C[6]C[6,6]O[6])	C[6](C[6,6]C[5,6]C[6,6])(O[6]C[6])(H){1|C<4>,4|C<3>}	C[6,6](C[5,6]C[5,6]C[5])(C[6,6]C[6]2)(C[6]O[6]H){1|C<4>,1|O<2>,2|H<1>,4|C<3>}	H(C[6]C[6,6]O[6])	117.9260	0.081	2	117.9260	0.006	2	117.9260	0.006	2	118.5580	2.468	15	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:2:1:	3:4:3:	3:	C[6,6]-3:C[6]-2:H-1:	C[6,6]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6])(H)	C[6,6](C[6,6]C[6,6a]C[6])(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6])(H){1|C<4>,2|C<3>,3|H<1>}	C[6,6](C[6,6]C[6,6a]C[6])(C[6]C[6]HH)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6,6]C[6])	119.5580	0.000	1	119.5580	0.000	1	119.5580	0.000	1	119.5153	5.645	7	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:2:1:	3:4:3:	3:	C[6,6]-3:O[6]-2:H-1:	C[6,6]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(O[6]C[6])(H)	C[6,6](C[6,6]C[6]2)(C[6]C[6]CH)(C[6]O[6]H)	H(C[6]C[6,6]O[6])	C[6](C[6,6]C[6,6]C[6])(O[6]C[6])(H){1|H<1>,2|C<3>,3|C<4>}	C[6,6](C[6,6]C[6]2)(C[6]C[6]CH)(C[6]O[6]H){1|C<4>,1|O<2>,2|C<3>,2|H<1>}	H(C[6]C[6,6]O[6])	117.8160	0.000	1	117.8160	0.000	1	119.5082	6.773	6	119.5153	5.645	7	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:2:1:	3:4:3:	3:	C[6,6]-3:O[6]-2:H-1:	C[6,6]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(O[6]C[6])(H)	C[6,6](C[6,6]C[6]2)(C[6]C[6]HO)(C[6]O[6]H)	H(C[6]C[6,6]O[6])	C[6](C[6,6]C[6,6]C[6])(O[6]C[6])(H){1|H<1>,1|O<2>,2|C<3>,2|C<4>}	C[6,6](C[6,6]C[6]2)(C[6]C[6]HO)(C[6]O[6]H){1|C<4>,1|H<1>,1|O<2>,3|C<3>}	H(C[6]C[6,6]O[6])	124.7400	0.000	1	119.8466	7.608	5	119.5082	6.773	6	119.5153	5.645	7	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:2:1:	3:4:3:	3:	C[6,6]-3:O[6]-2:H-1:	C[6,6]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(O[6]C[6])(H)	C[6,6](C[6,6]C[6]2)(C[6]C[6]HO)(C[6]O[6]H)	H(C[6]C[6,6]O[6])	C[6](C[6,6]C[6,6]C[6])(O[6]C[6])(H){1|H<1>,1|O<2>,2|C<3>,2|C<4>}	C[6,6](C[6,6]C[6]2)(C[6]C[6]HO)(C[6]O[6]H){1|H<1>,1|O<2>,2|C<3>,2|C<4>}	H(C[6]C[6,6]O[6])	118.6232	0.408	4	119.8466	7.608	5	119.5082	6.773	6	119.5153	5.645	7	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:2:1:	4:3:3:	3:	C[6,6]-3:C[6]-2:H-1:	C[6,6]-4:C[6,6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]2)(C[6]C[6])(H)	C[6,6](C[6,6]C[6,6a]2O[6])(C[6,6]C[6]N[6])(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2)(C[6]C[6])(H){1|H<1>,1|N<3>,1|O<2>,3|C<3>}	C[6,6](C[6,6]C[6,6a]2O[6])(C[6,6]C[6]N[6])(C[6]C[6]H){1|C<4>,1|H<1>,6|C<3>}	H(C[6]C[6,6]C[6])	118.2060	0.000	1	118.2060	0.000	1	118.2060	0.000	1	117.2792	0.454	5	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:2:1:	4:3:3:	3:	C[6,6]-3:O[6]-2:H-1:	C[3x6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[3x6]C[6])(O[6]C[6,6])(H)	C[6,6](C[3x6]O[6,6]C[6]2)(C[6]O[6]H)(C[6]O[6]O)	H(C[6]C[6,6]O[6])	C[6](C[6,6]C[3x6]C[6])(O[6]C[6,6])(H){1|H<1>,1|O<1>,2|O<2>,3|C<4>}	C[6,6](C[3x6]O[6,6]C[6]2)(C[6]O[6]H)(C[6]O[6]O){3|C<4>,4|H<1>}	H(C[6]C[6,6]O[6])	117.6300	0.000	1	117.6300	0.000	1	117.6300	0.000	1	117.2792	0.454	5	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:2:1:	4:3:3:	3:	C[6,6]-3:O[6]-2:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(O[6]C[5,6])(H)	C[6,6](C[6,6]C[5,6]C[6]H)(C[6]C[6]H)(C[6]O[6]H)	H(C[6]C[6,6]O[6])	C[6](C[6,6]C[6,6]C[6])(O[6]C[5,6])(H){1|C<3>,1|O<2>,2|C<4>,3|H<1>}	C[6,6](C[6,6]C[5,6]C[6]H)(C[6]C[6]H)(C[6]O[6]H){1|C<3>,2|H<1>,4|C<4>}	H(C[6]C[6,6]O[6])	116.6340	0.034	2	116.6340	0.001	2	116.8533	0.145	3	117.2792	0.454	5	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:2:1:	4:3:3:	3:	C[6,6]-3:O[6]-2:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(O[6]C[6])(H)	C[6,6](C[6,6]C[6]2H)(C[6]C[6]H)(C[6]O[6]H)	H(C[6]C[6,6]O[6])	C[6](C[6,6]C[6,6]C[6])(O[6]C[6])(H){1|C<3>,1|O<2>,2|C<4>,3|H<1>}	C[6,6](C[6,6]C[6]2H)(C[6]C[6]H)(C[6]O[6]H){1|C<3>,2|H<1>,4|C<4>}	H(C[6]C[6,6]O[6])	117.2920	0.000	1	117.2920	0.000	1	116.8533	0.145	3	117.2792	0.454	5	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:2:1:	4:4:3:	3:	C[6,6]-3:O[6]-2:H-1:	C[3x6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[3x6]C[6])(O[6]C[6])(H)	C[6,6](C[3x6]C[3x6]C[6,6]H)(C[6]C[5,6]HH)(C[6]O[6]H)	H(C[6]C[6,6]O[6])	C[6](C[6,6]C[3x6]C[6])(O[6]C[6])(H){3|C<4>,5|H<1>}	C[6,6](C[3x6]C[3x6]C[6,6]H)(C[6]C[5,6]HH)(C[6]O[6]H){1|H<1>,2|C<3>,5|C<4>}	H(C[6]C[6,6]O[6])	117.3040	0.182	4	117.3040	0.033	4	117.3040	0.033	4	117.3040	0.033	4	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:2:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[4x6]-3:N[6]-2:C[6]-3:	C[6]-3:	C[6](C[6,6]C[4x6]N[6])(C[6]C[6]C)(H)	C[6,6](C[4x6]C[3x6]C[4x6])(N[6]C[6,6a])(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[4x6]N[6])(C[6]C[6]C)(H){1|C<4>,1|O<1>,2|C<3>}	C[6,6](C[4x6]C[3x6]C[4x6])(N[6]C[6,6a])(C[6]C[6]H){2|C<4>,5|C<3>}	H(C[6]C[6,6]C[6])	118.5770	0.000	1	118.5770	0.000	1	118.8325	0.131	2	119.4937	1.107	36	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:2:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[4x6]-3:N[6]-2:C[6]-3:	C[6]-3:	C[6](C[6,6]C[4x6]N[6])(C[6]C[6]H)(H)	C[6,6](C[4x6]C[3x6]C[4x6])(N[6]C[6,6a])(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[4x6]N[6])(C[6]C[6]H)(H){1|C<4>,1|O<1>,2|C<3>}	C[6,6](C[4x6]C[3x6]C[4x6])(N[6]C[6,6a])(C[6]C[6]H){1|C<4>,1|H<1>,5|C<3>}	H(C[6]C[6,6]C[6])	119.0880	0.000	1	119.0880	0.000	1	118.8325	0.131	2	119.4937	1.107	36	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:2:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6,6a]-3:O[6]-2:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6,6a]O[6])(C[6]C[6a]O[6])(H)	C[6,6](C[6,6,6a]C[6,6a]2)(O[6]Ga[5,5,6])(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6,6a]O[6])(C[6]C[6a]O[6])(H){1|Ga<6>,4|C<3>}	C[6,6](C[6,6,6a]C[6,6a]2)(O[6]Ga[5,5,6])(C[6]C[6]H){2|O<2>,3|C<3>,4|N<3>}	H(C[6]C[6,6]C[6])	118.4640	0.000	1	118.4640	0.000	1	118.4790	0.063	3	119.4937	1.107	36	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:2:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6,6a]-3:O[6]-2:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6,6a]O[6])(C[6]C[6a]O[6])(H)	C[6,6](C[6,6,6a]C[6,6a]2)(O[6]Ga[5,6])(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6,6a]O[6])(C[6]C[6a]O[6])(H){1|Ga<6>,4|C<3>}	C[6,6](C[6,6,6a]C[6,6a]2)(O[6]Ga[5,6])(C[6]C[6]H){1|O<3>,2|N<3>,3|C<3>,3|O<2>}	H(C[6]C[6,6]C[6])	118.4865	0.356	2	118.4865	0.127	2	118.4790	0.063	3	119.4937	1.107	36	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:2:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:N[6]-2:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]N[6])(C[6]C[5,6]H)(H)	C[6,6](C[6,6]C[6]O[6])(N[6]C[6,6a])(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]N[6])(C[6]C[5,6]H)(H){1|N<3>,1|O<2>,3|C<3>}	C[6,6](C[6,6]C[6]O[6])(N[6]C[6,6a])(C[6]C[6]H){1|C<4>,2|C<3>,2|H<1>}	H(C[6]C[6,6]C[6])	118.8720	0.000	1	118.8720	0.000	1	119.0067	0.082	4	119.4937	1.107	36	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:2:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:N[6]-2:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]N[6])(C[6]C[5,6]H)(H)	C[6,6](C[6,6]C[6]S[6])(N[6]C[6,6a])(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]N[6])(C[6]C[5,6]H)(H){1|N<3>,1|S<2>,3|C<3>}	C[6,6](C[6,6]C[6]S[6])(N[6]C[6,6a])(C[6]C[6]H){1|C<4>,2|C<3>,2|H<1>}	H(C[6]C[6,6]C[6])	118.8530	0.000	1	118.8530	0.000	1	119.0067	0.082	4	119.4937	1.107	36	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:2:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:N[6]-2:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]N[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]C[6]2)(N[6]C[6,6a])(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]N[6])(C[6]C[6]H)(H){1|C<4>,1|O<1>,2|C<3>}	C[6,6](C[6,6]C[6]2)(N[6]C[6,6a])(C[6]C[6]H){2|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6,6]C[6])	119.1510	0.403	2	119.1510	0.162	2	119.0067	0.082	4	119.4937	1.107	36	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:2:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:O[6]-2:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]O[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]C[6]N[6])(O[6]C[5,6])(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]O[6])(C[6]C[6]H)(H){1|C<3>,1|N<3>,2|C<4>}	C[6,6](C[6,6]C[6]N[6])(O[6]C[5,6])(C[6]C[6]H){1|N<3>,2|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6,6]C[6])	121.0427	0.316	4	121.0427	0.100	4	120.0710	4.205	7	119.4937	1.107	36	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:2:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:O[6]-2:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]O[6])(C[6]C[6]N)(H)	C[6,6](C[6,6]C[5,6]C[6])(O[6]C[6,6a])(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]O[6])(C[6]C[6]N)(H){1|C<2>,1|C<3>,1|C<4>,1|H<1>}	C[6,6](C[6,6]C[5,6]C[6])(O[6]C[6,6a])(C[6]C[6]H){2|N<3>,4|C<3>}	H(C[6]C[6,6]C[6])	119.7700	0.000	1	119.7700	0.000	1	120.0710	4.205	7	119.4937	1.107	36	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:2:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:O[6]-2:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]O[6])(C[6]C[6]N)(H)	C[6,6](C[6,6]C[6]2)(O[6]C[6,6a])(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]O[6])(C[6]C[6]N)(H){3|C<3>}	C[6,6](C[6,6]C[6]2)(O[6]C[6,6a])(C[6]C[6]H){1|C<2>,1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6,6]C[6])	115.5730	0.000	1	115.5730	0.000	1	120.0710	4.205	7	119.4937	1.107	36	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:2:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:O[6]-2:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]O[6])(C[6]O[6]C)(H)	C[6,6](C[6,6]C[6]2)(O[6]C[6,6a])(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]O[6])(C[6]O[6]C)(H){1|C<4>,2|C<3>}	C[6,6](C[6,6]C[6]2)(O[6]C[6,6a])(C[6]C[6]H){1|C<4>,2|C<3>,2|H<1>,2|O<2>}	H(C[6]C[6,6]C[6])	120.9830	0.000	1	120.9830	0.000	1	120.0710	4.205	7	119.4937	1.107	36	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:2:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:N[6]-2:C[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]N[6])(C[6]C[6,6a]H)(H)	C[6,6](N[6,6]C[6,6a]B[6])(N[6]C[5,6])(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]N[6])(C[6]C[6,6a]H)(H){1|B<4>,3|C<3>}	C[6,6](N[6,6]C[6,6a]B[6])(N[6]C[5,6])(C[6]C[6]H){1|H<1>,1|N<3>,2|F<1>,3|C<3>}	H(C[6]C[6,6]C[6])	119.6273	0.081	3	119.6273	0.006	3	119.5304	0.181	19	119.4937	1.107	36	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:2:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:N[6]-2:C[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]N[6])(C[6]C[6,6a]H)(H)	C[6,6](N[6,6]C[6,6a]B[6])(N[6]C[6,6])(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]N[6])(C[6]C[6,6a]H)(H){1|B<4>,3|C<3>}	C[6,6](N[6,6]C[6,6a]B[6])(N[6]C[6,6])(C[6]C[6]H){1|H<1>,1|N<3>,2|F<1>,3|C<3>}	H(C[6]C[6,6]C[6])	119.4900	0.095	2	119.4900	0.009	2	119.5304	0.181	19	119.4937	1.107	36	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:2:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:N[6]-2:C[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]C)(H)	C[6,6](N[6,6]C[6]S[6])(N[6]C[6,6a])(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]C)(H){1|H<1>,1|S<4>,2|C<3>}	C[6,6](N[6,6]C[6]S[6])(N[6]C[6,6a])(C[6]C[6]H){1|C<4>,1|H<1>,2|O<1>,3|C<3>}	H(C[6]C[6,6]C[6])	118.2460	0.000	1	118.2460	0.000	1	119.5304	0.181	19	119.4937	1.107	36	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:2:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:N[6]-2:C[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(H)	C[6,6](N[6,6]B[6]C[6])(N[6]C[5,6])(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(H){1|B<4>,1|H<1>,2|C<3>}	C[6,6](N[6,6]B[6]C[6])(N[6]C[5,6])(C[6]C[6]H){1|N<3>,2|C<3>,2|F<1>,2|H<1>}	H(C[6]C[6,6]C[6])	120.0000	0.204	4	119.9148	0.068	5	119.5304	0.181	19	119.4937	1.107	36	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:2:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:N[6]-2:C[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(H)	C[6,6](N[6,6]B[6]C[6])(N[6]C[5,6])(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(H){1|B<4>,1|H<1>,2|C<3>}	C[6,6](N[6,6]B[6]C[6])(N[6]C[5,6])(C[6]C[6]H){1|N<3>,2|H<1>,4|C<3>}	H(C[6]C[6,6]C[6])	119.5740	0.000	1	119.9148	0.068	5	119.5304	0.181	19	119.4937	1.107	36	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:2:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:N[6]-2:C[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(H)	C[6,6](N[6,6]B[6]C[6])(N[6]C[5a,6])(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(H){1|B<4>,1|H<1>,2|C<3>}	C[6,6](N[6,6]B[6]C[6])(N[6]C[5a,6])(C[6]C[6]H){1|Cl<1>,1|H<1>,1|N<3>,2|C<3>,2|F<1>}	H(C[6]C[6,6]C[6])	119.5130	0.000	1	119.6145	0.021	2	119.5304	0.181	19	119.4937	1.107	36	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:2:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:N[6]-2:C[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(H)	C[6,6](N[6,6]B[6]C[6])(N[6]C[5a,6])(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(H){1|B<4>,1|H<1>,2|C<3>}	C[6,6](N[6,6]B[6]C[6])(N[6]C[5a,6])(C[6]C[6]H){1|N<3>,2|C<3>,2|F<1>,2|H<1>}	H(C[6]C[6,6]C[6])	119.7160	0.000	1	119.6145	0.021	2	119.5304	0.181	19	119.4937	1.107	36	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:2:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:N[6]-2:C[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(H)	C[6,6](N[6,6]B[6]C[6])(N[6]C[6,6])(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(H){1|B<4>,1|H<1>,2|C<3>}	C[6,6](N[6,6]B[6]C[6])(N[6]C[6,6])(C[6]C[6]H){1|N<3>,2|C<3>,2|F<1>,2|H<1>}	H(C[6]C[6,6]C[6])	119.5900	0.000	1	119.5900	0.000	1	119.5304	0.181	19	119.4937	1.107	36	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:2:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:N[6]-2:C[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(H)	C[6,6](N[6,6]C[6]2)(N[6]C[6,6])(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,2|C<3>}	C[6,6](N[6,6]C[6]2)(N[6]C[6,6])(C[6]C[6]H){1|N<3>,2|C<3>,4|H<1>}	H(C[6]C[6,6]C[6])	119.5475	0.185	2	119.5475	0.034	2	119.5304	0.181	19	119.4937	1.107	36	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:2:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:N[6]-2:C[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(H)	C[6,6](N[6,6]Ge[6]C[6])(N[6]C[6,6a])(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(H){1|Ge<3>,1|H<1>,2|C<3>}	C[6,6](N[6,6]Ge[6]C[6])(N[6]C[6,6a])(C[6]C[6]H){1|Cl<1>,1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6,6]C[6])	119.2210	0.211	2	119.1607	0.033	3	119.5304	0.181	19	119.4937	1.107	36	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:2:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:N[6]-2:C[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(H)	C[6,6](N[6,6]Ge[6]C[6])(N[6]C[6,6a])(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(H){1|Ge<3>,1|H<1>,2|C<3>}	C[6,6](N[6,6]Ge[6]C[6])(N[6]C[6,6a])(C[6]C[6]H){2|C<3>,2|H<1>,2|N<3>}	H(C[6]C[6,6]C[6])	119.0400	0.000	1	119.1607	0.033	3	119.5304	0.181	19	119.4937	1.107	36	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:2:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:O[6]-2:C[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]O[6])(C[6]C[6]H)(H)	C[6,6](N[6,6]B[5,6]C[6])(O[6]C[6,6a])(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]O[6])(C[6]C[6]H)(H){1|B<4>,1|H<1>,2|C<3>}	C[6,6](N[6,6]B[5,6]C[6])(O[6]C[6,6a])(C[6]C[6]H){2|H<1>,2|O<2>,3|C<3>}	H(C[6]C[6,6]C[6])	121.0680	0.000	1	121.0680	0.000	1	121.0680	0.000	1	119.4937	1.107	36	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:2:	3:	C[5a,6]-3:C[6,6]-3:H-1:	C[6]-3:C[6,6]-3:S[6]-2:	C[6]-3:	C[6](C[5a,6]C[5a,6]S[5a])(C[6,6]C[6,6]S[6])(H)	C[6,6](C[6]C[5a,6]H)(C[6,6]N[6]2)(S[6]C[6,6a])	H(C[6]C[5a,6]C[6,6])	C[6](C[5a,6]C[5a,6]S[5a])(C[6,6]C[6,6]S[6])(H){1|C<3>,1|N<3>,1|S<2>,2|N<2>}	C[6,6](C[6]C[5a,6]H)(C[6,6]N[6]2)(S[6]C[6,6a]){1|C<4>,1|N<2>,1|S<2>,2|C<3>}	H(C[6]C[5a,6]C[6,6])	120.6350	0.000	1	120.6060	0.002	2	120.5490	0.005	4	119.7311	5.212	46	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:2:	3:	C[5a,6]-3:C[6,6]-3:H-1:	C[6]-3:C[6,6]-3:S[6]-2:	C[6]-3:	C[6](C[5a,6]C[5a,6]S[5a])(C[6,6]C[6,6]S[6])(H)	C[6,6](C[6]C[5a,6]H)(C[6,6]N[6]2)(S[6]C[6,6a])	H(C[6]C[5a,6]C[6,6])	C[6](C[5a,6]C[5a,6]S[5a])(C[6,6]C[6,6]S[6])(H){1|C<3>,1|N<3>,1|S<2>,2|N<2>}	C[6,6](C[6]C[5a,6]H)(C[6,6]N[6]2)(S[6]C[6,6a]){1|C<4>,1|S<2>,3|C<3>}	H(C[6]C[5a,6]C[6,6])	120.5770	0.000	1	120.6060	0.002	2	120.5490	0.005	4	119.7311	5.212	46	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:2:	3:	C[5a,6]-3:C[6,6]-3:H-1:	C[6]-3:C[6,6]-3:S[6]-2:	C[6]-3:	C[6](C[5a,6]C[5a,6]S[5a])(C[6,6]C[6,6]S[6])(H)	C[6,6](C[6]C[5a,6]H)(C[6,6]N[6]2)(S[6]N[6])	H(C[6]C[5a,6]C[6,6])	C[6](C[5a,6]C[5a,6]S[5a])(C[6,6]C[6,6]S[6])(H){1|N<3>,1|S<2>,3|N<2>}	C[6,6](C[6]C[5a,6]H)(C[6,6]N[6]2)(S[6]N[6]){1|C<4>,1|S<2>,2|C<3>}	H(C[6]C[5a,6]C[6,6])	120.4920	0.000	2	120.4920	0.000	2	120.5490	0.005	4	119.7311	5.212	46	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:2:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-2:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]C[6,6]N[6])(C[6]C[6]H)(C[6]C[6])	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|H<1>,1|N<3>}	C[6,6](C[6,6]C[6,6]N[6])(C[6]C[6]H)(C[6]C[6]){1|Cd<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6,6]C[6])	123.8630	0.000	1	118.6930	38.177	6	118.8296	31.945	7	119.7311	5.212	46	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:2:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-2:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]C[6,6]N[6])(C[6]C[6]H)(C[6]C[6])	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|N<3>}	C[6,6](C[6,6]C[6,6]N[6])(C[6]C[6]H)(C[6]C[6]){1|Cd<6>,1|C<2>,1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6,6]C[6])	114.4420	11.010	2	118.6930	38.177	6	118.8296	31.945	7	119.7311	5.212	46	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:2:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-2:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]C[6,6]N[6])(C[6]C[6]H)(C[6]C[6])	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<4>,1|N<3>,2|C<3>}	C[6,6](C[6,6]C[6,6]N[6])(C[6]C[6]H)(C[6]C[6]){1|Cu<5>,1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6,6]C[6])	119.1700	0.000	1	118.6930	38.177	6	118.8296	31.945	7	119.7311	5.212	46	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:2:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-2:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]C[6,6]N[6])(C[6]C[6]H)(C[6]C[6])	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>}	C[6,6](C[6,6]C[6,6]N[6])(C[6]C[6]H)(C[6]C[6]){1|Cu<5>,1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6,6]C[6])	120.1205	1.580	2	118.6930	38.177	6	118.8296	31.945	7	119.7311	5.212	46	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:2:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-2:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]C[6]2)(C[6]C[6]H)(C[6]C[6])	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){3|C<3>}	C[6,6](C[6,6]C[6]2)(C[6]C[6]H)(C[6]C[6]){1|I<2>,2|C<2>,3|H<1>}	H(C[6]C[6,6]C[6])	119.6490	0.000	1	119.6490	0.000	1	118.8296	31.945	7	119.7311	5.212	46	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:2:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:N[6]-2:	C[6]-3:	C[6](C[6,6]C[6,6]N[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]C[5,6]C[6])(C[6]C[6]H)(N[6]O[6])	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]N[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<1>,1|O<2>}	C[6,6](C[6,6]C[5,6]C[6])(C[6]C[6]H)(N[6]O[6]){2|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6,6]C[6])	119.7790	0.000	1	119.7790	0.000	1	120.0375	0.134	2	119.7311	5.212	46	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:2:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:N[6]-2:	C[6]-3:	C[6](C[6,6]C[6,6]N[6])(C[6]N[6]C)(H)	C[6,6](C[6,6]C[6]2)(C[6]C[6]H)(N[6]C[6])	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]N[6])(C[6]N[6]C)(H){1|C<3>,2|C<4>}	C[6,6](C[6,6]C[6]2)(C[6]C[6]H)(N[6]C[6]){1|C<3>,1|H<1>,1|N<2>,1|O<1>,1|O<2>,3|C<4>}	H(C[6]C[6,6]C[6])	120.2960	0.000	1	120.2960	0.000	1	120.0375	0.134	2	119.7311	5.212	46	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:2:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:O[6]-2:	C[6]-3:	C[6](C[6,6]C[6,6]O[6])(C[6]C[6,6]H)(H)	C[6,6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(O[6]C[6])	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]O[6])(C[6]C[6,6]H)(H){1|Cr<9>,1|C<3>,3|C<4>}	C[6,6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(O[6]C[6]){1|Cr<9>,1|C<3>,2|H<1>,4|C<4>}	H(C[6]C[6,6]C[6])	120.9150	0.000	1	120.6507	0.146	3	120.3285	0.281	6	119.7311	5.212	46	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:2:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:O[6]-2:	C[6]-3:	C[6](C[6,6]C[6,6]O[6])(C[6]C[6,6]H)(H)	C[6,6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(O[6]C[6])	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]O[6])(C[6]C[6,6]H)(H){1|Cr<9>,1|C<3>,3|C<4>}	C[6,6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(O[6]C[6]){1|Cr<9>,2|C<3>,2|H<1>,3|C<4>}	H(C[6]C[6,6]C[6])	120.2120	0.000	1	120.6507	0.146	3	120.3285	0.281	6	119.7311	5.212	46	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:2:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:O[6]-2:	C[6]-3:	C[6](C[6,6]C[6,6]O[6])(C[6]C[6,6]H)(H)	C[6,6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(O[6]C[6])	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]O[6])(C[6]C[6,6]H)(H){1|Cr<9>,1|C<3>,3|C<4>}	C[6,6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(O[6]C[6]){1|Cr<9>,2|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6,6]C[6])	120.8250	0.000	1	120.6507	0.146	3	120.3285	0.281	6	119.7311	5.212	46	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:2:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:O[6]-2:	C[6]-3:	C[6](C[6,6]C[6,6]O[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]H)(O[6]B[6])	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]O[6])(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>,1|N<3>}	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]H)(O[6]B[6]){1|Ir<6>,1|C<3>,1|H<1>,2|F<1>,2|O<2>}	H(C[6]C[6,6]C[6])	120.5680	0.000	1	120.5680	0.000	1	120.3285	0.281	6	119.7311	5.212	46	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:2:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:O[6]-2:	C[6]-3:	C[6](C[6,6]C[6,6]O[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]H)(O[6]C[6])	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]O[6])(C[6]C[6]H)(H){1|C<4>,1|N<3>,2|C<3>}	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]H)(O[6]C[6]){1|C<3>,1|C<4>,1|N<3>,1|O<1>,3|H<1>}	H(C[6]C[6,6]C[6])	119.6410	0.000	1	119.6410	0.000	1	120.3285	0.281	6	119.7311	5.212	46	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:2:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:O[6]-2:	C[6]-3:	C[6](C[6,6]C[6,6]O[6])(C[6]C[6]O)(H)	C[6,6](C[6,6]C[6]2)(C[6]C[6]H)(O[6]C[6])	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]O[6])(C[6]C[6]O)(H){1|C<4>,1|H<1>,2|C<3>}	C[6,6](C[6,6]C[6]2)(C[6]C[6]H)(O[6]C[6]){1|C<4>,1|H<1>,1|O<2>,2|C<3>,2|O<1>}	H(C[6]C[6,6]C[6])	119.8100	0.000	1	119.8100	0.000	1	120.3285	0.281	6	119.7311	5.212	46	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:2:	3:	C[6,6]-3:C[6]-3:H-1:	N[3x6]-3:C[6]-3:N[6]-2:	C[6]-3:	C[6](C[6,6]N[3x6]N[6])(C[6]C[6]H)(H)	C[6,6](N[3x6]B[6,6]C[6,6])(C[6]C[6]H)(N[6]C[6])	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[3x6]N[6])(C[6]C[6]H)(H){1|B<4>,1|H<1>,2|C<3>}	C[6,6](N[3x6]B[6,6]C[6,6])(C[6]C[6]H)(N[6]C[6]){1|C<4>,1|H<1>,1|N<2>,2|C<3>,2|N<3>}	H(C[6]C[6,6]C[6])	120.0805	0.163	2	120.3143	0.039	8	120.3143	0.039	8	119.7311	5.212	46	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:2:	3:	C[6,6]-3:C[6]-3:H-1:	N[3x6]-3:C[6]-3:N[6]-2:	C[6]-3:	C[6](C[6,6]N[3x6]N[6])(C[6]C[6]H)(H)	C[6,6](N[3x6]B[6,6]C[6,6])(C[6]C[6]H)(N[6]C[6])	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[3x6]N[6])(C[6]C[6]H)(H){1|B<4>,1|H<1>,2|C<3>}	C[6,6](N[3x6]B[6,6]C[6,6])(C[6]C[6]H)(N[6]C[6]){1|F<1>,1|H<1>,1|N<2>,2|C<3>,2|O<2>}	H(C[6]C[6,6]C[6])	120.4420	0.120	4	120.3143	0.039	8	120.3143	0.039	8	119.7311	5.212	46	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:2:	3:	C[6,6]-3:C[6]-3:H-1:	N[3x6]-3:C[6]-3:N[6]-2:	C[6]-3:	C[6](C[6,6]N[3x6]N[6])(C[6]C[6]H)(H)	C[6,6](N[3x6]B[6,6]C[6,6])(C[6]C[6]H)(N[6]C[6])	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[3x6]N[6])(C[6]C[6]H)(H){1|B<4>,1|H<1>,2|C<3>}	C[6,6](N[3x6]B[6,6]C[6,6])(C[6]C[6]H)(N[6]C[6]){1|H<1>,1|N<2>,2|N<3>,3|C<3>}	H(C[6]C[6,6]C[6])	120.2925	0.156	2	120.3143	0.039	8	120.3143	0.039	8	119.7311	5.212	46	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:2:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:N[6]-2:	C[6]-3:	C[6](C[6,6]N[6,6]N[6])(C[6]C[6,6a]H)(H)	C[6,6](N[6,6]C[6,6a]B[6])(C[6]C[6]H)(N[6]C[6])	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]N[6])(C[6]C[6,6a]H)(H){1|B<4>,3|C<3>}	C[6,6](N[6,6]C[6,6a]B[6])(C[6]C[6]H)(N[6]C[6]){1|C<3>,1|C<4>,1|H<1>,1|N<2>,1|O<2>,2|F<1>}	H(C[6]C[6,6]C[6])	119.5520	0.485	3	119.6870	0.097	11	119.4352	1.518	18	119.7311	5.212	46	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:2:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:N[6]-2:	C[6]-3:	C[6](C[6,6]N[6,6]N[6])(C[6]C[6,6a]H)(H)	C[6,6](N[6,6]C[6,6a]B[6])(C[6]C[6]H)(N[6]C[6])	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]N[6])(C[6]C[6,6a]H)(H){1|B<4>,3|C<3>}	C[6,6](N[6,6]C[6,6a]B[6])(C[6]C[6]H)(N[6]C[6]){1|C<3>,1|C<4>,1|H<1>,1|N<3>,1|O<2>,2|F<1>}	H(C[6]C[6,6]C[6])	120.0680	0.000	2	119.6870	0.097	11	119.4352	1.518	18	119.7311	5.212	46	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:2:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:N[6]-2:	C[6]-3:	C[6](C[6,6]N[6,6]N[6])(C[6]C[6,6a]H)(H)	C[6,6](N[6,6]C[6,6a]B[6])(C[6]C[6]H)(N[6]C[6])	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]N[6])(C[6]C[6,6a]H)(H){1|B<4>,3|C<3>}	C[6,6](N[6,6]C[6,6a]B[6])(C[6]C[6]H)(N[6]C[6]){1|H<1>,1|N<2>,1|O<2>,2|C<3>,2|F<1>}	H(C[6]C[6,6]C[6])	119.6077	0.194	4	119.6870	0.097	11	119.4352	1.518	18	119.7311	5.212	46	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:2:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:N[6]-2:	C[6]-3:	C[6](C[6,6]N[6,6]N[6])(C[6]C[6,6a]H)(H)	C[6,6](N[6,6]C[6,6a]B[6])(C[6]C[6]H)(N[6]C[6])	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]N[6])(C[6]C[6,6a]H)(H){1|B<4>,3|C<3>}	C[6,6](N[6,6]C[6,6a]B[6])(C[6]C[6]H)(N[6]C[6]){1|H<1>,1|N<3>,2|F<1>,3|C<3>}	H(C[6]C[6,6]C[6])	119.5910	0.000	1	119.6870	0.097	11	119.4352	1.518	18	119.7311	5.212	46	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:2:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:N[6]-2:	C[6]-3:	C[6](C[6,6]N[6,6]N[6])(C[6]C[6,6a]H)(H)	C[6,6](N[6,6]C[6,6a]B[6])(C[6]C[6]H)(N[6]C[6])	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]N[6])(C[6]C[6,6a]H)(H){1|B<4>,3|C<3>}	C[6,6](N[6,6]C[6,6a]B[6])(C[6]C[6]H)(N[6]C[6]){1|H<1>,1|O<2>,2|F<1>,3|C<3>}	H(C[6]C[6,6]C[6])	119.7430	0.000	1	119.6870	0.097	11	119.4352	1.518	18	119.7311	5.212	46	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:2:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:N[6]-2:	C[6]-3:	C[6](C[6,6]N[6,6]N[6])(C[6]C[6,6a]H)(H)	C[6,6](N[6,6]C[6,6a]C[6])(C[6]C[6]H)(N[6]C[6])	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]N[6])(C[6]C[6,6a]H)(H){2|C<3>,2|C<4>}	C[6,6](N[6,6]C[6,6a]C[6])(C[6]C[6]H)(N[6]C[6]){1|C<3>,1|C<4>,1|N<2>,5|H<1>}	H(C[6]C[6,6]C[6])	118.6310	0.000	1	118.6310	0.000	1	119.4352	1.518	18	119.7311	5.212	46	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:2:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:N[6]-2:	C[6]-3:	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(H)	C[6,6](N[6,6]B[6]C[6])(C[6]C[6]H)(N[6]C[6])	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(H){1|B<4>,1|H<1>,2|C<3>}	C[6,6](N[6,6]B[6]C[6])(C[6]C[6]H)(N[6]C[6]){1|O<2>,2|C<3>,2|F<1>,2|H<1>}	H(C[6]C[6,6]C[6])	119.9786	0.158	5	119.9786	0.025	5	119.4352	1.518	18	119.7311	5.212	46	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:2:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:N[6]-2:	C[6]-3:	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(H)	C[6,6](N[6,6]C[6]2)(C[6]C[6]H)(N[6]C[6])	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,2|C<4>}	C[6,6](N[6,6]C[6]2)(C[6]C[6]H)(N[6]C[6]){1|O<2>,2|C<3>,2|H<1>,3|C<4>}	H(C[6]C[6,6]C[6])	114.7530	0.000	1	114.7530	0.000	1	119.4352	1.518	18	119.7311	5.212	46	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:2:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:S[6]-2:	C[6]-3:	C[6](C[6,6]N[6,6]S[6])(C[6]C[6]H)(H)	C[6,6](N[6,6]C[5a,6]C[6])(C[6]C[6]H)(S[6]C[6])	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]S[6])(C[6]C[6]H)(H){1|H<1>,3|C<3>}	C[6,6](N[6,6]C[5a,6]C[6])(C[6]C[6]H)(S[6]C[6]){2|H<1>,4|C<3>}	H(C[6]C[6,6]C[6])	119.2350	0.000	1	119.2350	0.000	1	119.2350	0.000	1	119.7311	5.212	46	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[3x6]-3:C[6,6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[3x6]C[4,6,6]C[3x6])(C[6,6]C[6,6]C[6])(H)	C[6,6](C[6,6]C[6]O[6])(C[6]C[3x6]H)(C[6]C[6]O)	H(C[6]C[3x6]C[6,6])	C[6](C[3x6]C[4,6,6]C[3x6])(C[6,6]C[6,6]C[6])(H){1|O<1>,1|O<2>,2|H<1>,5|C<4>}	C[6,6](C[6,6]C[6]O[6])(C[6]C[3x6]H)(C[6]C[6]O){3|C<4>,4|H<1>}	H(C[6]C[3x6]C[6,6])	120.2490	0.000	1	120.2490	0.000	1	120.2490	0.000	1	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[5,6]-3:C[6,6]-3:H-1:	N[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[5,6]C[5,6a]N[5,6])(C[6,6]N[6,6]C[6])(H)	C[6,6](N[6,6]B[6]C[6])(C[6]C[5,6]H)(C[6]C[6]H)	H(C[6]C[5,6]C[6,6])	C[6](C[5,6]C[5,6a]N[5,6])(C[6,6]N[6,6]C[6])(H){1|B<4>,1|H<1>,5|C<3>}	C[6,6](N[6,6]B[6]C[6])(C[6]C[5,6]H)(C[6]C[6]H){1|N<3>,2|C<3>,2|F<1>,2|H<1>}	H(C[6]C[5,6]C[6,6])	118.9930	0.085	2	118.9930	0.007	2	119.0607	0.011	4	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[5,6]-3:C[6,6]-3:H-1:	N[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[5,6]C[5,6a]N[5,6])(C[6,6]N[6,6]C[6])(H)	C[6,6](N[6,6]C[6,6a]B[6])(C[6]C[5,6]H)(C[6]C[6]H)	H(C[6]C[5,6]C[6,6])	C[6](C[5,6]C[5,6a]N[5,6])(C[6,6]N[6,6]C[6])(H){1|B<4>,1|H<1>,5|C<3>}	C[6,6](N[6,6]C[6,6a]B[6])(C[6]C[5,6]H)(C[6]C[6]H){1|H<1>,1|N<3>,2|F<1>,3|C<3>}	H(C[6]C[5,6]C[6,6])	119.0640	0.000	1	119.0640	0.000	1	119.0607	0.011	4	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[5,6]-3:C[6,6]-3:H-1:	N[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[5,6]N[5,6]C[5])(C[6,6]N[6,6]C[6])(H)	C[6,6](N[6,6]B[6]C[6])(C[6]C[5,6]H)(C[6]C[6]H)	H(C[6]C[5,6]C[6,6])	C[6](C[5,6]N[5,6]C[5])(C[6,6]N[6,6]C[6])(H){1|B<4>,1|H<1>,5|C<3>}	C[6,6](N[6,6]B[6]C[6])(C[6]C[5,6]H)(C[6]C[6]H){1|N<3>,2|C<3>,2|F<1>,2|H<1>}	H(C[6]C[5,6]C[6,6])	119.1930	0.000	1	119.1930	0.000	1	119.0607	0.011	4	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[5a,6]-3:C[6,6]-3:H-1:	C[6]-3:C[6,6]-3:C[6]-3:	C[6]-3:	C[6](C[5a,6]N[5a,6]C[5a])(C[6,6]C[6,6]C[6])(H)	C[6,6](C[6]C[5a,6]H)(C[6,6]C[6]2)(C[6]C[6]O)	H(C[6]C[5a,6]C[6,6])	C[6](C[5a,6]N[5a,6]C[5a])(C[6,6]C[6,6]C[6])(H){1|H<1>,1|O<1>,5|C<3>}	C[6,6](C[6]C[5a,6]H)(C[6,6]C[6]2)(C[6]C[6]O){1|N<3>,1|O<1>,1|O<2>,3|C<3>}	H(C[6]C[5a,6]C[6,6])	119.8980	0.000	1	119.8980	0.000	1	119.8980	0.000	1	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6,6]-3:H-1:	C[6,6a]-3:N[6,6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6a]N[6,6])(C[6,6]N[6,6]C[6])(H)	C[6,6](C[6,6a]C[6,6a]C[6a])(N[6,6]C[6,6a]B[6])(C[6]C[6,6]H)	H(C[6]C[6,6]2)	C[6](C[6,6]C[6,6a]N[6,6])(C[6,6]N[6,6]C[6])(H){1|B<4>,1|H<1>,5|C<3>}	C[6,6](C[6,6a]C[6,6a]C[6a])(N[6,6]C[6,6a]B[6])(C[6]C[6,6]H){1|H<1>,1|N<3>,2|F<1>,5|C<3>}	H(C[6]C[6,6]2)	117.7550	0.000	1	117.7550	0.000	1	119.1522	0.804	5	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6,6]-3:H-1:	C[6,6a]-3:N[6,6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6a]N[6,6])2(H)	C[6,6](C[6,6a]C[6,6a]C[6a])(N[6,6]B[3x6]C[6])(C[6]C[6,6]H)	H(C[6]C[6,6]2)	C[6](C[6,6]C[6,6a]N[6,6])2(H){2|B<4>,5|C<3>}	C[6,6](C[6,6a]C[6,6a]C[6a])(N[6,6]B[3x6]C[6])(C[6]C[6,6]H){1|N<3>,2|H<1>,3|C<3>,3|C<4>}	H(C[6]C[6,6]2)	119.2563	0.166	3	119.2563	0.028	3	119.1522	0.804	5	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6,6]-3:H-1:	C[6,6a]-3:N[6,6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6a]N[6,6])2(H)	C[6,6](C[6,6a]C[6,6a]C[6a])(N[6,6]B[6]C[6])(C[6]C[6,6]H)	H(C[6]C[6,6]2)	C[6](C[6,6]C[6,6a]N[6,6])2(H){2|B<4>,5|C<3>}	C[6,6](C[6,6a]C[6,6a]C[6a])(N[6,6]B[6]C[6])(C[6]C[6,6]H){1|C<4>,1|N<3>,2|H<1>,5|C<3>}	H(C[6]C[6,6]2)	120.2370	0.000	1	120.2370	0.000	1	119.1522	0.804	5	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6,6]-3:H-1:	N[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6a]N[6,6])(C[6,6]N[6,6]C[6])(H)	C[6,6](N[6,6]B[6]C[6])(C[6]C[6,6]H)(C[6]C[6]H)	H(C[6]C[6,6]2)	C[6](C[6,6]C[6,6a]N[6,6])(C[6,6]N[6,6]C[6])(H){1|B<4>,1|H<1>,5|C<3>}	C[6,6](N[6,6]B[6]C[6])(C[6]C[6,6]H)(C[6]C[6]H){1|N<3>,2|C<3>,2|F<1>,2|H<1>}	H(C[6]C[6,6]2)	117.7570	0.000	1	117.7570	0.000	1	118.2490	2.114	4	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6,6]-3:H-1:	N[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])2(H)	C[6,6](N[6,6]B[6]C[6])(C[6]C[6,6]H)(C[6]C[6]H)	H(C[6]C[6,6]2)	C[6](C[6,6]N[6,6]C[6])2(H){2|B<4>,2|H<1>,3|C<3>}	C[6,6](N[6,6]B[6]C[6])(C[6]C[6,6]H)(C[6]C[6]H){1|H<1>,1|N<3>,1|O<2>,2|C<3>,2|F<1>}	H(C[6]C[6,6]2)	119.5220	0.000	1	119.5220	0.000	1	118.2490	2.114	4	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6,6]-3:H-1:	N[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])2(H)	C[6,6](N[6,6]C[6,6a]B[6])(C[6]C[6,6]H)(C[6]C[6]H)	H(C[6]C[6,6]2)	C[6](C[6,6]N[6,6]C[6])2(H){1|B<4>,2|H<1>,4|C<3>}	C[6,6](N[6,6]C[6,6a]B[6])(C[6]C[6,6]H)(C[6]C[6]H){1|H<1>,1|N<3>,2|F<1>,3|C<3>}	H(C[6]C[6,6]2)	117.8585	2.043	2	117.8585	4.173	2	118.2490	2.114	4	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6,6a]-3:H-1:	C[6,6a]-3:C[6]-3:N[6,6]-3:	C[6]-3:	C[6](C[6,6]C[6,6a]N[6,6])(C[6,6a]C[6,6a]C[6a])(H)	C[6,6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6a]H)(N[6,6]C[6]2)	H(C[6]C[6,6a]C[6,6])	C[6](C[6,6]C[6,6a]N[6,6])(C[6,6a]C[6,6a]C[6a])(H){1|C<4>,1|H<1>,5|C<3>}	C[6,6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6a]H)(N[6,6]C[6]2){1|C<4>,4|C<3>,4|H<1>}	H(C[6]C[6,6a]C[6,6])	118.8837	0.146	9	119.1009	0.491	10	119.1009	0.491	10	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6,6a]-3:H-1:	C[6,6a]-3:C[6]-3:N[6,6]-3:	C[6]-3:	C[6](C[6,6]C[6,6a]N[6,6])(C[6,6a]C[6,6a]C[6a])(H)	C[6,6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6a]H)(N[6,6]C[6]2)	H(C[6]C[6,6a]C[6,6])	C[6](C[6,6]C[6,6a]N[6,6])(C[6,6a]C[6,6a]C[6a])(H){1|H<1>,2|C<4>,4|C<3>}	C[6,6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6a]H)(N[6,6]C[6]2){1|C<4>,4|C<3>,5|H<1>}	H(C[6]C[6,6a]C[6,6])	121.0560	0.000	1	119.1009	0.491	10	119.1009	0.491	10	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[5a,6]-3:N[6,6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[5a,6]N[6,6])(C[6]C[6]H)(H)	C[6,6](C[5a,6]C[5a,6]N[5a])(N[6,6]B[6]C[6])(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5a,6]N[6,6])(C[6]C[6]H)(H){1|B<4>,1|H<1>,1|N<2>,2|C<3>}	C[6,6](C[5a,6]C[5a,6]N[5a])(N[6,6]B[6]C[6])(C[6]C[6]H){1|N<3>,1|S<2>,2|C<3>,2|F<1>,2|H<1>}	H(C[6]C[6,6]C[6])	119.9980	0.000	1	119.9980	0.000	1	119.9585	0.003	2	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[5a,6]-3:N[6,6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[5a,6]N[6,6])(C[6]C[6]H)(H)	C[6,6](C[5a,6]C[5a,6]N[5a])(N[6,6]C[6]2)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5a,6]N[6,6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6,6](C[5a,6]C[5a,6]N[5a])(N[6,6]C[6]2)(C[6]C[6]H){1|C<4>,4|C<3>,4|H<1>}	H(C[6]C[6,6]C[6])	119.9190	0.000	1	119.9190	0.000	1	119.9585	0.003	2	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6,6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6,6a]C[6])(C[6]N[6]H)(H)	C[6,6](C[6,6,6a]C[6,6a]2)(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6,6a]C[6])(C[6]N[6]H)(H){1|Ru<9>,1|H<1>,3|C<3>}	C[6,6](C[6,6,6a]C[6,6a]2)(C[6]C[6]H)2{2|C<3>,2|H<1>,2|N<3>}	H(C[6]C[6,6]C[6])	119.9440	0.000	1	119.9440	0.000	1	119.9440	0.000	1	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[3,6]H)(H)	C[6,6](C[6,6]C[6]O[6])(C[6]C[6]H)(C[6]C[6]O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[3,6]H)(H){1|O<1>,1|O<2>,4|C<4>}	C[6,6](C[6,6]C[6]O[6])(C[6]C[6]H)(C[6]C[6]O){2|C<4>,5|H<1>}	H(C[6]C[6,6]C[6])	119.7120	0.000	1	119.7120	0.000	1	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[5,6]C[6a])(H)	C[6,6](C[6,6]N[5,6]N[6])(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[5,6]C[6a])(H){1|H<1>,3|C<3>,3|N<3>}	C[6,6](C[6,6]N[5,6]N[6])(C[6]C[6]H)2{1|Ir<8>,1|H<1>,4|C<3>}	H(C[6]C[6,6]C[6])	118.7960	0.000	1	118.6375	0.186	4	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[5,6]C[6a])(H)	C[6,6](C[6,6]N[5,6]N[6])(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[5,6]C[6a])(H){1|H<1>,3|C<3>,3|N<3>}	C[6,6](C[6,6]N[5,6]N[6])(C[6]C[6]H)2{1|Pd<4>,1|H<1>,4|C<3>}	H(C[6]C[6,6]C[6])	118.5847	0.512	3	118.6375	0.186	4	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[5,6]N)(H)	C[6,6](C[6,6]C[5,6]C[6])(C[6]C[6]H)(C[6]C[6]O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[5,6]N)(H){1|C<4>,1|H<1>,1|N<3>,1|O<1>,2|C<3>}	C[6,6](C[6,6]C[5,6]C[6])(C[6]C[6]H)(C[6]C[6]O){1|H<1>,1|N<3>,1|O<1>,2|C<3>,2|C<4>}	H(C[6]C[6,6]C[6])	120.3430	0.000	2	120.3430	0.000	2	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[5,6]O)(H)	C[6,6](C[6,6]C[5,6]C[6])(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[5,6]O)(H){1|C<4>,1|H<1>,1|O<2>,3|C<3>}	C[6,6](C[6,6]C[5,6]C[6])(C[6]C[6]H)2{1|C<4>,1|H<1>,1|O<1>,1|O<2>,2|C<3>}	H(C[6]C[6,6]C[6])	118.8500	0.000	1	118.8500	0.000	1	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[5a,6]C[6a])(H)	C[6,6](C[6,6]N[5a,6]N[6])(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[5a,6]C[6a])(H){1|H<1>,3|C<3>,3|N<3>}	C[6,6](C[6,6]N[5a,6]N[6])(C[6]C[6]H)2{1|Rh<6>,1|H<1>,4|C<3>}	H(C[6]C[6,6]C[6])	118.5970	0.000	1	118.4160	0.066	2	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[5a,6]C[6a])(H)	C[6,6](C[6,6]N[5a,6]N[6])(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[5a,6]C[6a])(H){1|H<1>,3|C<3>,3|N<3>}	C[6,6](C[6,6]N[5a,6]N[6])(C[6]C[6]H)2{1|Ru<8>,1|H<1>,4|C<3>}	H(C[6]C[6,6]C[6])	118.2350	0.000	1	118.4160	0.066	2	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]H)(H)	C[6,6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(C[6]C[6]O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]H)(H){1|H<1>,1|O<1>,2|C<3>,2|C<4>}	C[6,6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(C[6]C[6]O){1|C<3>,1|H<1>,1|O<1>,4|C<4>}	H(C[6]C[6,6]C[6])	121.4860	0.000	1	121.4860	0.000	1	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]O)(H)	C[6,6](C[6,6]C[6,6]C[6])(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]O)(H){2|C<3>,2|C<4>,2|H<1>}	C[6,6](C[6,6]C[6,6]C[6])(C[6]C[6]H)2{1|C<3>,1|O<1>,1|O<2>,4|C<4>}	H(C[6]C[6,6]C[6])	118.4830	0.000	1	118.4830	0.000	1	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]C)(H)	C[6,6](C[6,6]C[6,6]C[6])(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]C)(H){1|C<4>,1|H<1>,1|O<1>,2|C<3>}	C[6,6](C[6,6]C[6,6]C[6])(C[6]C[6]H)2{1|C<3>,1|O<1>,1|O<2>,4|C<4>}	H(C[6]C[6,6]C[6])	118.3880	0.000	1	118.3880	0.000	1	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]C)(H)	C[6,6](C[6,6]C[6]2)(C[6]C[6]H)(C[6]N[6]O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]C)(H){1|C<4>,1|H<1>,1|N<3>,1|O<1>,2|C<3>}	C[6,6](C[6,6]C[6]2)(C[6]C[6]H)(C[6]N[6]O){1|C<4>,2|H<1>,4|C<3>}	H(C[6]C[6,6]C[6])	119.2570	0.000	1	119.2570	0.000	1	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]C)(H)	C[6,6](C[6,6]N[6]2)(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]C)(H){1|C<3>,1|C<4>,1|H<1>,2|N<3>}	C[6,6](C[6,6]N[6]2)(C[6]C[6]H)2{2|Ru<5>,1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6,6]C[6])	118.3275	0.395	2	118.3275	0.156	2	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]C[5,6]C[6])(C[6]C[6]2)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|H<1>,2|C<4>}	C[6,6](C[6,6]C[5,6]C[6])(C[6]C[6]2)(C[6]C[6]H){1|C<4>,3|H<1>,5|C<3>}	H(C[6]C[6,6]C[6])	109.8190	0.000	1	109.8190	0.000	1	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]C[6,6]N[6])(C[6]C[6]C)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6,6](C[6,6]C[6,6]N[6])(C[6]C[6]C)(C[6]C[6]H){1|Ru<6>,1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6,6]C[6])	116.1800	0.000	1	115.8305	0.244	2	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]C[6,6]N[6])(C[6]C[6]C)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6,6](C[6,6]C[6,6]N[6])(C[6]C[6]C)(C[6]C[6]H){1|Ru<6>,1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6,6]C[6])	115.4810	0.000	1	115.8305	0.244	2	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]C[6,6]N[6])(C[6]C[6]H)(C[6]C[6]O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>,2|C<3>}	C[6,6](C[6,6]C[6,6]N[6])(C[6]C[6]H)(C[6]C[6]O){1|Co<6>,1|H<1>,1|N<3>,1|O<1>,2|C<3>}	H(C[6]C[6,6]C[6])	120.3697	0.085	3	120.4035	0.386	22	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]C[6,6]N[6])(C[6]C[6]H)(C[6]C[6]O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>,2|C<3>}	C[6,6](C[6,6]C[6,6]N[6])(C[6]C[6]H)(C[6]C[6]O){1|Hg<6>,1|H<1>,1|N<3>,1|O<1>,2|C<3>}	H(C[6]C[6,6]C[6])	120.7703	0.794	4	120.4035	0.386	22	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]C[6,6]N[6])(C[6]C[6]H)(C[6]C[6]O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>,2|C<3>}	C[6,6](C[6,6]C[6,6]N[6])(C[6]C[6]H)(C[6]C[6]O){1|Mn<6>,1|H<1>,1|N<3>,1|O<1>,2|C<3>}	H(C[6]C[6,6]C[6])	119.9397	0.971	3	120.4035	0.386	22	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]C[6,6]N[6])(C[6]C[6]H)(C[6]C[6]O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>,2|C<3>}	C[6,6](C[6,6]C[6,6]N[6])(C[6]C[6]H)(C[6]C[6]O){1|Mn<7>,1|H<1>,1|N<3>,1|O<1>,2|C<3>}	H(C[6]C[6,6]C[6])	120.5700	0.000	1	120.4035	0.386	22	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]C[6,6]N[6])(C[6]C[6]H)(C[6]C[6]O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>,2|C<3>}	C[6,6](C[6,6]C[6,6]N[6])(C[6]C[6]H)(C[6]C[6]O){1|Pt<4>,1|H<1>,1|N<3>,1|O<1>,2|C<3>}	H(C[6]C[6,6]C[6])	120.6200	0.522	2	120.4035	0.386	22	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]C[6,6]N[6])(C[6]C[6]H)(C[6]C[6]O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>,2|C<3>}	C[6,6](C[6,6]C[6,6]N[6])(C[6]C[6]H)(C[6]C[6]O){1|Re<6>,1|H<1>,1|N<3>,1|O<1>,2|C<3>}	H(C[6]C[6,6]C[6])	120.1160	0.847	2	120.4035	0.386	22	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]C[6,6]N[6])(C[6]C[6]H)(C[6]C[6]O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>,2|C<3>}	C[6,6](C[6,6]C[6,6]N[6])(C[6]C[6]H)(C[6]C[6]O){1|Ru<6>,1|H<1>,1|N<3>,1|O<1>,2|C<3>}	H(C[6]C[6,6]C[6])	120.6250	0.000	1	120.4035	0.386	22	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]C[6,6]N[6])(C[6]C[6]H)(C[6]C[6]O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>,2|C<3>}	C[6,6](C[6,6]C[6,6]N[6])(C[6]C[6]H)(C[6]C[6]O){1|Zn<6>,1|H<1>,1|N<3>,1|O<1>,2|C<3>}	H(C[6]C[6,6]C[6])	120.3670	0.600	6	120.4035	0.386	22	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]C[6,6]N[6])(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|C<4>,1|H<1>,1|N<3>}	C[6,6](C[6,6]C[6,6]N[6])(C[6]C[6]H)2{1|Cu<5>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6,6]C[6])	117.2520	0.000	1	119.0643	3.631	3	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]C[6,6]N[6])(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|N<3>,2|H<1>}	C[6,6](C[6,6]C[6,6]N[6])(C[6]C[6]H)2{1|Cu<5>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6,6]C[6])	119.9705	1.528	2	119.0643	3.631	3	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]C[6,6]O[6])(C[6]C[6,6]O)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|O<1>,1|O<2>,4|C<4>}	C[6,6](C[6,6]C[6,6]O[6])(C[6]C[6,6]O)(C[6]C[6]H){1|C<3>,2|H<1>,4|C<4>}	H(C[6]C[6,6]C[6])	120.1900	0.000	1	120.1900	0.000	1	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]C[6,6a]N[6])(C[6]C[6]H)(C[6]C[6]O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>,2|C<3>}	C[6,6](C[6,6]C[6,6a]N[6])(C[6]C[6]H)(C[6]C[6]O){1|N<2>,1|O<1>,2|C<3>,2|H<1>}	H(C[6]C[6,6]C[6])	120.1684	0.145	5	120.1684	0.021	5	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]C[6]2)(C[6]C[6,6]O)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>,3|C<3>}	C[6,6](C[6,6]C[6]2)(C[6]C[6,6]O)(C[6]C[6]H){1|C<4>,1|O<1>,2|C<3>,2|H<1>}	H(C[6]C[6,6]C[6])	117.7830	0.000	1	117.7830	0.000	1	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]2)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<2>,1|H<1>,1|N<3>,2|C<3>}	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]2)(C[6]C[6]H){1|C<4>,2|H<1>,4|C<3>}	H(C[6]C[6,6]C[6])	118.6400	0.000	1	118.6400	0.000	1	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]H)(C[6]C[6]O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>,2|C<3>}	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]H)(C[6]C[6]O){1|Ir<8>,1|H<1>,1|O<1>,1|O<2>,2|C<3>}	H(C[6]C[6,6]C[6])	120.6120	0.000	1	120.2415	0.557	6	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]H)(C[6]C[6]O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>,2|C<3>}	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]H)(C[6]C[6]O){1|Os<9>,1|H<1>,1|O<1>,1|O<2>,2|C<3>}	H(C[6]C[6,6]C[6])	120.9780	0.000	1	120.2415	0.557	6	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]H)(C[6]C[6]O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>,2|C<3>}	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]H)(C[6]C[6]O){1|Rh<8>,1|H<1>,1|O<1>,1|O<2>,2|C<3>}	H(C[6]C[6,6]C[6])	120.5830	0.000	1	120.2415	0.557	6	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]H)(C[6]C[6]O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>,2|C<3>}	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]H)(C[6]C[6]O){1|Ru<9>,1|H<1>,1|O<1>,1|O<2>,2|C<3>}	H(C[6]C[6,6]C[6])	120.6860	0.000	1	120.2415	0.557	6	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]H)(C[6]C[6]O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>,3|C<4>}	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]H)(C[6]C[6]O){3|C<4>,5|H<1>}	H(C[6]C[6,6]C[6])	119.2950	0.013	2	120.2415	0.557	6	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|C<5>,1|H<1>,1|N<3>}	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]H)2{2|Y<14>,1|O<3>,2|C<3>,3|H<1>}	H(C[6]C[6,6]C[6])	119.7570	0.000	1	119.0129	12.860	14	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|C<5>,1|H<1>,1|N<3>}	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]H)2{2|Yb<14>,1|O<3>,2|C<3>,3|H<1>}	H(C[6]C[6,6]C[6])	118.8790	0.000	1	119.0129	12.860	14	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>,2|H<1>}	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]H)2{1|Ti<9>,1|O<2>,2|C<3>,2|H<1>}	H(C[6]C[6,6]C[6])	120.1950	0.083	2	119.0129	12.860	14	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>,2|H<1>}	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]H)2{2|Ni<4>,1|C<3>,1|C<4>,3|H<1>}	H(C[6]C[6,6]C[6])	120.0570	0.000	1	119.0129	12.860	14	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<5>,1|N<3>,2|H<1>}	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]H)2{2|Y<14>,1|O<3>,2|C<3>,3|H<1>}	H(C[6]C[6,6]C[6])	119.9300	0.000	1	119.0129	12.860	14	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<5>,1|N<3>,2|H<1>}	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]H)2{2|Yb<14>,1|O<3>,2|C<3>,3|H<1>}	H(C[6]C[6,6]C[6])	119.7810	0.000	1	119.0129	12.860	14	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>,2|C<4>}	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]H)2{1|Ti<9>,1|O<2>,2|C<3>,2|H<1>}	H(C[6]C[6,6]C[6])	120.1825	0.088	2	119.0129	12.860	14	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]H)2{1|Pt<4>,1|O<1>,2|C<3>,2|H<1>}	H(C[6]C[6,6]C[6])	120.5170	0.000	1	119.0129	12.860	14	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>}	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]H)2{1|Zn<6>,1|C<2>,1|C<3>,1|N<3>,2|H<1>}	H(C[6]C[6,6]C[6])	107.1470	0.000	1	119.0129	12.860	14	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]H)2{1|Pt<4>,1|O<1>,2|C<3>,2|H<1>}	H(C[6]C[6,6]C[6])	117.6880	0.000	1	119.0129	12.860	14	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]H)2{1|Zn<6>,1|C<2>,1|C<3>,1|N<3>,2|H<1>}	H(C[6]C[6,6]C[6])	122.7170	0.000	1	119.0129	12.860	14	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|Ni<4>,1|C<3>,1|C<4>,1|N<3>,2|H<1>}	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]H)2{2|Ni<4>,1|C<3>,1|C<4>,3|H<1>}	H(C[6]C[6,6]C[6])	118.9520	0.000	1	119.0129	12.860	14	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]C[6]O[6])(C[6]C[6,6a]O)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|O<1>,1|O<2>,3|C<4>}	C[6,6](C[6,6]C[6]O[6])(C[6]C[6,6a]O)(C[6]C[6]H){1|H<1>,2|C<3>,3|C<4>}	H(C[6]C[6,6]C[6])	120.1290	0.000	1	120.1290	0.000	1	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]C[6]O[6])(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<2>,1|N<3>,1|O<2>,2|H<1>}	C[6,6](C[6,6]C[6]O[6])(C[6]C[6]H)(C[6]N[6]H){1|B<4>,1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6,6]C[6])	115.7710	0.000	1	115.7710	0.000	1	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]N[5,6]N[6])(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,2|H<1>,2|N<3>}	C[6,6](C[6,6]N[5,6]N[6])(C[6]C[6]H)2{1|Ir<8>,1|H<1>,4|C<3>}	H(C[6]C[6,6]C[6])	120.2830	0.000	1	119.7625	0.744	4	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]N[5,6]N[6])(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,2|H<1>,2|N<3>}	C[6,6](C[6,6]N[5,6]N[6])(C[6]C[6]H)2{1|Pd<4>,1|H<1>,4|C<3>}	H(C[6]C[6,6]C[6])	119.5890	0.967	3	119.7625	0.744	4	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]N[5a,6]N[6])(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,2|H<1>,2|N<3>}	C[6,6](C[6,6]N[5a,6]N[6])(C[6]C[6]H)2{1|Rh<6>,1|H<1>,4|C<3>}	H(C[6]C[6,6]C[6])	120.6250	0.000	1	120.8140	0.071	2	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]N[5a,6]N[6])(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,2|H<1>,2|N<3>}	C[6,6](C[6,6]N[5a,6]N[6])(C[6]C[6]H)2{1|Ru<8>,1|H<1>,4|C<3>}	H(C[6]C[6,6]C[6])	121.0030	0.000	1	120.8140	0.071	2	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]N[6]2)(C[6]C[6]C)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<2>,2|N<3>}	C[6,6](C[6,6]N[6]2)(C[6]C[6]C)(C[6]C[6]H){2|Cu<3>,2|C<3>,2|H<1>}	H(C[6]C[6,6]C[6])	119.3840	0.000	1	119.4703	0.012	3	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]N[6]2)(C[6]C[6]C)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,3|N<3>}	C[6,6](C[6,6]N[6]2)(C[6]C[6]C)(C[6]C[6]H){1|Co<6>,2|C<3>,2|H<1>}	H(C[6]C[6,6]C[6])	119.5135	0.111	2	119.4703	0.012	3	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]N[6]2)(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|N<2>,1|N<3>}	C[6,6](C[6,6]N[6]2)(C[6]C[6]H)2{1|Ru<6>,2|C<3>,2|H<1>}	H(C[6]C[6,6]C[6])	120.5730	0.147	4	120.2277	0.085	110	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]N[6]2)(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,2|N<3>}	C[6,6](C[6,6]N[6]2)(C[6]C[6]H)2{1|Cu<5>,1|Pt<4>,2|C<3>,2|H<1>}	H(C[6]C[6,6]C[6])	120.2010	0.000	1	120.2277	0.085	110	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]N[6]2)(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,2|N<3>}	C[6,6](C[6,6]N[6]2)(C[6]C[6]H)2{1|Rh<4>,1|Rh<5>,2|C<3>,2|H<1>}	H(C[6]C[6,6]C[6])	120.3860	0.116	2	120.2277	0.085	110	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]N[6]2)(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,2|N<3>}	C[6,6](C[6,6]N[6]2)(C[6]C[6]H)2{1|Rh<7>,1|B<5>,2|C<3>,2|H<1>}	H(C[6]C[6,6]C[6])	120.4670	0.085	2	120.2277	0.085	110	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]N[6]2)(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,2|N<3>}	C[6,6](C[6,6]N[6]2)(C[6]C[6]H)2{2|Co<6>,2|C<3>,2|H<1>}	H(C[6]C[6,6]C[6])	120.7855	0.139	2	120.2277	0.085	110	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]N[6]2)(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,2|N<3>}	C[6,6](C[6,6]N[6]2)(C[6]C[6]H)2{2|Cu<3>,2|C<3>,2|H<1>}	H(C[6]C[6,6]C[6])	120.2323	0.084	3	120.2277	0.085	110	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]N[6]2)(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,2|N<3>}	C[6,6](C[6,6]N[6]2)(C[6]C[6]H)2{2|Cu<4>,2|C<3>,2|H<1>}	H(C[6]C[6,6]C[6])	120.0865	0.241	2	120.2277	0.085	110	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]N[6]2)(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,2|N<3>}	C[6,6](C[6,6]N[6]2)(C[6]C[6]H)2{2|Cu<5>,2|C<3>,2|H<1>}	H(C[6]C[6,6]C[6])	120.3047	0.071	4	120.2277	0.085	110	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]N[6]2)(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,2|N<3>}	C[6,6](C[6,6]N[6]2)(C[6]C[6]H)2{2|Fe<5>,2|C<3>,2|H<1>}	H(C[6]C[6,6]C[6])	120.0800	0.079	2	120.2277	0.085	110	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]N[6]2)(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,2|N<3>}	C[6,6](C[6,6]N[6]2)(C[6]C[6]H)2{2|Fe<6>,2|C<3>,2|H<1>}	H(C[6]C[6,6]C[6])	120.4000	0.000	1	120.2277	0.085	110	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]N[6]2)(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>,1|N<3>,1|O<1>}	C[6,6](C[6,6]N[6]2)(C[6]C[6]H)2{1|Ru<6>,2|C<3>,2|H<1>}	H(C[6]C[6,6]C[6])	119.8372	0.065	4	120.2277	0.085	110	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]N[6]2)(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>,2|N<3>}	C[6,6](C[6,6]N[6]2)(C[6]C[6]H)2{1|Cu<5>,1|Pt<4>,2|C<3>,2|H<1>}	H(C[6]C[6,6]C[6])	120.2040	0.000	1	120.2277	0.085	110	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]N[6]2)(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>,2|N<3>}	C[6,6](C[6,6]N[6]2)(C[6]C[6]H)2{2|Cu<4>,2|C<3>,2|H<1>}	H(C[6]C[6,6]C[6])	120.1895	0.071	2	120.2277	0.085	110	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]N[6]2)(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,3|N<3>}	C[6,6](C[6,6]N[6]2)(C[6]C[6]H)2{1|Cu<4>,1|Cu<5>,2|C<3>,2|H<1>}	H(C[6]C[6,6]C[6])	119.9570	0.000	1	120.2277	0.085	110	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]N[6]2)(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,3|N<3>}	C[6,6](C[6,6]N[6]2)(C[6]C[6]H)2{2|Cu<3>,2|C<3>,2|H<1>}	H(C[6]C[6,6]C[6])	120.0240	0.020	2	120.2277	0.085	110	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]N[6]2)(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,3|N<3>}	C[6,6](C[6,6]N[6]2)(C[6]C[6]H)2{2|Ni<6>,2|C<3>,2|H<1>}	H(C[6]C[6,6]C[6])	120.1167	0.407	3	120.2277	0.085	110	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]N[6]2)(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,2|H<1>,2|N<3>}	C[6,6](C[6,6]N[6]2)(C[6]C[6]H)2{1|Cu<3>,1|Cu<4>,2|C<3>,2|H<1>}	H(C[6]C[6,6]C[6])	120.5265	0.026	2	120.2277	0.085	110	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]N[6]2)(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,2|H<1>,2|N<3>}	C[6,6](C[6,6]N[6]2)(C[6]C[6]H)2{1|Cu<4>,1|Cu<5>,2|C<3>,2|H<1>}	H(C[6]C[6,6]C[6])	119.7420	0.000	1	120.2277	0.085	110	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]N[6]2)(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,2|H<1>,2|N<3>}	C[6,6](C[6,6]N[6]2)(C[6]C[6]H)2{1|Rh<4>,1|Rh<5>,2|C<3>,2|H<1>}	H(C[6]C[6,6]C[6])	120.0285	0.360	2	120.2277	0.085	110	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]N[6]2)(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,2|H<1>,2|N<3>}	C[6,6](C[6,6]N[6]2)(C[6]C[6]H)2{2|Pd<4>,2|C<3>,2|H<1>}	H(C[6]C[6,6]C[6])	119.6220	0.000	1	120.2277	0.085	110	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]N[6]2)(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,2|H<1>,2|N<3>}	C[6,6](C[6,6]N[6]2)(C[6]C[6]H)2{2|Re<5>,2|C<3>,2|H<1>}	H(C[6]C[6,6]C[6])	120.5280	0.000	1	120.2277	0.085	110	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]N[6]2)(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,2|H<1>,2|N<3>}	C[6,6](C[6,6]N[6]2)(C[6]C[6]H)2{2|Rh<5>,2|C<3>,2|H<1>}	H(C[6]C[6,6]C[6])	120.5690	0.422	3	120.2277	0.085	110	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]N[6]2)(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,2|H<1>,2|N<3>}	C[6,6](C[6,6]N[6]2)(C[6]C[6]H)2{2|Ru<5>,1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6,6]C[6])	120.1810	0.602	2	120.2277	0.085	110	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]N[6]2)(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,2|H<1>,2|N<3>}	C[6,6](C[6,6]N[6]2)(C[6]C[6]H)2{2|Ru<5>,1|H<1>,3|C<3>}	H(C[6]C[6,6]C[6])	120.5870	0.000	1	120.2277	0.085	110	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]N[6]2)(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,2|H<1>,2|N<3>}	C[6,6](C[6,6]N[6]2)(C[6]C[6]H)2{2|Ru<5>,2|C<3>,2|H<1>}	H(C[6]C[6,6]C[6])	120.4098	0.278	13	120.2277	0.085	110	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]N[6]2)(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6,6](C[6,6]N[6]2)(C[6]C[6]H)2{1|Co<4>,1|Co<5>,2|C<3>,2|H<1>}	H(C[6]C[6,6]C[6])	120.0200	0.191	2	120.2277	0.085	110	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]N[6]2)(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6,6](C[6,6]N[6]2)(C[6]C[6]H)2{1|Cu<3>,1|Cu<4>,2|C<3>,2|H<1>}	H(C[6]C[6,6]C[6])	120.2395	0.019	2	120.2277	0.085	110	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]N[6]2)(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6,6](C[6,6]N[6]2)(C[6]C[6]H)2{1|Ni<5>,1|Ni<6>,2|C<3>,2|H<1>}	H(C[6]C[6,6]C[6])	119.9690	0.000	1	120.2277	0.085	110	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]N[6]2)(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6,6](C[6,6]N[6]2)(C[6]C[6]H)2{1|Pd<3>,1|Pd<4>,2|C<3>,2|H<1>}	H(C[6]C[6,6]C[6])	120.1895	0.218	4	120.2277	0.085	110	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]N[6]2)(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6,6](C[6,6]N[6]2)(C[6]C[6]H)2{2|Co<5>,2|C<3>,2|H<1>}	H(C[6]C[6,6]C[6])	119.8300	0.000	1	120.2277	0.085	110	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]N[6]2)(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6,6](C[6,6]N[6]2)(C[6]C[6]H)2{2|Co<6>,2|C<3>,2|H<1>}	H(C[6]C[6,6]C[6])	120.2195	0.112	2	120.2277	0.085	110	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]N[6]2)(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6,6](C[6,6]N[6]2)(C[6]C[6]H)2{2|Ni<3>,2|C<3>,2|H<1>}	H(C[6]C[6,6]C[6])	120.1950	0.175	3	120.2277	0.085	110	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]N[6]2)(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6,6](C[6,6]N[6]2)(C[6]C[6]H)2{2|Ni<4>,2|C<3>,2|H<1>}	H(C[6]C[6,6]C[6])	120.0386	0.288	12	120.2277	0.085	110	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]N[6]2)(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6,6](C[6,6]N[6]2)(C[6]C[6]H)2{2|Ni<5>,2|C<3>,2|H<1>}	H(C[6]C[6,6]C[6])	120.3445	0.037	2	120.2277	0.085	110	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]N[6]2)(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6,6](C[6,6]N[6]2)(C[6]C[6]H)2{2|Pd<4>,2|C<3>,2|H<1>}	H(C[6]C[6,6]C[6])	119.8600	0.000	1	120.2277	0.085	110	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]N[6]2)(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6,6](C[6,6]N[6]2)(C[6]C[6]H)2{2|Re<5>,2|C<3>,2|H<1>}	H(C[6]C[6,6]C[6])	120.4590	0.000	1	120.2277	0.085	110	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]N[6]2)(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6,6](C[6,6]N[6]2)(C[6]C[6]H)2{2|Rh<5>,2|C<3>,2|H<1>}	H(C[6]C[6,6]C[6])	120.1737	0.239	3	120.2277	0.085	110	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]N[6]2)(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6,6](C[6,6]N[6]2)(C[6]C[6]H)2{2|Ru<5>,2|C<3>,2|H<1>}	H(C[6]C[6,6]C[6])	120.2330	0.223	14	120.2277	0.085	110	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6,6](C[6,6]C[6,6]C[6])(C[6]C[6a]C[6])(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){1|C<4>,1|O<1>,3|C<3>}	C[6,6](C[6,6]C[6,6]C[6])(C[6]C[6a]C[6])(C[6]C[6]H){1|H<1>,1|O<1>,1|O<2>,3|C<3>,3|C<4>}	H(C[6]C[6,6]C[6])	119.7570	0.000	1	119.7570	0.000	1	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6,6](C[6,6]C[6]2)(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){1|H<1>,1|O<2>,2|C<3>,2|C<4>}	C[6,6](C[6,6]C[6]2)(C[6]C[6]H)2{1|O<1>,1|O<2>,2|H<1>,3|C<4>}	H(C[6]C[6,6]C[6])	119.4630	0.000	1	119.4630	0.000	1	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]C)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]C)(C[6]C[6]H){1|C<3>,1|C<4>,2|H<1>,2|O<1>}	H(C[6]C[6,6]C[6])	118.4390	0.277	2	118.4390	0.077	2	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6,6](C[6,6]C[6]O[6])(C[6]C[6,6]O)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){1|O<2>,2|C<4>,2|O<1>}	C[6,6](C[6,6]C[6]O[6])(C[6]C[6,6]O)(C[6]C[6]H){1|H<1>,1|O<2>,2|C<3>,3|C<4>}	H(C[6]C[6,6]C[6])	118.7715	0.069	2	118.7715	0.005	2	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6a]C[6])(H)	C[6,6](C[6,6]N[6]2)(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6a]C[6])(H){1|H<1>,3|C<3>,3|N<3>}	C[6,6](C[6,6]N[6]2)(C[6]C[6]H)2{2|Ru<5>,1|H<1>,3|C<3>}	H(C[6]C[6,6]C[6])	119.3760	0.000	1	119.3760	0.000	1	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]N[5a,6]H)(H)	C[6,6](C[6,6]C[5a,6]C[6])(C[6]C[6]H)(C[6]C[6]O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]N[5a,6]H)(H){1|O<1>,4|C<3>}	C[6,6](C[6,6]C[5a,6]C[6])(C[6]C[6]H)(C[6]C[6]O){1|H<1>,1|N<3>,1|O<1>,3|C<3>}	H(C[6]C[6,6]C[6])	119.8110	0.000	1	119.8110	0.000	1	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]N[6]C)(H)	C[6,6](C[6,6]C[6]2)(C[6]C[6]Cl)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]N[6]C)(H){1|Cl<1>,1|H<1>,3|C<3>}	C[6,6](C[6,6]C[6]2)(C[6]C[6]Cl)(C[6]C[6]H){1|C<3>,1|C<4>,1|H<1>,1|N<3>,2|O<1>}	H(C[6]C[6,6]C[6])	118.9370	0.000	1	118.9370	0.000	1	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]O[6]C)(H)	C[6,6](C[6,6]C[5,6]C[6])(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]O[6]C)(H){1|H<1>,3|C<3>}	C[6,6](C[6,6]C[5,6]C[6])(C[6]C[6]H)2{1|C<4>,1|H<1>,1|O<1>,1|O<2>,2|C<3>}	H(C[6]C[6,6]C[6])	118.6540	0.093	2	118.6540	0.009	2	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]O[6]C)(H)	C[6,6](C[6,6]C[6]2)(C[6]C[6]C)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]O[6]C)(H){1|C<4>,3|C<3>}	C[6,6](C[6,6]C[6]2)(C[6]C[6]C)(C[6]C[6]H){1|C<3>,1|O<1>,1|O<2>,2|C<4>,2|H<1>}	H(C[6]C[6,6]C[6])	119.5270	0.000	1	119.7002	1.341	5	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]O[6]C)(H)	C[6,6](C[6,6]C[6]2)(C[6]C[6]C)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]O[6]C)(H){1|C<4>,3|C<3>}	C[6,6](C[6,6]C[6]2)(C[6]C[6]C)(C[6]C[6]H){1|O<1>,2|C<4>,2|H<1>,2|O<2>}	H(C[6]C[6,6]C[6])	121.6700	0.000	1	119.7002	1.341	5	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]O[6]C)(H)	C[6,6](C[6,6]C[6]2)(C[6]C[6]C)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]O[6]C)(H){2|C<3>,2|C<4>}	C[6,6](C[6,6]C[6]2)(C[6]C[6]C)(C[6]C[6]H){1|O<1>,2|C<4>,2|H<1>,2|O<2>}	H(C[6]C[6,6]C[6])	119.1013	0.434	3	119.7002	1.341	5	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]O[6]C)(H)	C[6,6](C[6,6]C[6]2)(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]O[6]C)(H){1|C<4>,1|H<1>,2|C<3>}	C[6,6](C[6,6]C[6]2)(C[6]C[6]H)2{1|O<1>,1|O<2>,2|H<1>,3|C<4>}	H(C[6]C[6,6]C[6])	119.1620	0.000	1	119.1620	0.000	1	119.8300	2.062	210	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]N[6])(C[6]C[5,6]H)(H)	C[6,6](C[6,6]C[6]O[6])(C[6]C[6]H)(N[6]C[6]C)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]N[6])(C[6]C[5,6]H)(H){1|N<3>,1|O<2>,2|C<3>,2|C<4>}	C[6,6](C[6,6]C[6]O[6])(C[6]C[6]H)(N[6]C[6]C){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6,6]C[6])	120.5765	0.329	4	120.5765	0.108	4	120.2782	0.280	6	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]N[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]C[6]2)(C[6]C[6]H)(N[6]C[6]O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]N[6])(C[6]C[6]H)(H){1|C<4>,2|C<3>,2|O<1>}	C[6,6](C[6,6]C[6]2)(C[6]C[6]H)(N[6]C[6]O){1|C<4>,2|H<1>,4|C<3>}	H(C[6]C[6,6]C[6])	119.6815	0.094	2	119.6815	0.009	2	120.2782	0.280	6	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:N[6,6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]N[6,6])(C[6]C[6]C)(H)	C[6,6](C[6,6]N[6,6]C[6])(N[6,6]C[6]2)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]N[6,6])(C[6]C[6]C)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6,6](C[6,6]N[6,6]C[6])(N[6,6]C[6]2)(C[6]C[6]H){1|C<4>,4|C<3>,4|H<1>}	H(C[6]C[6,6]C[6])	119.6290	0.000	1	119.4383	0.149	3	119.7734	1.046	25	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:N[6,6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]N[6,6])(C[6]C[6]C)(H)	C[6,6](C[6,6]N[6,6]C[6])(N[6,6]C[6]2)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]N[6,6])(C[6]C[6]C)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6,6](C[6,6]N[6,6]C[6])(N[6,6]C[6]2)(C[6]C[6]H){2|C<4>,3|C<3>,4|H<1>}	H(C[6]C[6,6]C[6])	119.3430	0.494	2	119.4383	0.149	3	119.7734	1.046	25	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:N[6,6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]N[6,6])(C[6]C[6]H)(H)	C[6,6](C[6,6]N[6,6]C[6])(N[6,6]C[6]2)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]N[6,6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6,6](C[6,6]N[6,6]C[6])(N[6,6]C[6]2)(C[6]C[6]H){1|C<4>,3|C<3>,5|H<1>}	H(C[6]C[6,6]C[6])	119.7906	1.129	20	119.8190	1.163	22	119.7734	1.046	25	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:N[6,6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]N[6,6])(C[6]C[6]H)(H)	C[6,6](C[6,6]N[6,6]C[6])(N[6,6]C[6]2)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]N[6,6])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|C<4>}	C[6,6](C[6,6]N[6,6]C[6])(N[6,6]C[6]2)(C[6]C[6]H){1|C<4>,3|C<3>,5|H<1>}	H(C[6]C[6,6]C[6])	120.1040	0.119	2	119.8190	1.163	22	119.7734	1.046	25	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]N[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]C[6,6]C[6])(N[6]C[6,6a]C)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]N[6])(C[6]C[6]H)(H){2|C<3>,2|C<4>}	C[6,6](C[6,6]C[6,6]C[6])(N[6]C[6,6a]C)(C[6]C[6]H){1|C<2>,1|O<2>,2|H<1>,3|C<3>}	H(C[6]C[6,6]C[6])	119.3400	0.000	1	119.3400	0.000	1	120.2889	0.211	9	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]N[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]C[6,6]N[6])(N[6]N[6]Yb)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]N[6])(C[6]C[6]H)(H){1|Yb<12>,1|C<3>,1|H<1>,2|N<3>}	C[6,6](C[6,6]C[6,6]N[6])(N[6]N[6]Yb)(C[6]C[6]H){1|Pd<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6,6]C[6])	120.7975	0.117	2	120.5323	0.122	4	120.2889	0.211	9	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]N[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]C[6,6]N[6])(N[6]N[6]Yb)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]N[6])(C[6]C[6]H)(H){1|Yb<13>,1|C<3>,1|H<1>,2|N<3>}	C[6,6](C[6,6]C[6,6]N[6])(N[6]N[6]Yb)(C[6]C[6]H){1|Pd<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6,6]C[6])	120.2670	0.269	2	120.5323	0.122	4	120.2889	0.211	9	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]N[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]C[6]N[6])(N[6]C[6,6a]H)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]N[6])(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|N<2>,2|H<1>}	C[6,6](C[6,6]C[6]N[6])(N[6]C[6,6a]H)(C[6]C[6]H){1|H<1>,3|C<3>}	H(C[6]C[6,6]C[6])	120.4830	0.000	1	120.2827	0.061	4	120.2889	0.211	9	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]N[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]C[6]N[6])(N[6]C[6,6a]H)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]N[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6,6](C[6,6]C[6]N[6])(N[6]C[6,6a]H)(C[6]C[6]H){1|Ru<6>,3|C<3>,3|H<1>}	H(C[6]C[6,6]C[6])	120.2160	0.256	3	120.2827	0.061	4	120.2889	0.211	9	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6,6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6a]C[6,6])(C[6]C[6]H)(H)	C[6,6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6,6]N[6])(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]C[6,6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6,6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6,6]N[6])(C[6]C[6]H){1|Cr<9>,1|Mn<6>,1|H<1>,1|O<2>,2|C<4>,3|C<3>}	H(C[6]C[6,6]C[6])	120.1200	0.000	1	120.1200	0.000	1	120.6557	2.989	4	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6,6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6a]C[6,6])(C[6]C[6]H)(H)	C[6,6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6]2)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]C[6,6])(C[6]C[6]H)(H){1|C<4>,3|C<3>}	C[6,6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6]2)(C[6]C[6]H){1|C<2>,1|C<4>,1|N<2>,2|C<3>,4|H<1>}	H(C[6]C[6,6]C[6])	119.5890	0.000	1	119.5890	0.000	1	120.6557	2.989	4	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6,6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6a]C[6,6])(C[6]C[6]O)(H)	C[6,6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6]O[6])(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]C[6,6])(C[6]C[6]O)(H){1|O<2>,2|H<1>,3|C<3>}	C[6,6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6]O[6])(C[6]C[6]H){1|C<4>,1|H<1>,1|O<1>,1|O<2>,3|C<3>}	H(C[6]C[6,6]C[6])	119.6880	0.000	1	119.6880	0.000	1	120.6557	2.989	4	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6,6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6a]C[6,6])(C[6]C[6a]O[6])(H)	C[6,6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6]2)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]C[6,6])(C[6]C[6a]O[6])(H){1|C<4>,5|C<3>}	C[6,6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6]2)(C[6]C[6]H){1|C<4>,1|O<2>,3|H<1>,4|C<3>}	H(C[6]C[6,6]C[6])	123.2260	0.000	1	123.2260	0.000	1	120.6557	2.989	4	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6a]-3:N[3x6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6a]N[3x6])(C[6]C[6]H)(H)	C[6,6](C[6,6a]C[6,6a]C[6a])(N[3x6]B[6,6]C[6,6])(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]N[3x6])(C[6]C[6]H)(H){1|B<4>,1|H<1>,3|C<3>}	C[6,6](C[6,6a]C[6,6a]C[6a])(N[3x6]B[6,6]C[6,6])(C[6]C[6]H){2|H<1>,2|O<2>,5|C<3>}	H(C[6]C[6,6]C[6])	119.8093	1.150	10	119.8093	1.324	10	119.8813	1.112	12	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6a]-3:N[3x6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6a]N[3x6])(C[6]C[6]H)(H)	C[6,6](C[6,6a]C[6,6a]C[6a])(N[3x6]C[6,6]P[6,6])(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]N[3x6])(C[6]C[6]H)(H){1|H<1>,1|P<3>,3|C<3>}	C[6,6](C[6,6a]C[6,6a]C[6a])(N[3x6]C[6,6]P[6,6])(C[6]C[6]H){2|H<1>,2|O<2>,4|C<3>}	H(C[6]C[6,6]C[6])	120.2415	0.105	2	120.2415	0.011	2	119.8813	1.112	12	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6a]-3:N[6,6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6a]N[6,6])(C[6]C[6,6a]H)(H)	C[6,6](C[6,6a]C[6,6a]C[6a])(N[6,6]C[6,6a]B[3x6])(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]N[6,6])(C[6]C[6,6a]H)(H){1|B<4>,1|N<3>,3|C<3>}	C[6,6](C[6,6a]C[6,6a]C[6a])(N[6,6]C[6,6a]B[3x6])(C[6]C[6]H){2|H<1>,3|C<4>,4|C<3>}	H(C[6]C[6,6]C[6])	119.3480	0.000	1	119.3480	0.000	1	119.2576	0.836	45	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6a]-3:N[6,6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6a]N[6,6])(C[6]C[6,6a]H)(H)	C[6,6](C[6,6a]C[6,6a]C[6a])(N[6,6]C[6,6a]B[6])(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]N[6,6])(C[6]C[6,6a]H)(H){1|B<4>,4|C<3>}	C[6,6](C[6,6a]C[6,6a]C[6a])(N[6,6]C[6,6a]B[6])(C[6]C[6]H){1|O<2>,2|F<1>,2|H<1>,4|C<3>}	H(C[6]C[6,6]C[6])	119.8920	0.000	1	119.8920	0.000	1	119.2576	0.836	45	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6a]-3:N[6,6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6a]N[6,6])(C[6]C[6]C)(H)	C[6,6](C[6,6a]C[6,6a]2)(N[6,6]C[6]2)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]N[6,6])(C[6]C[6]C)(H){1|C<4>,1|H<1>,3|C<3>}	C[6,6](C[6,6a]C[6,6a]2)(N[6,6]C[6]2)(C[6]C[6]H){1|C<4>,3|H<1>,5|C<3>}	H(C[6]C[6,6]C[6])	119.0746	0.168	7	119.1815	0.045	12	119.2576	0.836	45	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6a]-3:N[6,6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6a]N[6,6])(C[6]C[6]C)(H)	C[6,6](C[6,6a]C[6,6a]2)(N[6,6]C[6]2)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]N[6,6])(C[6]C[6]C)(H){1|C<4>,1|H<1>,3|C<3>}	C[6,6](C[6,6a]C[6,6a]2)(N[6,6]C[6]2)(C[6]C[6]H){2|C<4>,3|H<1>,4|C<3>}	H(C[6]C[6,6]C[6])	119.3312	0.181	5	119.1815	0.045	12	119.2576	0.836	45	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6a]-3:N[6,6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6a]N[6,6])(C[6]C[6]C)(H)	C[6,6](C[6,6a]C[6,6a]C[6a])(N[6,6]B[6]C[6])(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]N[6,6])(C[6]C[6]C)(H){1|B<4>,1|H<1>,3|C<3>}	C[6,6](C[6,6a]C[6,6a]C[6a])(N[6,6]B[6]C[6])(C[6]C[6]H){1|C<4>,1|F<1>,1|O<2>,2|H<1>,4|C<3>}	H(C[6]C[6,6]C[6])	119.5530	0.000	1	119.5530	0.000	1	119.2576	0.836	45	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6a]-3:N[6,6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6a]N[6,6])(C[6]C[6]H)(H)	C[6,6](C[6,6a]C[5a,6,6a]C[5a,6a])(N[6,6]B[6]C[6])(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]N[6,6])(C[6]C[6]H)(H){1|B<4>,1|H<1>,3|C<3>}	C[6,6](C[6,6a]C[5a,6,6a]C[5a,6a])(N[6,6]B[6]C[6])(C[6]C[6]H){1|C<4>,1|H<1>,1|N<3>,2|F<1>,4|C<3>}	H(C[6]C[6,6]C[6])	119.7910	0.000	1	119.7910	0.000	1	119.2576	0.836	45	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6a]-3:N[6,6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6a]N[6,6])(C[6]C[6]H)(H)	C[6,6](C[6,6a]C[5a,6,6a]C[6a])(N[6,6]B[6]C[6])(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]N[6,6])(C[6]C[6]H)(H){1|B<4>,1|H<1>,3|C<3>}	C[6,6](C[6,6a]C[5a,6,6a]C[6a])(N[6,6]B[6]C[6])(C[6]C[6]H){1|N<3>,2|F<1>,3|C<3>,3|H<1>}	H(C[6]C[6,6]C[6])	119.7710	0.000	1	119.7710	0.000	1	119.2576	0.836	45	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6a]-3:N[6,6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6a]N[6,6])(C[6]C[6]H)(H)	C[6,6](C[6,6a]C[5a,6a]C[6,6a])(N[6,6]C[6]2)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]N[6,6])(C[6]C[6]H)(H){1|H<1>,4|C<3>}	C[6,6](C[6,6a]C[5a,6a]C[6,6a])(N[6,6]C[6]2)(C[6]C[6]H){1|N<3>,2|H<1>,5|C<3>}	H(C[6]C[6,6]C[6])	119.2420	0.000	1	119.2420	0.000	1	119.2576	0.836	45	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6a]-3:N[6,6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6a]N[6,6])(C[6]C[6]H)(H)	C[6,6](C[6,6a]C[6,6a]2)(N[6,6]C[6]2)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]N[6,6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,3|C<3>}	C[6,6](C[6,6a]C[6,6a]2)(N[6,6]C[6]2)(C[6]C[6]H){1|C<4>,3|H<1>,5|C<3>}	H(C[6]C[6,6]C[6])	120.0957	0.040	3	119.9136	0.087	5	119.2576	0.836	45	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6a]-3:N[6,6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6a]N[6,6])(C[6]C[6]H)(H)	C[6,6](C[6,6a]C[6,6a]2)(N[6,6]C[6]2)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]N[6,6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,3|C<3>}	C[6,6](C[6,6a]C[6,6a]2)(N[6,6]C[6]2)(C[6]C[6]H){1|C<4>,4|C<3>,4|H<1>}	H(C[6]C[6,6]C[6])	119.6405	0.308	2	119.9136	0.087	5	119.2576	0.836	45	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6a]-3:N[6,6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6a]N[6,6])(C[6]C[6]H)(H)	C[6,6](C[6,6a]C[6,6a]C[6a])(N[6,6]B[5,6]C[6])(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]N[6,6])(C[6]C[6]H)(H){1|B<4>,1|H<1>,3|C<3>}	C[6,6](C[6,6a]C[6,6a]C[6a])(N[6,6]B[5,6]C[6])(C[6]C[6]H){1|O<2>,3|H<1>,5|C<3>}	H(C[6]C[6,6]C[6])	119.8710	0.000	1	119.5777	0.066	3	119.2576	0.836	45	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6a]-3:N[6,6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6a]N[6,6])(C[6]C[6]H)(H)	C[6,6](C[6,6a]C[6,6a]C[6a])(N[6,6]B[5,6]C[6])(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]N[6,6])(C[6]C[6]H)(H){1|B<4>,1|H<1>,3|C<3>}	C[6,6](C[6,6a]C[6,6a]C[6a])(N[6,6]B[5,6]C[6])(C[6]C[6]H){2|C<4>,3|H<1>,4|C<3>}	H(C[6]C[6,6]C[6])	119.4310	0.049	2	119.5777	0.066	3	119.2576	0.836	45	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6a]-3:N[6,6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6a]N[6,6])(C[6]C[6]H)(H)	C[6,6](C[6,6a]C[6,6a]C[6a])(N[6,6]B[6,6]C[6])(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]N[6,6])(C[6]C[6]H)(H){1|B<4>,1|H<1>,3|C<3>}	C[6,6](C[6,6a]C[6,6a]C[6a])(N[6,6]B[6,6]C[6])(C[6]C[6]H){1|O<2>,3|H<1>,5|C<3>}	H(C[6]C[6,6]C[6])	116.2490	2.830	2	116.2490	8.008	2	119.2576	0.836	45	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6a]-3:N[6,6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6a]N[6,6])(C[6]C[6]H)(H)	C[6,6](C[6,6a]C[6,6a]C[6a])(N[6,6]B[6]C[6])(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]N[6,6])(C[6]C[6]H)(H){1|B<4>,1|C<4>,3|C<3>}	C[6,6](C[6,6a]C[6,6a]C[6a])(N[6,6]B[6]C[6])(C[6]C[6]H){1|F<1>,1|O<2>,3|H<1>,4|C<3>}	H(C[6]C[6,6]C[6])	119.8420	0.000	1	119.6274	0.041	9	119.2576	0.836	45	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6a]-3:N[6,6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6a]N[6,6])(C[6]C[6]H)(H)	C[6,6](C[6,6a]C[6,6a]C[6a])(N[6,6]B[6]C[6])(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]N[6,6])(C[6]C[6]H)(H){1|B<4>,1|H<1>,3|C<3>}	C[6,6](C[6,6a]C[6,6a]C[6a])(N[6,6]B[6]C[6])(C[6]C[6]H){1|C<4>,1|F<1>,1|O<2>,2|H<1>,4|C<3>}	H(C[6]C[6,6]C[6])	119.8550	0.000	1	119.6274	0.041	9	119.2576	0.836	45	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6a]-3:N[6,6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6a]N[6,6])(C[6]C[6]H)(H)	C[6,6](C[6,6a]C[6,6a]C[6a])(N[6,6]B[6]C[6])(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]N[6,6])(C[6]C[6]H)(H){1|B<4>,1|H<1>,3|C<3>}	C[6,6](C[6,6a]C[6,6a]C[6a])(N[6,6]B[6]C[6])(C[6]C[6]H){1|C<4>,2|F<1>,3|C<3>,3|H<1>}	H(C[6]C[6,6]C[6])	119.7290	0.000	1	119.6274	0.041	9	119.2576	0.836	45	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6a]-3:N[6,6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6a]N[6,6])(C[6]C[6]H)(H)	C[6,6](C[6,6a]C[6,6a]C[6a])(N[6,6]B[6]C[6])(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]N[6,6])(C[6]C[6]H)(H){1|B<4>,1|H<1>,3|C<3>}	C[6,6](C[6,6a]C[6,6a]C[6a])(N[6,6]B[6]C[6])(C[6]C[6]H){1|C<4>,2|I<1>,3|C<3>,3|H<1>}	H(C[6]C[6,6]C[6])	119.6890	0.000	1	119.6274	0.041	9	119.2576	0.836	45	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6a]-3:N[6,6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6a]N[6,6])(C[6]C[6]H)(H)	C[6,6](C[6,6a]C[6,6a]C[6a])(N[6,6]B[6]C[6])(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]N[6,6])(C[6]C[6]H)(H){1|B<4>,1|H<1>,3|C<3>}	C[6,6](C[6,6a]C[6,6a]C[6a])(N[6,6]B[6]C[6])(C[6]C[6]H){1|C<4>,3|H<1>,5|C<3>}	H(C[6]C[6,6]C[6])	119.4410	0.136	3	119.6274	0.041	9	119.2576	0.836	45	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6a]-3:N[6,6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6a]N[6,6])(C[6]C[6]H)(H)	C[6,6](C[6,6a]C[6,6a]C[6a])(N[6,6]B[6]C[6])(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]N[6,6])(C[6]C[6]H)(H){1|B<4>,1|H<1>,3|C<3>}	C[6,6](C[6,6a]C[6,6a]C[6a])(N[6,6]B[6]C[6])(C[6]C[6]H){1|F<1>,1|O<2>,3|H<1>,4|C<3>}	H(C[6]C[6,6]C[6])	119.7950	0.000	1	119.6274	0.041	9	119.2576	0.836	45	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6a]-3:N[6,6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6a]N[6,6])(C[6]C[6]H)(H)	C[6,6](C[6,6a]C[6,6a]C[6a])(N[6,6]B[6]C[6])(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]N[6,6])(C[6]C[6]H)(H){1|B<4>,1|H<1>,3|C<3>}	C[6,6](C[6,6a]C[6,6a]C[6a])(N[6,6]B[6]C[6])(C[6]C[6]H){2|Br<1>,1|C<4>,3|C<3>,3|H<1>}	H(C[6]C[6,6]C[6])	119.4140	0.000	1	119.6274	0.041	9	119.2576	0.836	45	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6a]-3:N[6,6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6a]N[6,6])(C[6]C[6]H)(H)	C[6,6](C[6,6a]C[6,6a]C[6a])(N[6,6]C[6,6a]C[6])(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]N[6,6])(C[6]C[6]H)(H){1|H<1>,4|C<3>}	C[6,6](C[6,6a]C[6,6a]C[6a])(N[6,6]C[6,6a]C[6])(C[6]C[6]H){3|H<1>,5|C<3>}	H(C[6]C[6,6]C[6])	119.0170	0.000	1	119.0170	0.000	1	119.2576	0.836	45	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6a]-3:N[6,6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6a]N[6,6])(C[6]C[6]H)(H)	C[6,6](C[6,6a]C[6,6a]C[6a])(N[6,6]C[6]2)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]N[6,6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,3|C<3>}	C[6,6](C[6,6a]C[6,6a]C[6a])(N[6,6]C[6]2)(C[6]C[6]H){1|C<4>,4|C<3>,4|H<1>}	H(C[6]C[6,6]C[6])	119.6470	0.000	1	119.6470	0.000	1	119.2576	0.836	45	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6a]-3:N[6,6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6a]N[6,6])(C[6]C[6]H)(H)	C[6,6](C[6,6a]C[6,6a]N[6a])(N[6,6]B[5,6]C[6])(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]N[6,6])(C[6]C[6]H)(H){1|B<4>,1|H<1>,1|N<2>,2|C<3>}	C[6,6](C[6,6a]C[6,6a]N[6a])(N[6,6]B[5,6]C[6])(C[6]C[6]H){2|C<4>,2|H<1>,4|C<3>}	H(C[6]C[6,6]C[6])	119.7760	0.000	1	119.7760	0.000	1	119.2576	0.836	45	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6a]-3:N[6,6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6a]N[6,6])(C[6]C[6]H)(H)	C[6,6](C[6,6a]C[6,6a]N[6a])(N[6,6]B[6]C[6])(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]N[6,6])(C[6]C[6]H)(H){1|B<4>,1|H<1>,1|N<2>,2|C<3>}	C[6,6](C[6,6a]C[6,6a]N[6a])(N[6,6]B[6]C[6])(C[6]C[6]H){1|C<4>,2|H<1>,5|C<3>}	H(C[6]C[6,6]C[6])	119.7490	0.000	1	119.7490	0.000	1	119.2576	0.836	45	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6a]-3:N[6,6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6a]N[6,6])(C[6]C[6a]O[6])(H)	C[6,6](C[6,6a]C[6,6a]C[6a])(N[6,6]B[6]C[6])(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]N[6,6])(C[6]C[6a]O[6])(H){1|B<4>,5|C<3>}	C[6,6](C[6,6a]C[6,6a]C[6a])(N[6,6]B[6]C[6])(C[6]C[6]H){1|O<2>,2|F<1>,2|H<1>,4|C<3>}	H(C[6]C[6,6]C[6])	118.6440	0.000	1	118.6440	0.000	1	119.2576	0.836	45	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6a]-3:N[6,6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6a]N[6,6])(C[6]C[6a]O[6])(H)	C[6,6](C[6,6a]C[6,6a]C[6a])(N[6,6]C[6,6a]B[6])(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]N[6,6])(C[6]C[6a]O[6])(H){1|B<4>,5|C<3>}	C[6,6](C[6,6a]C[6,6a]C[6a])(N[6,6]C[6,6a]B[6])(C[6]C[6]H){1|H<1>,1|O<2>,2|F<1>,5|C<3>}	H(C[6]C[6,6]C[6])	118.1800	0.073	3	118.1800	0.005	3	119.2576	0.836	45	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6,6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6]C[6,6a]C[6a])(C[6,6]C[6]P[6])(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|O<1>,1|P<4>,3|C<3>}	C[6,6](C[6]C[6,6a]C[6a])(C[6,6]C[6]P[6])(C[6]C[6]H){1|O<1>,2|H<1>,6|C<3>}	H(C[6]C[6,6]C[6])	118.8340	0.000	1	118.8340	0.000	1	119.3954	0.383	5	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6,6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6]C[6,6a]C[6a])(C[6,6]N[6]2)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){2|N<3>,3|C<3>}	C[6,6](C[6]C[6,6a]C[6a])(C[6,6]N[6]2)(C[6]C[6]H){1|Rh<4>,1|Rh<5>,1|H<1>,5|C<3>}	H(C[6]C[6,6]C[6])	119.6520	0.000	1	119.6520	0.000	1	119.3954	0.383	5	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6,6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6]C[6,6a]O)(C[6,6]C[6]2)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<4>,1|O<1>,1|O<2>,1|V<7>,2|C<3>}	C[6,6](C[6]C[6,6a]O)(C[6,6]C[6]2)(C[6]C[6]H){1|C<4>,1|H<1>,1|O<1>,1|O<2>,1|V<7>,2|C<3>}	H(C[6]C[6,6]C[6])	119.1800	0.000	1	119.0695	0.024	2	119.3954	0.383	5	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6,6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6]C[6,6a]O)(C[6,6]C[6]2)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|W<10>,1|C<4>,1|O<1>,1|O<2>,2|C<3>}	C[6,6](C[6]C[6,6a]O)(C[6,6]C[6]2)(C[6]C[6]H){1|W<10>,1|C<4>,1|H<1>,1|O<1>,1|O<2>,2|C<3>}	H(C[6]C[6,6]C[6])	118.9590	0.000	1	119.0695	0.024	2	119.3954	0.383	5	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6,6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]O[6]C)(H)	C[6,6](C[6]C[6,6a]O)(C[6,6]C[6]2)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]O[6]C)(H){1|C<4>,1|O<1>,2|C<3>}	C[6,6](C[6]C[6,6a]O)(C[6,6]C[6]2)(C[6]C[6]H){1|C<4>,1|H<1>,1|O<1>,2|C<3>,2|O<2>}	H(C[6]C[6,6]C[6])	120.3520	0.000	1	120.3520	0.000	1	119.3954	0.383	5	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:N[6,6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6]C[6,6]C[6])(N[6,6]B[6]C[6])(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H){1|B<4>,1|H<1>,3|C<3>}	C[6,6](C[6]C[6,6]C[6])(N[6,6]B[6]C[6])(C[6]C[6]H){1|N<3>,2|F<1>,2|H<1>,4|C<3>}	H(C[6]C[6,6]C[6])	119.5632	0.108	4	119.5632	0.012	4	119.5632	0.012	4	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[5a,6]-3:N[6,6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]N[5a,6]N[6,6])(C[6]C[6]H)(H)	C[6,6](N[5a,6]C[5a,6]C[5a])(N[6,6]C[6]2)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[5a,6]N[6,6])(C[6]C[6]H)(H){1|H<1>,4|C<3>}	C[6,6](N[5a,6]C[5a,6]C[5a])(N[6,6]C[6]2)(C[6]C[6]H){1|N<2>,3|H<1>,4|C<3>}	H(C[6]C[6,6]C[6])	120.5880	0.000	1	120.5880	0.000	1	120.1320	0.950	3	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[5a,6]-3:N[6,6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]N[5a,6]N[6,6])(C[6]C[6]H)(H)	C[6,6](N[5a,6]C[5a,6]N[5a])(N[6,6]B[6]C[6])(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[5a,6]N[6,6])(C[6]C[6]H)(H){1|B<4>,1|H<1>,1|N<2>,2|C<3>}	C[6,6](N[5a,6]C[5a,6]N[5a])(N[6,6]B[6]C[6])(C[6]C[6]H){1|O<2>,2|H<1>,5|C<3>}	H(C[6]C[6,6]C[6])	120.7950	0.000	1	120.7950	0.000	1	120.1320	0.950	3	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[5a,6]-3:N[6,6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]N[5a,6]N[6,6])(C[6]C[6]H)(H)	C[6,6](N[5a,6]C[5a,6a]C[5a,6])(N[6,6]C[6]2)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[5a,6]N[6,6])(C[6]C[6]H)(H){1|H<1>,4|C<3>}	C[6,6](N[5a,6]C[5a,6a]C[5a,6])(N[6,6]C[6]2)(C[6]C[6]H){2|H<1>,6|C<3>}	H(C[6]C[6,6]C[6])	119.0130	0.000	1	119.0130	0.000	1	120.1320	0.950	3	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6,6a]-3:C[6,6a]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6,6a]C[6,6a])(C[6]C[6a]C[6])(H)	C[6,6](N[6,6,6a]C[6,6a,6a]C[6,6a])(C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6,6a]C[6,6a])(C[6]C[6a]C[6])(H){1|H<1>,6|C<3>}	C[6,6](N[6,6,6a]C[6,6a,6a]C[6,6a])(C[6,6a]C[6,6a]C[6a])(C[6]C[6]H){1|H<1>,7|C<3>}	H(C[6]C[6,6]C[6])	119.2300	0.000	1	119.2300	0.000	1	119.2300	0.000	1	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:C[6,6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]N[6,6])(C[6]C[6,6a]H)(H)	C[6,6](N[6,6]C[6,6a]B[6])(C[6,6]C[6,6]C[6])(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]N[6,6])(C[6]C[6,6a]H)(H){1|B<4>,4|C<3>}	C[6,6](N[6,6]C[6,6a]B[6])(C[6,6]C[6,6]C[6])(C[6]C[6]H){1|H<1>,1|O<1>,1|O<2>,2|F<1>,4|C<3>}	H(C[6]C[6,6]C[6])	119.6010	0.115	2	119.6010	0.013	2	119.6010	0.013	2	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]C[6,6a]C)(H)	C[6,6](N[6,6]C[6,6a]B[6])(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]C[6,6a]C)(H){1|B<4>,1|H<1>,3|C<3>}	C[6,6](N[6,6]C[6,6a]B[6])(C[6]C[6]H)2{1|C<3>,1|N<2>,1|O<2>,2|C<4>,2|F<1>}	H(C[6]C[6,6]C[6])	118.9311	0.239	14	118.9311	0.057	14	119.4344	0.702	150	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]C[6,6a]H)(H)	C[6,6](N[6,6]C[6,6a]B[6])(C[6]C[5,6]H)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]C[6,6a]H)(H){1|B<4>,1|H<1>,3|C<3>}	C[6,6](N[6,6]C[6,6a]B[6])(C[6]C[5,6]H)(C[6]C[6]H){1|H<1>,1|N<3>,2|F<1>,3|C<3>}	H(C[6]C[6,6]C[6])	119.5430	0.000	1	119.5430	0.000	1	119.4344	0.702	150	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]C[6,6a]H)(H)	C[6,6](N[6,6]C[6,6a]B[6])(C[6]C[6,6]H)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]C[6,6a]H)(H){1|B<4>,1|H<1>,3|C<3>}	C[6,6](N[6,6]C[6,6a]B[6])(C[6]C[6,6]H)(C[6]C[6]H){1|H<1>,1|N<3>,2|F<1>,3|C<3>}	H(C[6]C[6,6]C[6])	116.6570	0.392	2	116.6570	0.153	2	119.4344	0.702	150	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]C[6,6a]H)(H)	C[6,6](N[6,6]C[6,6a]B[6])(C[6]C[6]H)(C[6]N[6]C)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]C[6,6a]H)(H){1|B<4>,1|C<2>,1|N<2>,2|C<3>}	C[6,6](N[6,6]C[6,6a]B[6])(C[6]C[6]H)(C[6]N[6]C){1|H<1>,1|N<3>,2|C<3>,2|F<1>}	H(C[6]C[6,6]C[6])	120.0850	0.000	1	120.0850	0.000	1	119.4344	0.702	150	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]C[6,6a]H)(H)	C[6,6](N[6,6]C[6,6a]B[6])(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]C[6,6a]H)(H){1|B<4>,1|H<1>,3|C<3>}	C[6,6](N[6,6]C[6,6a]B[6])(C[6]C[6]H)2{1|H<1>,1|O<2>,2|F<1>,3|C<3>}	H(C[6]C[6,6]C[6])	119.7173	0.151	6	119.7173	0.023	6	119.4344	0.702	150	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](N[6,6]B[3x6]C[6])(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H){1|B<4>,2|C<3>,2|H<1>}	C[6,6](N[6,6]B[3x6]C[6])(C[6]C[6]H)2{1|C<3>,1|O<2>,2|H<1>,3|C<4>}	H(C[6]C[6,6]C[6])	119.6720	0.000	1	119.6720	0.000	1	119.4344	0.702	150	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](N[6,6]B[5a,6]C[6])(C[6]C[6a]C[6])(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H){1|B<4>,1|H<1>,3|C<3>}	C[6,6](N[6,6]B[5a,6]C[6])(C[6]C[6a]C[6])(C[6]C[6]H){2|H<1>,3|O<2>,4|C<3>}	H(C[6]C[6,6]C[6])	119.4100	0.205	3	119.4100	0.042	3	119.4344	0.702	150	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](N[6,6]B[6,6a]C[6])(C[6]C[6a]C[6])(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H){1|B<4>,1|H<1>,3|C<3>}	C[6,6](N[6,6]B[6,6a]C[6])(C[6]C[6a]C[6])(C[6]C[6]H){2|H<1>,3|O<2>,4|C<3>}	H(C[6]C[6,6]C[6])	119.5950	0.134	3	119.5950	0.018	3	119.4344	0.702	150	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](N[6,6]B[6]C[6])(C[6]C[5,6]C)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H){1|B<4>,1|C<2>,1|H<1>,2|C<3>}	C[6,6](N[6,6]B[6]C[6])(C[6]C[5,6]C)(C[6]C[6]H){1|N<3>,2|C<3>,2|F<1>,2|H<1>}	H(C[6]C[6,6]C[6])	119.9540	0.285	4	119.9540	0.081	4	119.4344	0.702	150	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](N[6,6]B[6]C[6])(C[6]C[5,6]H)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H){1|B<4>,1|H<1>,3|C<3>}	C[6,6](N[6,6]B[6]C[6])(C[6]C[5,6]H)(C[6]C[6]H){1|N<3>,2|C<3>,2|F<1>,2|H<1>}	H(C[6]C[6,6]C[6])	119.5660	0.000	1	119.8013	0.047	3	119.4344	0.702	150	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](N[6,6]B[6]C[6])(C[6]C[5,6]H)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H){1|B<4>,2|C<3>,2|H<1>}	C[6,6](N[6,6]B[6]C[6])(C[6]C[5,6]H)(C[6]C[6]H){1|N<3>,2|C<3>,2|F<1>,2|H<1>}	H(C[6]C[6,6]C[6])	119.9190	0.102	2	119.8013	0.047	3	119.4344	0.702	150	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](N[6,6]B[6]C[6])(C[6]C[5a,6]C)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H){1|B<4>,1|C<2>,1|H<1>,2|C<3>}	C[6,6](N[6,6]B[6]C[6])(C[6]C[5a,6]C)(C[6]C[6]H){1|N<3>,2|C<3>,2|F<1>,2|H<1>}	H(C[6]C[6,6]C[6])	119.7835	0.074	2	119.7835	0.006	2	119.4344	0.702	150	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](N[6,6]B[6]C[6])(C[6]C[6,6]C)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H){1|B<4>,1|C<2>,1|H<1>,2|C<3>}	C[6,6](N[6,6]B[6]C[6])(C[6]C[6,6]C)(C[6]C[6]H){1|N<3>,2|C<3>,2|F<1>,2|H<1>}	H(C[6]C[6,6]C[6])	119.5653	0.045	3	119.5653	0.002	3	119.4344	0.702	150	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](N[6,6]B[6]C[6])(C[6]C[6,6]H)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H){1|B<4>,2|C<3>,2|H<1>}	C[6,6](N[6,6]B[6]C[6])(C[6]C[6,6]H)(C[6]C[6]H){1|N<3>,2|C<3>,2|F<1>,2|H<1>}	H(C[6]C[6,6]C[6])	119.5970	0.000	1	119.5970	0.000	1	119.4344	0.702	150	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](N[6,6]B[6]C[6])(C[6]C[6]H)(C[6]N[6]C)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H){1|B<4>,1|C<2>,1|C<3>,1|H<1>,1|N<2>}	C[6,6](N[6,6]B[6]C[6])(C[6]C[6]H)(C[6]N[6]C){1|C<3>,1|N<3>,2|F<1>,2|H<1>}	H(C[6]C[6,6]C[6])	120.0825	0.054	2	119.6086	0.697	5	119.4344	0.702	150	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](N[6,6]B[6]C[6])(C[6]C[6]H)(C[6]N[6]C)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|C<4>,1|H<1>,1|N<2>}	C[6,6](N[6,6]B[6]C[6])(C[6]C[6]H)(C[6]N[6]C){1|C<3>,1|N<3>,2|F<1>,2|H<1>}	H(C[6]C[6,6]C[6])	118.1280	0.000	1	119.6086	0.697	5	119.4344	0.702	150	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](N[6,6]B[6]C[6])(C[6]C[6]H)(C[6]N[6]C)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H){1|B<4>,1|H<1>,1|N<2>,2|C<3>}	C[6,6](N[6,6]B[6]C[6])(C[6]C[6]H)(C[6]N[6]C){1|C<3>,1|N<3>,2|F<1>,2|H<1>}	H(C[6]C[6,6]C[6])	119.8750	0.048	2	119.6086	0.697	5	119.4344	0.702	150	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](N[6,6]B[6]C[6])(C[6]C[6]H)(C[6]N[6]O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>,1|N<3>,1|O<1>}	C[6,6](N[6,6]B[6]C[6])(C[6]C[6]H)(C[6]N[6]O){1|C<4>,1|F<1>,1|O<2>,2|C<3>,2|H<1>}	H(C[6]C[6,6]C[6])	120.3630	0.000	1	120.3630	0.000	1	119.4344	0.702	150	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](N[6,6]B[6]C[6])(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H){1|B<4>,2|C<3>,2|H<1>}	C[6,6](N[6,6]B[6]C[6])(C[6]C[6]H)2{1|C<4>,1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6,6]C[6])	119.7940	0.000	1	119.6800	0.070	12	119.4344	0.702	150	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](N[6,6]B[6]C[6])(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H){1|B<4>,2|C<3>,2|H<1>}	C[6,6](N[6,6]B[6]C[6])(C[6]C[6]H)2{1|C<4>,1|O<2>,2|H<1>,3|C<3>}	H(C[6]C[6,6]C[6])	119.7560	0.000	1	119.6800	0.070	12	119.4344	0.702	150	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](N[6,6]B[6]C[6])(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H){1|B<4>,2|C<3>,2|H<1>}	C[6,6](N[6,6]B[6]C[6])(C[6]C[6]H)2{1|N<3>,2|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6,6]C[6])	119.2900	0.000	1	119.6800	0.070	12	119.4344	0.702	150	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](N[6,6]B[6]C[6])(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H){1|B<4>,2|C<3>,2|H<1>}	C[6,6](N[6,6]B[6]C[6])(C[6]C[6]H)2{1|N<3>,2|C<3>,2|F<1>,2|H<1>}	H(C[6]C[6,6]C[6])	120.1120	0.000	1	119.6800	0.070	12	119.4344	0.702	150	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](N[6,6]B[6]C[6])(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H){1|B<4>,2|C<3>,2|H<1>}	C[6,6](N[6,6]B[6]C[6])(C[6]C[6]H)2{1|N<3>,2|H<1>,4|C<3>}	H(C[6]C[6,6]C[6])	119.4980	0.136	2	119.6800	0.070	12	119.4344	0.702	150	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](N[6,6]B[6]C[6])(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H){1|B<4>,2|C<3>,2|H<1>}	C[6,6](N[6,6]B[6]C[6])(C[6]C[6]H)2{1|O<2>,2|C<3>,2|F<1>,2|H<1>}	H(C[6]C[6,6]C[6])	119.7020	0.255	6	119.6800	0.070	12	119.4344	0.702	150	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](N[6,6]B[6]C[6])(C[6]C[6a]C[6])(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H){1|B<4>,1|H<1>,3|C<3>}	C[6,6](N[6,6]B[6]C[6])(C[6]C[6a]C[6])(C[6]C[6]H){1|N<3>,2|F<1>,2|H<1>,4|C<3>}	H(C[6]C[6,6]C[6])	119.6120	0.258	3	119.4403	0.073	6	119.4344	0.702	150	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](N[6,6]B[6]C[6])(C[6]C[6a]C[6])(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H){1|B<4>,1|H<1>,3|C<3>}	C[6,6](N[6,6]B[6]C[6])(C[6]C[6a]C[6])(C[6]C[6]H){1|N<3>,2|H<1>,6|C<3>}	H(C[6]C[6,6]C[6])	119.2530	0.000	1	119.4403	0.073	6	119.4344	0.702	150	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](N[6,6]B[6]C[6])(C[6]C[6a]C[6])(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H){1|B<4>,1|H<1>,3|C<3>}	C[6,6](N[6,6]B[6]C[6])(C[6]C[6a]C[6])(C[6]C[6]H){1|O<2>,2|F<1>,2|H<1>,4|C<3>}	H(C[6]C[6,6]C[6])	119.4420	0.000	1	119.4403	0.073	6	119.4344	0.702	150	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](N[6,6]B[6]C[6])(C[6]C[6a]C[6])(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H){1|B<4>,1|H<1>,3|C<3>}	C[6,6](N[6,6]B[6]C[6])(C[6]C[6a]C[6])(C[6]C[6]H){1|O<2>,2|H<1>,6|C<3>}	H(C[6]C[6,6]C[6])	119.1110	0.000	1	119.4403	0.073	6	119.4344	0.702	150	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](N[6,6]C[6,6]C[6])(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H){1|C<4>,2|C<3>,2|H<1>}	C[6,6](N[6,6]C[6,6]C[6])(C[6]C[6]H)2{2|H<1>,5|C<3>}	H(C[6]C[6,6]C[6])	119.3920	0.000	1	119.3920	0.000	1	119.4344	0.702	150	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](N[6,6]C[6,6a]C[6])(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H){1|N<2>,2|C<3>,2|H<1>}	C[6,6](N[6,6]C[6,6a]C[6])(C[6]C[6]H)(C[6]N[6]H){2|H<1>,3|C<3>}	H(C[6]C[6,6]C[6])	119.5500	0.000	1	119.5500	0.000	1	119.4344	0.702	150	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](N[6,6]Ge[6]C[6])(C[6]C[6]Si)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H){1|Ge<4>,1|Si<4>,1|H<1>,2|C<3>}	C[6,6](N[6,6]Ge[6]C[6])(C[6]C[6]Si)(C[6]C[6]H){1|B<4>,1|N<3>,2|C<3>,3|H<1>}	H(C[6]C[6,6]C[6])	119.1840	0.000	1	119.5618	0.101	4	119.4344	0.702	150	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](N[6,6]Ge[6]C[6])(C[6]C[6]Si)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H){1|Ge<4>,1|Si<4>,1|H<1>,2|C<3>}	C[6,6](N[6,6]Ge[6]C[6])(C[6]C[6]Si)(C[6]C[6]H){1|Cl<1>,1|B<4>,1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6,6]C[6])	119.5130	0.000	1	119.5618	0.101	4	119.4344	0.702	150	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](N[6,6]Ge[6]C[6])(C[6]C[6]Si)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H){1|Ge<4>,1|Si<4>,1|H<1>,2|C<3>}	C[6,6](N[6,6]Ge[6]C[6])(C[6]C[6]Si)(C[6]C[6]H){1|Cl<1>,1|Cu<4>,1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6,6]C[6])	119.9580	0.000	1	119.5618	0.101	4	119.4344	0.702	150	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](N[6,6]Ge[6]C[6])(C[6]C[6]Si)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H){1|Ge<4>,1|Si<4>,1|H<1>,2|C<3>}	C[6,6](N[6,6]Ge[6]C[6])(C[6]C[6]Si)(C[6]C[6]H){1|Fe<5>,1|Ge<3>,1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6,6]C[6])	119.5920	0.000	1	119.5618	0.101	4	119.4344	0.702	150	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](N[6,6]Nb[6]C[6])(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H){1|Nb<6>,2|C<3>,2|H<1>}	C[6,6](N[6,6]Nb[6]C[6])(C[6]C[6]H)2{1|C<3>,1|C<4>,2|H<1>,5|O<2>}	H(C[6]C[6,6]C[6])	119.5670	0.000	1	119.5670	0.000	1	119.4344	0.702	150	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]C[6a]C[6])(H)	C[6,6](N[6,6]C[6,6]C[6])(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]C[6a]C[6])(H){1|C<4>,1|H<1>,1|O<1>,4|C<3>}	C[6,6](N[6,6]C[6,6]C[6])(C[6]C[6]H)2{2|H<1>,5|C<3>}	H(C[6]C[6,6]C[6])	117.4230	0.000	1	117.4230	0.000	1	119.4344	0.702	150	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]C[6a]N[6])(H)	C[6,6](N[6,6]B[6]C[6])(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]C[6a]N[6])(H){1|B<4>,1|H<1>,5|C<3>}	C[6,6](N[6,6]B[6]C[6])(C[6]C[6]H)2{1|N<3>,2|C<3>,2|F<1>,2|H<1>}	H(C[6]C[6,6]C[6])	118.6090	0.000	1	118.9437	0.050	4	119.4344	0.702	150	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]C[6a]N[6])(H)	C[6,6](N[6,6]B[6]C[6])(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]C[6a]N[6])(H){1|B<4>,2|H<1>,4|C<3>}	C[6,6](N[6,6]B[6]C[6])(C[6]C[6]H)2{1|N<3>,2|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6,6]C[6])	119.0500	0.000	1	118.9437	0.050	4	119.4344	0.702	150	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]C[6a]N[6])(H)	C[6,6](N[6,6]B[6]C[6])(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]C[6a]N[6])(H){1|B<4>,2|H<1>,4|C<3>}	C[6,6](N[6,6]B[6]C[6])(C[6]C[6]H)2{1|N<3>,2|H<1>,4|C<3>}	H(C[6]C[6,6]C[6])	119.0580	0.027	2	118.9437	0.050	4	119.4344	0.702	150	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]C[6a]O[6])(H)	C[6,6](N[6,6]B[6]C[6])(C[6]C[6,6]H)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]C[6a]O[6])(H){1|B<4>,1|H<1>,4|C<3>}	C[6,6](N[6,6]B[6]C[6])(C[6]C[6,6]H)(C[6]C[6]H){1|H<1>,1|N<3>,1|O<2>,2|C<3>,2|F<1>}	H(C[6]C[6,6]C[6])	118.8170	0.000	1	118.8170	0.000	1	119.4344	0.702	150	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]C[6a]O[6])(H)	C[6,6](N[6,6]B[6]C[6])(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]C[6a]O[6])(H){1|B<4>,1|H<1>,1|N<2>,3|C<3>}	C[6,6](N[6,6]B[6]C[6])(C[6]C[6]H)(C[6]N[6]H){1|H<1>,1|O<2>,2|C<3>,2|F<1>}	H(C[6]C[6,6]C[6])	119.2690	0.031	2	118.4850	0.820	4	119.4344	0.702	150	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]C[6a]O[6])(H)	C[6,6](N[6,6]B[6]C[6])(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]C[6a]O[6])(H){1|B<4>,1|H<1>,1|N<2>,3|C<3>}	C[6,6](N[6,6]B[6]C[6])(C[6]C[6]H)(C[6]N[6]H){1|H<1>,1|O<2>,4|C<3>}	H(C[6]C[6,6]C[6])	117.7010	0.003	2	118.4850	0.820	4	119.4344	0.702	150	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]C[6a]O[6])(H)	C[6,6](N[6,6]B[6]C[6])(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]C[6a]O[6])(H){1|B<4>,1|H<1>,4|C<3>}	C[6,6](N[6,6]B[6]C[6])(C[6]C[6]H)2{1|Cl<1>,1|C<3>,1|H<1>,1|N<2>,1|O<2>,2|F<1>}	H(C[6]C[6,6]C[6])	119.1562	0.263	4	118.9668	0.132	15	119.4344	0.702	150	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]C[6a]O[6])(H)	C[6,6](N[6,6]B[6]C[6])(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]C[6a]O[6])(H){1|B<4>,1|H<1>,4|C<3>}	C[6,6](N[6,6]B[6]C[6])(C[6]C[6]H)2{1|Cl<1>,1|H<1>,1|N<2>,1|O<2>,3|C<3>}	H(C[6]C[6,6]C[6])	119.2548	0.168	5	118.9668	0.132	15	119.4344	0.702	150	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]C[6a]O[6])(H)	C[6,6](N[6,6]B[6]C[6])(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]C[6a]O[6])(H){1|B<4>,1|H<1>,4|C<3>}	C[6,6](N[6,6]B[6]C[6])(C[6]C[6]H)2{1|O<2>,2|C<3>,2|F<1>,2|H<1>}	H(C[6]C[6,6]C[6])	118.6005	0.185	6	118.9668	0.132	15	119.4344	0.702	150	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]C[6a]O[6])(H)	C[6,6](N[6,6]C[6,6a]B[6])(C[6]C[6]H)(C[6]N[6]C)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]C[6a]O[6])(H){1|B<4>,1|C<4>,1|N<2>,3|C<3>}	C[6,6](N[6,6]C[6,6a]B[6])(C[6]C[6]H)(C[6]N[6]C){1|O<2>,2|F<1>,3|C<3>}	H(C[6]C[6,6]C[6])	119.1095	0.185	2	119.1095	0.034	2	119.4344	0.702	150	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]C[6a]O[6])(H)	C[6,6](N[6,6]C[6,6a]B[6])(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]C[6a]O[6])(H){1|B<4>,1|H<1>,1|N<2>,3|C<3>}	C[6,6](N[6,6]C[6,6a]B[6])(C[6]C[6]H)(C[6]N[6]H){1|O<2>,2|F<1>,3|C<3>}	H(C[6]C[6,6]C[6])	119.2275	0.039	2	119.2275	0.002	2	119.4344	0.702	150	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]C[6a]O[6])(H)	C[6,6](N[6,6]C[6,6a]B[6])(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]C[6a]O[6])(H){1|B<4>,1|H<1>,4|C<3>}	C[6,6](N[6,6]C[6,6a]B[6])(C[6]C[6]H)2{1|H<1>,1|O<2>,2|F<1>,3|C<3>}	H(C[6]C[6,6]C[6])	118.8862	0.184	6	118.8862	0.034	6	119.4344	0.702	150	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]C[6a]O[6])(H)	C[6,6](N[6,6]C[6,6a]B[6])(C[6]C[6a]N[6])(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]C[6a]O[6])(H){1|B<4>,1|N<2>,4|C<3>}	C[6,6](N[6,6]C[6,6a]B[6])(C[6]C[6a]N[6])(C[6]C[6]H){1|O<2>,2|F<1>,5|C<3>}	H(C[6]C[6,6]C[6])	118.8405	0.211	2	118.8405	0.045	2	119.4344	0.702	150	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]N[6]C)(H)	C[6,6](N[6,6]B[6]C[6])(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]N[6]C)(H){1|B<4>,2|C<3>,2|H<1>}	C[6,6](N[6,6]B[6]C[6])(C[6]C[6]H)2{1|C<4>,1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6,6]C[6])	119.4490	0.000	1	119.4490	0.000	1	119.4344	0.702	150	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]N[6]Cl)(H)	C[6,6](N[6,6]B[6]C[6])(C[6]C[5,6]C)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]N[6]Cl)(H){1|B<4>,1|C<2>,2|C<3>}	C[6,6](N[6,6]B[6]C[6])(C[6]C[5,6]C)(C[6]C[6]H){1|Cl<1>,1|H<1>,1|N<2>,1|N<3>,1|S<2>,2|F<1>}	H(C[6]C[6,6]C[6])	120.9995	0.093	2	120.9995	0.009	2	119.4344	0.702	150	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]N[6]Cl)(H)	C[6,6](N[6,6]B[6]C[6])(C[6]C[6,6]C)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]N[6]Cl)(H){1|B<4>,1|C<2>,2|C<3>}	C[6,6](N[6,6]B[6]C[6])(C[6]C[6,6]C)(C[6]C[6]H){1|Cl<1>,1|C<3>,1|H<1>,1|N<2>,1|N<3>,2|F<1>}	H(C[6]C[6,6]C[6])	121.0730	0.000	1	121.0730	0.000	1	119.4344	0.702	150	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]N[6]Cl)(H)	C[6,6](N[6,6]B[6]C[6])(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]N[6]Cl)(H){1|B<4>,1|H<1>,2|C<3>}	C[6,6](N[6,6]B[6]C[6])(C[6]C[6]H)2{1|Cl<1>,1|C<3>,1|H<1>,1|N<2>,1|O<2>,2|F<1>}	H(C[6]C[6,6]C[6])	121.2060	0.205	4	121.1450	0.036	9	119.4344	0.702	150	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]N[6]Cl)(H)	C[6,6](N[6,6]B[6]C[6])(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]N[6]Cl)(H){1|B<4>,1|H<1>,2|C<3>}	C[6,6](N[6,6]B[6]C[6])(C[6]C[6]H)2{1|Cl<1>,1|H<1>,1|N<2>,1|O<2>,3|C<3>}	H(C[6]C[6,6]C[6])	121.0962	0.184	5	121.1450	0.036	9	119.4344	0.702	150	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]N[6]Cl)(H)	C[6,6](N[6,6]B[6]C[6])(C[6]C[6a]C[6])(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]N[6]Cl)(H){1|B<4>,3|C<3>}	C[6,6](N[6,6]B[6]C[6])(C[6]C[6a]C[6])(C[6]C[6]H){1|Cl<1>,1|H<1>,1|N<2>,1|O<2>,2|F<1>,3|C<3>}	H(C[6]C[6,6]C[6])	120.4150	0.000	1	120.4150	0.000	1	119.4344	0.702	150	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]N[6]H)(H)	C[6,6](N[6,6]B[6]C[6])(C[6]C[5,6]C)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]N[6]H)(H){1|B<4>,1|C<2>,2|C<3>}	C[6,6](N[6,6]B[6]C[6])(C[6]C[5,6]C)(C[6]C[6]H){1|H<1>,1|N<2>,1|N<3>,1|O<2>,1|S<2>,2|F<1>}	H(C[6]C[6,6]C[6])	120.2900	0.000	1	120.9490	0.869	2	119.4344	0.702	150	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]N[6]H)(H)	C[6,6](N[6,6]B[6]C[6])(C[6]C[5,6]C)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]N[6]H)(H){1|B<4>,1|C<2>,2|C<3>}	C[6,6](N[6,6]B[6]C[6])(C[6]C[5,6]C)(C[6]C[6]H){1|H<1>,1|N<2>,1|S<2>,2|F<1>,2|N<3>}	H(C[6]C[6,6]C[6])	121.6080	0.000	1	120.9490	0.869	2	119.4344	0.702	150	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]N[6]N)(H)	C[6,6](N[6,6]B[6]C[6])(C[6]C[5,6]C)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]N[6]N)(H){1|B<4>,1|C<2>,2|C<3>}	C[6,6](N[6,6]B[6]C[6])(C[6]C[5,6]C)(C[6]C[6]H){1|H<1>,1|N<2>,1|S<2>,2|F<1>,2|N<3>}	H(C[6]C[6,6]C[6])	119.9500	0.000	1	119.9500	0.000	1	119.4344	0.702	150	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]N[6]N)(H)	C[6,6](N[6,6]B[6]C[6])(C[6]C[6,6]C)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]N[6]N)(H){1|B<4>,1|C<2>,2|C<3>}	C[6,6](N[6,6]B[6]C[6])(C[6]C[6,6]C)(C[6]C[6]H){1|C<3>,1|H<1>,1|N<2>,2|F<1>,2|N<3>}	H(C[6]C[6,6]C[6])	120.1360	0.000	1	120.1360	0.000	1	119.4344	0.702	150	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]N[6]N)(H)	C[6,6](N[6,6]B[6]C[6])(C[6]C[6a]C[6])(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]N[6]N)(H){1|B<4>,3|C<3>}	C[6,6](N[6,6]B[6]C[6])(C[6]C[6a]C[6])(C[6]C[6]H){1|H<1>,1|N<2>,1|N<3>,1|O<2>,2|F<1>,3|C<3>}	H(C[6]C[6,6]C[6])	119.7900	0.000	1	119.7900	0.000	1	119.4344	0.702	150	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]N[6]O)(H)	C[6,6](N[6,6]B[6]C[6])(C[6]C[5,6]C)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]N[6]O)(H){1|B<4>,1|C<2>,2|C<3>}	C[6,6](N[6,6]B[6]C[6])(C[6]C[5,6]C)(C[6]C[6]H){1|H<1>,1|N<2>,1|N<3>,1|O<2>,1|S<2>,2|F<1>}	H(C[6]C[6,6]C[6])	120.3620	0.000	1	120.3620	0.000	1	119.4344	0.702	150	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]N[6]O)(H)	C[6,6](N[6,6]B[6]C[6])(C[6]C[6,6]C)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]N[6]O)(H){1|B<4>,1|C<2>,2|C<3>}	C[6,6](N[6,6]B[6]C[6])(C[6]C[6,6]C)(C[6]C[6]H){1|C<3>,1|H<1>,1|N<2>,1|N<3>,1|O<2>,2|F<1>}	H(C[6]C[6,6]C[6])	120.4075	0.046	2	120.4075	0.002	2	119.4344	0.702	150	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]N[6]O)(H)	C[6,6](N[6,6]B[6]C[6])(C[6]C[6a]C[6])(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]N[6]O)(H){1|B<4>,3|C<3>}	C[6,6](N[6,6]B[6]C[6])(C[6]C[6a]C[6])(C[6]C[6]H){1|H<1>,1|N<2>,2|F<1>,2|O<2>,3|C<3>}	H(C[6]C[6,6]C[6])	120.3770	0.000	1	120.3770	0.000	1	119.4344	0.702	150	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]O[6]C)(H)	C[6,6](N[6,6]B[3x6]C[6])(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]O[6]C)(H){1|B<4>,1|H<1>,2|C<3>}	C[6,6](N[6,6]B[3x6]C[6])(C[6]C[6]H)2{1|C<3>,1|O<2>,2|H<1>,3|C<4>}	H(C[6]C[6,6]C[6])	119.4080	0.000	1	119.4080	0.000	1	119.4344	0.702	150	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]O[6]C)(H)	C[6,6](N[6,6]B[6]C[6])(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]O[6]C)(H){1|B<4>,1|H<1>,2|C<3>}	C[6,6](N[6,6]B[6]C[6])(C[6]C[6]H)2{1|C<4>,1|O<2>,2|H<1>,3|C<3>}	H(C[6]C[6,6]C[6])	119.2840	0.000	1	119.2840	0.000	1	119.4344	0.702	150	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]O[6]C)(H)	C[6,6](N[6,6]C[6,6a]B[6])(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]O[6]C)(H){1|B<4>,1|H<1>,2|C<3>}	C[6,6](N[6,6]C[6,6a]B[6])(C[6]C[6]H)2{1|C<3>,1|N<2>,1|O<2>,2|C<4>,2|F<1>}	H(C[6]C[6,6]C[6])	118.9038	0.219	12	118.9038	0.048	12	119.4344	0.702	150	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]O[6]C)(H)	C[6,6](N[6,6]Nb[6]C[6])(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]O[6]C)(H){1|Nb<6>,1|H<1>,2|C<3>}	C[6,6](N[6,6]Nb[6]C[6])(C[6]C[6]H)2{1|C<3>,1|C<4>,2|H<1>,5|O<2>}	H(C[6]C[6,6]C[6])	116.9120	0.000	1	116.9120	0.000	1	119.4344	0.702	150	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(H)	C[6,6](N[6,6]C[6]2)(C[6]C[6]H)(N[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6,6](N[6,6]C[6]2)(C[6]C[6]H)(N[6]C[6]H){1|C<4>,2|C<3>,5|H<1>}	H(C[6]C[6,6]C[6])	120.0490	0.000	1	118.4535	5.091	2	118.4535	5.091	2	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(H)	C[6,6](N[6,6]C[6]2)(C[6]C[6]H)(N[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6,6](N[6,6]C[6]2)(C[6]C[6]H)(N[6]C[6]H){1|O<2>,2|C<3>,2|H<1>,3|C<4>}	H(C[6]C[6,6]C[6])	116.8580	0.000	1	118.4535	5.091	2	118.4535	5.091	2	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(H)	C[6,6](N[6,6]B[6]C[6])(N[6]C[6,6a]H)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(H){1|B<4>,2|C<3>,2|H<1>}	C[6,6](N[6,6]B[6]C[6])(N[6]C[6,6a]H)(C[6]C[6]H){1|F<1>,2|H<1>,4|C<3>}	H(C[6]C[6,6]C[6])	120.0820	0.000	1	119.8165	0.141	2	119.8867	0.097	4	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(H)	C[6,6](N[6,6]B[6]C[6])(N[6]C[6,6a]H)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(H){1|B<4>,2|C<3>,2|H<1>}	C[6,6](N[6,6]B[6]C[6])(N[6]C[6,6a]H)(C[6]C[6]H){2|H<1>,5|C<3>}	H(C[6]C[6,6]C[6])	119.5510	0.000	1	119.8165	0.141	2	119.8867	0.097	4	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(H)	C[6,6](N[6,6]In[6]C[6])(N[6]C[6,6]H)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(H){1|In<6>,2|C<3>,2|H<1>}	C[6,6](N[6,6]In[6]C[6])(N[6]C[6,6]H)(C[6]C[6]H){3|Cl<1>,1|N<3>,1|O<2>,2|C<3>,2|H<1>}	H(C[6]C[6,6]C[6])	119.9570	0.362	2	119.9570	0.131	2	119.8867	0.097	4	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[6]-3:C[6,6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]N[6])(C[6]C[6a]N[6])(H)	C[6,6](N[6]C[6,6a]H)(C[6,6]C[6]2)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]N[6])(C[6]C[6a]N[6])(H){1|Ru<6>,1|C<4>,1|H<1>,4|C<3>}	C[6,6](N[6]C[6,6a]H)(C[6,6]C[6]2)(C[6]C[6]H){1|N<3>,3|C<3>,3|H<1>}	H(C[6]C[6,6]C[6])	120.3850	0.000	1	120.3850	0.000	1	120.3850	0.000	1	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:N[6,6]-3:H-1:	C[6,6a]-3:N[6,6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6a]N[6,6])(N[6,6]B[3x6]C[6,6])(H)	C[6,6](C[6,6a]C[6,6a]C[6a])(N[6,6]B[3x6]C[6])(C[6]N[6,6]H)	H(C[6]C[6,6]N[6,6])	C[6](C[6,6]C[6,6a]N[6,6])(N[6,6]B[3x6]C[6,6])(H){1|B<4>,3|C<4>,4|C<3>}	C[6,6](C[6,6a]C[6,6a]C[6a])(N[6,6]B[3x6]C[6])(C[6]N[6,6]H){1|B<4>,2|H<1>,3|C<3>,3|C<4>}	H(C[6]C[6,6]N[6,6])	118.0250	0.000	1	118.0250	0.000	1	118.1042	0.022	5	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:N[6,6]-3:H-1:	C[6,6a]-3:N[6,6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6a]N[6,6])(N[6,6]C[6,6]B[6])(H)	C[6,6](C[6,6a]C[6,6a]C[6a])(N[6,6]B[6]C[6])(C[6]N[6,6]H)	H(C[6]C[6,6]N[6,6])	C[6](C[6,6]C[6,6a]N[6,6])(N[6,6]C[6,6]B[6])(H){1|B<4>,1|C<4>,6|C<3>}	C[6,6](C[6,6a]C[6,6a]C[6a])(N[6,6]B[6]C[6])(C[6]N[6,6]H){1|B<4>,1|C<4>,2|H<1>,5|C<3>}	H(C[6]C[6,6]N[6,6])	118.1240	0.165	4	118.1240	0.027	4	118.1042	0.022	5	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:N[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(N[6]B[6]C)(H)	C[6,6](C[6,6]C[6]O[6])(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6,6]N[6])	C[6](C[6,6]C[6,6]C[6])(N[6]B[6]C)(H){1|C<2>,1|C<3>,1|C<4>,1|F<1>,1|H<1>,1|O<2>}	C[6,6](C[6,6]C[6]O[6])(C[6]C[6]H)(C[6]N[6]H){1|B<4>,1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6,6]N[6])	118.9820	0.000	1	118.9820	0.000	1	118.0031	0.622	11	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:N[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(N[6]C[5,6]C)(H)	C[6,6](C[6,6]C[6]2)(C[6]C[6]O)(C[6]N[6]H)	H(C[6]C[6,6]N[6])	C[6](C[6,6]C[6,6]C[6])(N[6]C[5,6]C)(H){1|C<3>,1|O<1>,1|O<2>,3|C<4>}	C[6,6](C[6,6]C[6]2)(C[6]C[6]O)(C[6]N[6]H){1|Cl<1>,1|C<3>,1|H<1>,2|O<2>,3|C<4>}	H(C[6]C[6,6]N[6])	117.7516	0.707	8	117.7516	0.500	8	118.0031	0.622	11	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:N[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(N[6]C[6]H)(H)	C[6,6](C[6,6]C[6]2)(C[6]C[6]O)(C[6]N[6]H)	H(C[6]C[6,6]N[6])	C[6](C[6,6]C[6,6]C[6])(N[6]C[6]H)(H){1|C<4>,1|O<1>,3|C<3>}	C[6,6](C[6,6]C[6]2)(C[6]C[6]O)(C[6]N[6]H){1|Cl<1>,1|C<4>,1|O<2>,2|C<3>,2|H<1>}	H(C[6]C[6,6]N[6])	119.1210	0.000	1	118.5195	0.724	2	118.0031	0.622	11	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:N[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(N[6]C[6]H)(H)	C[6,6](C[6,6]C[6]2)(C[6]C[6]O)(C[6]N[6]H)	H(C[6]C[6,6]N[6])	C[6](C[6,6]C[6,6]C[6])(N[6]C[6]H)(H){1|H<1>,1|O<2>,2|C<3>,2|C<4>}	C[6,6](C[6,6]C[6]2)(C[6]C[6]O)(C[6]N[6]H){2|C<3>,2|H<1>,3|C<4>}	H(C[6]C[6,6]N[6])	117.9180	0.000	1	118.5195	0.724	2	118.0031	0.622	11	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6a]-3:C[6,6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6,6]C[6])(H)	C[6,6](C[6,6]C[6]O[6])(C[6]C[6,6a]H)(C[6]C[6]O)	H(C[6]C[6,6a]C[6,6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6,6]C[6])(H){1|C<4>,1|H<1>,1|N<2>,1|O<1>,1|O<2>,2|C<3>}	C[6,6](C[6,6]C[6]O[6])(C[6]C[6,6a]H)(C[6]C[6]O){1|C<4>,2|C<3>,3|H<1>}	H(C[6]C[6,6a]C[6,6])	119.9650	0.000	1	119.8080	0.049	2	119.8080	0.049	2	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6a]-3:C[6,6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6,6]C[6])(H)	C[6,6](C[6,6]C[6]O[6])(C[6]C[6,6a]H)(C[6]C[6]O)	H(C[6]C[6,6a]C[6,6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6,6]C[6])(H){1|C<4>,1|H<1>,1|O<1>,1|O<2>,3|C<3>}	C[6,6](C[6,6]C[6]O[6])(C[6]C[6,6a]H)(C[6]C[6]O){2|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6,6a]C[6,6])	119.6510	0.000	1	119.8080	0.049	2	119.8080	0.049	2	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:3:	3:	C[6,6a]-3:C[6,6]-3:H-1:	C[6]-3:N[6,6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6,6]N[6,6]C[6])(H)	C[6,6](C[6]C[6,6a]H)(N[6,6]C[6]2)(C[6]N[6]O)	H(C[6]C[6,6a]C[6,6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6,6]N[6,6]C[6])(H){1|C<4>,1|H<1>,1|N<3>,1|O<1>,3|C<3>}	C[6,6](C[6]C[6,6a]H)(N[6,6]C[6]2)(C[6]N[6]O){1|C<4>,1|O<1>,2|H<1>,3|C<3>}	H(C[6]C[6,6a]C[6,6])	119.0470	0.000	1	119.0470	0.000	1	119.0470	0.000	1	119.5849	1.402	530	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:4:	3:	C[6,6]-3:C[6,6]-3:H-1:	C[3x6]-3:C[6]-3:C[6]-4:	C[6]-3:	C[6](C[6,6]C[3x6]C[6])(C[6,6]C[6,6]C[6])(H)	C[6,6](C[3x6]C[4,4,6,6]C[6,6])(C[6]C[6,6]H)(C[6]C[6]CC)	H(C[6]C[6,6]2)	C[6](C[6,6]C[3x6]C[6])(C[6,6]C[6,6]C[6])(H){9|C<4>}	C[6,6](C[3x6]C[4,4,6,6]C[6,6])(C[6]C[6,6]H)(C[6]C[6]CC){1|C<3>,2|H<1>,6|C<4>}	H(C[6]C[6,6]2)	118.1600	0.000	1	118.1600	0.000	1	118.1600	0.000	1	119.3662	0.258	20	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:4:	3:	C[6,6]-3:C[6,6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-4:	C[6]-3:	C[6](C[6,6]C[3x6]C[6])(C[6,6]C[6,6]C[6])(H)	C[6,6](C[6,6]C[4,4,6,6]C[6])(C[6]C[6,6]H)(C[6]C[6]CC)	H(C[6]C[6,6]2)	C[6](C[6,6]C[3x6]C[6])(C[6,6]C[6,6]C[6])(H){9|C<4>}	C[6,6](C[6,6]C[4,4,6,6]C[6])(C[6]C[6,6]H)(C[6]C[6]CC){2|C<3>,2|H<1>,5|C<4>}	H(C[6]C[6,6]2)	118.6280	0.000	1	118.6280	0.000	1	119.4663	0.237	13	119.3662	0.258	20	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:4:	3:	C[6,6]-3:C[6,6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-4:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])2(H)	C[6,6](C[6,6]C[6]N[6])(C[6]C[6,6]H)(C[6]C[6]HH)	H(C[6]C[6,6]2)	C[6](C[6,6]C[6,6]C[6])2(H){1|N<3>,2|C<3>,2|C<4>,4|H<1>}	C[6,6](C[6,6]C[6]N[6])(C[6]C[6,6]H)(C[6]C[6]HH){1|Co<5>,1|C<3>,1|N<3>,2|C<4>,2|H<1>}	H(C[6]C[6,6]2)	119.0050	0.000	1	119.5362	0.189	12	119.4663	0.237	13	119.3662	0.258	20	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:4:	3:	C[6,6]-3:C[6,6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-4:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])2(H)	C[6,6](C[6,6]C[6]N[6])(C[6]C[6,6]H)(C[6]C[6]HH)	H(C[6]C[6,6]2)	C[6](C[6,6]C[6,6]C[6])2(H){1|N<3>,2|C<3>,2|C<4>,4|H<1>}	C[6,6](C[6,6]C[6]N[6])(C[6]C[6,6]H)(C[6]C[6]HH){1|Fe<5>,1|C<3>,1|N<3>,2|C<4>,2|H<1>}	H(C[6]C[6,6]2)	119.9070	0.226	6	119.5362	0.189	12	119.4663	0.237	13	119.3662	0.258	20	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:4:	3:	C[6,6]-3:C[6,6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-4:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])2(H)	C[6,6](C[6,6]C[6]N[6])(C[6]C[6,6]H)(C[6]C[6]HH)	H(C[6]C[6,6]2)	C[6](C[6,6]C[6,6]C[6])2(H){1|N<3>,4|C<4>,4|H<1>}	C[6,6](C[6,6]C[6]N[6])(C[6]C[6,6]H)(C[6]C[6]HH){1|C<3>,1|O<1>,1|P<4>,2|C<4>,3|H<1>}	H(C[6]C[6,6]2)	118.9750	0.000	1	119.5362	0.189	12	119.4663	0.237	13	119.3662	0.258	20	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:4:	3:	C[6,6]-3:C[6,6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-4:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])2(H)	C[6,6](C[6,6]C[6]N[6])(C[6]C[6,6]H)(C[6]C[6]HH)	H(C[6]C[6,6]2)	C[6](C[6,6]C[6,6]C[6])2(H){1|N<3>,4|C<4>,4|H<1>}	C[6,6](C[6,6]C[6]N[6])(C[6]C[6,6]H)(C[6]C[6]HH){1|Mn<7>,1|C<3>,1|N<4>,2|C<4>,3|H<1>}	H(C[6]C[6,6]2)	119.2530	0.169	4	119.5362	0.189	12	119.4663	0.237	13	119.3662	0.258	20	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:4:	3:	C[6,6a]-3:C[6,6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-4:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6,6]C[6])(H)	C[6,6](C[6,6]C[6,6a]O[6])(C[6]C[6,6a]H)(C[6]C[6]HH)	H(C[6]C[6,6a]C[6,6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6,6]C[6])(H){1|C<4>,1|O<2>,3|C<3>,3|H<1>}	C[6,6](C[6,6]C[6,6a]O[6])(C[6]C[6,6a]H)(C[6]C[6]HH){2|H<1>,4|C<3>}	H(C[6]C[6,6a]C[6,6])	119.4123	0.164	4	119.4123	0.027	4	119.4584	0.031	5	119.3662	0.258	20	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:4:	3:	C[6,6a]-3:C[6,6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-4:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6,6]C[6])(H)	C[6,6](C[6,6]C[6]N[6])(C[6]C[6,6a]H)(C[6]C[6]HH)	H(C[6]C[6,6a]C[6,6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6,6]C[6])(H){1|C<4>,1|N<3>,3|C<3>,3|H<1>}	C[6,6](C[6,6]C[6]N[6])(C[6]C[6,6a]H)(C[6]C[6]HH){1|Fe<5>,1|C<4>,1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6,6a]C[6,6])	119.6430	0.000	1	119.6430	0.000	1	119.4584	0.031	5	119.3662	0.258	20	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:3:4:	3:	C[6,6a]-3:C[6,6]-3:H-1:	C[6]-3:N[6,6]-3:C[6]-4:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6,6]N[6,6]C[6])(H)	C[6,6](C[6]C[6,6a]H)(N[6,6]C[6]2)(C[6]C[6]HH)	H(C[6]C[6,6a]C[6,6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6,6]N[6,6]C[6])(H){2|C<4>,3|C<3>,3|H<1>}	C[6,6](C[6]C[6,6a]H)(N[6,6]C[6]2)(C[6]C[6]HH){1|C<4>,1|O<1>,2|C<3>,4|H<1>}	H(C[6]C[6,6a]C[6,6])	118.8100	0.000	1	118.8100	0.000	1	118.8100	0.000	1	119.3662	0.258	20	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:4:3:	3:	C[6,6]-3:C[6,6]-3:H-1:	C[6,6a]-3:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6a]C[6,6])(C[6,6]C[6,6]N[6])(H)	C[6,6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6]O[6]C)(C[6]C[6,6]H)	H(C[6]C[6,6]2)	C[6](C[6,6]C[6,6a]C[6,6])(C[6,6]C[6,6]N[6])(H){2|C<4>,3|C<3>,3|O<2>}	C[6,6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6]O[6]C)(C[6]C[6,6]H){1|C<4>,1|N<2>,3|C<3>,3|H<1>}	H(C[6]C[6,6]2)	118.4530	0.000	1	118.4530	0.000	1	118.4530	0.000	1	119.5294	0.907	114	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:4:3:	3:	C[6,6]-3:C[6,6a]-3:H-1:	C[5a,6]-3:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[5a,6]C[6,6])(C[6,6a]C[6,6a]C[6a])(H)	C[6,6](C[5a,6]C[5a,6]N[5a])(C[6,6]C[6]O[6]H)(C[6]C[6,6a]H)	H(C[6]C[6,6a]C[6,6])	C[6](C[6,6]C[5a,6]C[6,6])(C[6,6a]C[6,6a]C[6a])(H){1|C<4>,1|N<3>,1|O<2>,2|H<1>,3|C<3>}	C[6,6](C[5a,6]C[5a,6]N[5a])(C[6,6]C[6]O[6]H)(C[6]C[6,6a]H){1|C<4>,3|H<1>,4|C<3>}	H(C[6]C[6,6a]C[6,6])	119.9100	0.000	1	119.9100	0.000	1	119.9100	0.000	1	119.5294	0.907	114	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:4:3:	3:	C[6,6]-3:C[6,6a]-3:H-1:	C[6,6a]-3:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6a]C[6,6])(C[6,6a]C[6,6a]C[6a])(H)	C[6,6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6]O[6]H)(C[6]C[6,6a]H)	H(C[6]C[6,6a]C[6,6])	C[6](C[6,6]C[6,6a]C[6,6])(C[6,6a]C[6,6a]C[6a])(H){1|C<4>,1|O<2>,2|H<1>,4|C<3>}	C[6,6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6]O[6]H)(C[6]C[6,6a]H){1|C<4>,3|H<1>,4|C<3>}	H(C[6]C[6,6a]C[6,6])	119.3850	0.000	1	119.3850	0.000	1	119.6667	0.067	3	119.5294	0.907	114	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:4:3:	3:	C[6,6]-3:C[6,6a]-3:H-1:	C[6,6a]-3:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6a]C[6,6])(C[6,6a]C[6,6a]C[6a])(H)	C[6,6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6a]O[6]2)(C[6]C[6,6a]H)	H(C[6]C[6,6a]C[6,6])	C[6](C[6,6]C[6,6a]C[6,6])(C[6,6a]C[6,6a]C[6a])(H){1|H<1>,2|O<2>,5|C<3>}	C[6,6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6a]O[6]2)(C[6]C[6,6a]H){1|C<4>,1|H<1>,6|C<3>}	H(C[6]C[6,6a]C[6,6])	119.8075	0.124	2	119.8075	0.015	2	119.6667	0.067	3	119.5294	0.907	114	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[5,6,6]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[5,6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[5,6,6]C[5,6,6a]C[5,6])(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6,6]C[6])(C[6]C[6]H)(H){1|Mo<10>,1|C<3>,2|C<4>,3|H<1>}	C[6,6](C[5,6,6]C[5,6,6a]C[5,6])(C[6]C[6]HH)(C[6]C[6]H){1|Mo<10>,2|C<3>,2|C<4>,3|H<1>}	H(C[6]C[6,6]C[6])	113.2370	0.000	1	113.2370	0.000	1	113.2370	0.000	1	119.5294	0.907	114	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]2)(C[6]C[6]H)(H)	C[6,6](C[6,6]C[6,6]C[6])(C[6,6]C[6]2H)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2)(C[6]C[6]H)(H){1|H<1>,1|O<1>,4|C<4>}	C[6,6](C[6,6]C[6,6]C[6])(C[6,6]C[6]2H)(C[6]C[6]H){2|C<3>,4|C<4>,6|H<1>}	H(C[6]C[6,6]C[6])	118.1675	0.391	2	118.1675	0.153	2	118.1675	0.153	2	119.5294	0.907	114	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]C)(H)	C[6,6](C[6,6]C[5,6]N[6])(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]C)(H){1|C<3>,1|N<3>,2|C<4>,2|H<1>}	C[6,6](C[6,6]C[5,6]N[6])(C[6]C[6]HH)(C[6]C[6]H){1|C<3>,1|O<1>,1|O<2>,2|C<4>,3|H<1>}	H(C[6]C[6,6]C[6])	119.8795	0.103	2	119.8795	0.011	2	119.7480	0.448	67	119.5294	0.907	114	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]C[6,6]N[6])(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>,3|H<1>}	C[6,6](C[6,6]C[6,6]N[6])(C[6]C[6]HH)(C[6]C[6]H){1|N<3>,2|C<3>,4|H<1>}	H(C[6]C[6,6]C[6])	119.6490	0.000	1	120.1360	0.219	3	119.7480	0.448	67	119.5294	0.907	114	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]C[6,6]N[6])(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>,3|H<1>}	C[6,6](C[6,6]C[6,6]N[6])(C[6]C[6]HH)(C[6]C[6]H){1|Pt<4>,1|N<3>,2|C<3>,3|H<1>}	H(C[6]C[6,6]C[6])	120.3795	0.286	2	120.1360	0.219	3	119.7480	0.448	67	119.5294	0.907	114	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]C[6,6a]C[6])(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<4>,2|C<3>,3|H<1>}	C[6,6](C[6,6]C[6,6a]C[6])(C[6]C[6]HH)(C[6]C[6]H){1|O<1>,3|C<3>,3|H<1>}	H(C[6]C[6,6]C[6])	119.7770	0.000	1	119.7770	0.000	1	119.7480	0.448	67	119.5294	0.907	114	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]C[6,6a]N[6])(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	C[6,6](C[6,6]C[6,6a]N[6])(C[6]C[6]HH)(C[6]C[6]H){1|Ni<4>,3|C<3>,3|H<1>}	H(C[6]C[6,6]C[6])	120.0700	0.035	2	120.0700	0.001	2	119.7480	0.448	67	119.5294	0.907	114	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]C[6]N[6])(C[6]C[6,6a]CH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|N<3>,2|C<4>,2|H<1>}	C[6,6](C[6,6]C[6]N[6])(C[6]C[6,6a]CH)(C[6]C[6]H){1|C<4>,1|O<1>,2|H<1>,3|C<3>}	H(C[6]C[6,6]C[6])	120.7400	0.000	1	120.2900	0.118	5	119.7480	0.448	67	119.5294	0.907	114	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]C[6]N[6])(C[6]C[6,6a]CH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|N<3>,2|C<4>,2|H<1>}	C[6,6](C[6,6]C[6]N[6])(C[6]C[6,6a]CH)(C[6]C[6]H){2|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6,6]C[6])	120.1775	0.270	4	120.2900	0.118	5	119.7480	0.448	67	119.5294	0.907	114	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>,3|H<1>}	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]HH)(C[6]C[6]H){1|Al<4>,1|N<3>,2|C<3>,3|H<1>}	H(C[6]C[6,6]C[6])	119.8470	0.000	1	119.7743	0.384	47	119.7480	0.448	67	119.5294	0.907	114	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>,3|H<1>}	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]HH)(C[6]C[6]H){1|Ir<6>,1|C<4>,2|C<3>,3|H<1>}	H(C[6]C[6,6]C[6])	120.1379	0.613	9	119.7743	0.384	47	119.7480	0.448	67	119.5294	0.907	114	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>,3|H<1>}	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]HH)(C[6]C[6]H){1|Mg<5>,1|N<3>,2|C<3>,3|H<1>}	H(C[6]C[6,6]C[6])	119.3300	0.000	1	119.7743	0.384	47	119.7480	0.448	67	119.5294	0.907	114	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>,3|H<1>}	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]HH)(C[6]C[6]H){1|Ni<5>,1|C<3>,1|C<4>,1|N<3>,3|H<1>}	H(C[6]C[6,6]C[6])	120.0922	0.142	5	119.7743	0.384	47	119.7480	0.448	67	119.5294	0.907	114	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>,3|H<1>}	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]HH)(C[6]C[6]H){1|Ni<6>,1|C<3>,1|C<4>,1|N<3>,3|H<1>}	H(C[6]C[6,6]C[6])	119.4870	1.037	4	119.7743	0.384	47	119.7480	0.448	67	119.5294	0.907	114	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>,3|H<1>}	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]HH)(C[6]C[6]H){1|Pd<4>,1|C<3>,1|C<4>,1|N<3>,3|H<1>}	H(C[6]C[6,6]C[6])	119.7697	0.166	3	119.7743	0.384	47	119.7480	0.448	67	119.5294	0.907	114	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>,3|H<1>}	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]HH)(C[6]C[6]H){1|Ru<6>,1|C<3>,1|C<4>,1|N<3>,3|H<1>}	H(C[6]C[6,6]C[6])	120.1760	0.000	1	119.7743	0.384	47	119.7480	0.448	67	119.5294	0.907	114	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|N<3>,2|C<4>,2|H<1>}	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]HH)(C[6]C[6]H){1|Al<4>,1|N<3>,2|C<3>,3|H<1>}	H(C[6]C[6,6]C[6])	119.9270	0.000	1	119.7743	0.384	47	119.7480	0.448	67	119.5294	0.907	114	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|N<3>,2|C<4>,2|H<1>}	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]HH)(C[6]C[6]H){1|Ni<5>,1|C<3>,1|C<4>,1|N<3>,3|H<1>}	H(C[6]C[6,6]C[6])	119.5225	0.057	2	119.7743	0.384	47	119.7480	0.448	67	119.5294	0.907	114	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]HH)(C[6]C[6]H){1|Co<5>,1|C<3>,1|C<4>,1|N<3>,3|H<1>}	H(C[6]C[6,6]C[6])	119.5610	0.000	1	119.7743	0.384	47	119.7480	0.448	67	119.5294	0.907	114	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]HH)(C[6]C[6]H){1|Fe<5>,1|C<3>,1|C<4>,1|N<3>,3|H<1>}	H(C[6]C[6,6]C[6])	119.7230	0.000	1	119.7743	0.384	47	119.7480	0.448	67	119.5294	0.907	114	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]HH)(C[6]C[6]H){1|Ni<4>,1|C<3>,1|C<4>,1|N<3>,3|H<1>}	H(C[6]C[6,6]C[6])	119.7500	0.000	1	119.7743	0.384	47	119.7480	0.448	67	119.5294	0.907	114	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]HH)(C[6]C[6]H){1|Pd<4>,1|C<3>,1|C<4>,1|N<3>,3|H<1>}	H(C[6]C[6,6]C[6])	119.5380	0.111	3	119.7743	0.384	47	119.7480	0.448	67	119.5294	0.907	114	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|N<2>,1|N<3>,2|C<4>,2|H<1>}	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]HH)(C[6]C[6]H){1|Li<4>,1|C<3>,1|C<4>,5|H<1>}	H(C[6]C[6,6]C[6])	118.3715	1.788	2	119.7743	0.384	47	119.7480	0.448	67	119.5294	0.907	114	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|N<3>,2|C<4>,3|H<1>}	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]HH)(C[6]C[6]H){1|Al<4>,1|C<4>,1|N<3>,2|C<3>,3|H<1>}	H(C[6]C[6,6]C[6])	119.3970	0.000	1	119.7743	0.384	47	119.7480	0.448	67	119.5294	0.907	114	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|N<3>,2|C<4>,3|H<1>}	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]HH)(C[6]C[6]H){1|Al<5>,1|C<3>,1|C<4>,1|O<3>,4|H<1>}	H(C[6]C[6,6]C[6])	119.9440	0.000	1	119.7743	0.384	47	119.7480	0.448	67	119.5294	0.907	114	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|N<3>,2|C<4>,3|H<1>}	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]HH)(C[6]C[6]H){1|C<3>,1|C<4>,1|O<1>,5|H<1>}	H(C[6]C[6,6]C[6])	119.7245	0.199	2	119.7743	0.384	47	119.7480	0.448	67	119.5294	0.907	114	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|N<3>,2|C<4>,3|H<1>}	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]HH)(C[6]C[6]H){1|Ir<6>,1|C<3>,1|C<4>,5|H<1>}	H(C[6]C[6,6]C[6])	119.8550	0.000	1	119.7743	0.384	47	119.7480	0.448	67	119.5294	0.907	114	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|N<3>,2|C<4>,3|H<1>}	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]HH)(C[6]C[6]H){1|Mg<5>,1|C<4>,1|N<4>,2|C<3>,3|H<1>}	H(C[6]C[6,6]C[6])	119.6540	0.000	1	119.7743	0.384	47	119.7480	0.448	67	119.5294	0.907	114	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|N<3>,2|C<4>,3|H<1>}	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]HH)(C[6]C[6]H){1|Ru<6>,1|C<3>,1|C<4>,1|N<3>,4|H<1>}	H(C[6]C[6,6]C[6])	120.7790	0.000	1	119.7743	0.384	47	119.7480	0.448	67	119.5294	0.907	114	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|N<3>,2|C<4>,3|H<1>}	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]HH)(C[6]C[6]H){1|Ru<6>,1|C<3>,1|C<4>,1|N<4>,4|H<1>}	H(C[6]C[6,6]C[6])	119.5770	0.048	2	119.7743	0.384	47	119.7480	0.448	67	119.5294	0.907	114	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|N<3>,2|H<1>,3|C<4>}	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]HH)(C[6]C[6]H){1|Al<4>,1|C<4>,1|N<3>,2|C<3>,3|H<1>}	H(C[6]C[6,6]C[6])	119.7160	0.000	1	119.7743	0.384	47	119.7480	0.448	67	119.5294	0.907	114	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|N<3>,2|H<1>,3|C<4>}	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]HH)(C[6]C[6]H){1|Al<5>,1|C<3>,1|C<4>,1|O<3>,4|H<1>}	H(C[6]C[6,6]C[6])	119.7610	0.000	1	119.7743	0.384	47	119.7480	0.448	67	119.5294	0.907	114	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|N<3>,2|H<1>,3|C<4>}	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]HH)(C[6]C[6]H){1|Ir<6>,1|C<3>,1|C<4>,1|N<4>,4|H<1>}	H(C[6]C[6,6]C[6])	120.0090	0.000	1	119.7743	0.384	47	119.7480	0.448	67	119.5294	0.907	114	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]C[6]O[6])(C[6]C[6,6]CC)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<3>,3|C<4>}	C[6,6](C[6,6]C[6]O[6])(C[6]C[6,6]CC)(C[6]C[6]H){1|Li<4>,2|Li<5>,1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6,6]C[6])	119.7500	0.000	1	119.7500	0.000	1	119.7480	0.448	67	119.5294	0.907	114	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]N[6]2)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,2|H<1>,2|N<3>}	C[6,6](C[6,6]N[6]2)(C[6]C[6]HH)(C[6]C[6]H){2|Ru<5>,1|C<3>,1|C<4>,3|H<1>}	H(C[6]C[6,6]C[6])	118.9280	0.000	1	119.4005	0.447	2	119.7480	0.448	67	119.5294	0.907	114	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]N[6]2)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){2|C<3>,2|H<1>,2|N<3>}	C[6,6](C[6,6]N[6]2)(C[6]C[6]HH)(C[6]C[6]H){1|Ni<3>,1|Ni<4>,2|C<3>,2|H<1>}	H(C[6]C[6,6]C[6])	119.8730	0.000	1	119.4005	0.447	2	119.7480	0.448	67	119.5294	0.907	114	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6,6](C[6,6]C[6,6]C[6])(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){1|C<3>,2|C<4>,4|H<1>}	C[6,6](C[6,6]C[6,6]C[6])(C[6]C[6]HH)(C[6]C[6]H){1|O<1>,3|C<4>,4|H<1>}	H(C[6]C[6,6]C[6])	117.8680	0.000	1	117.8680	0.000	1	119.7480	0.448	67	119.5294	0.907	114	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6,6](C[6,6]C[6]2)(C[6]C[6]HO)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){1|C<2>,1|H<1>,2|C<4>,2|O<2>}	C[6,6](C[6,6]C[6]2)(C[6]C[6]HO)(C[6]C[6]H){1|C<4>,1|N<3>,1|O<2>,2|C<3>,2|H<1>}	H(C[6]C[6,6]C[6])	119.1850	0.000	1	119.1850	0.000	1	119.7480	0.448	67	119.5294	0.907	114	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6,6](C[6,6]C[6]N[6])(C[6]C[6,6a]CC)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){1|H<1>,1|N<2>,2|C<3>,2|C<4>}	C[6,6](C[6,6]C[6]N[6])(C[6]C[6,6a]CC)(C[6]C[6]H){1|H<1>,1|O<1>,3|C<3>}	H(C[6]C[6,6]C[6])	118.2940	0.182	2	118.2940	0.033	2	119.7480	0.448	67	119.5294	0.907	114	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:S[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]S[6])(C[6]C[6a]S[6])(H)	C[6,6](C[6,6]C[6,6a]O[6])(S[6]C[6]OO)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]S[6])(C[6]C[6a]S[6])(H){1|C<4>,1|O<2>,3|C<3>,4|O<1>}	C[6,6](C[6,6]C[6,6a]O[6])(S[6]C[6]OO)(C[6]C[6]H){1|S<4>,2|H<1>,3|C<3>}	H(C[6]C[6,6]C[6])	118.1370	0.000	1	118.1370	0.000	1	118.1370	0.000	1	119.5294	0.907	114	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6a]C[6,6])(C[6]C[6]H)(H)	C[6,6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6]2H)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]C[6,6])(C[6]C[6]H)(H){1|H<1>,1|S<4>,2|C<3>,2|C<4>}	C[6,6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6]2H)(C[6]C[6]H){1|C<4>,3|C<3>,6|H<1>}	H(C[6]C[6,6]C[6])	119.2495	0.548	2	119.2495	0.300	2	118.5297	0.431	10	119.5294	0.907	114	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6a]C[6,6])(C[6]C[6]O)(H)	C[6,6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[5a,6]C[6]C)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]C[6,6])(C[6]C[6]O)(H){1|C<4>,1|O<2>,4|C<3>}	C[6,6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[5a,6]C[6]C)(C[6]C[6]H){1|N<3>,1|O<1>,2|H<1>,4|C<3>}	H(C[6]C[6,6]C[6])	118.0140	0.122	4	118.0140	0.015	4	118.5297	0.431	10	119.5294	0.907	114	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6a]C[6,6])(C[6]C[6]O)(H)	C[6,6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6]2C)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]C[6,6])(C[6]C[6]O)(H){2|C<4>,2|H<1>,3|C<3>}	C[6,6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6]2C)(C[6]C[6]H){1|O<1>,2|C<3>,2|C<4>,5|H<1>}	H(C[6]C[6,6]C[6])	118.3480	0.000	1	118.3480	0.000	1	118.5297	0.431	10	119.5294	0.907	114	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6a]C[6,6])(C[6]C[6]O)(H)	C[6,6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6]2H)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]C[6,6])(C[6]C[6]O)(H){2|C<3>,2|C<4>,3|H<1>}	C[6,6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6]2H)(C[6]C[6]H){1|O<1>,2|C<3>,3|C<4>,4|H<1>}	H(C[6]C[6,6]C[6])	117.9130	0.000	1	117.9130	0.000	1	118.5297	0.431	10	119.5294	0.907	114	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6a]C[6,6])(C[6]O[6]O)(H)	C[6,6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6]2C)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]C[6,6])(C[6]O[6]O)(H){2|C<3>,3|C<4>}	C[6,6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6]2C)(C[6]C[6]H){1|C<4>,1|N<2>,1|O<1>,1|O<2>,2|C<3>,4|H<1>}	H(C[6]C[6,6]C[6])	119.2405	0.107	2	119.2405	0.011	2	118.5297	0.431	10	119.5294	0.907	114	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[3x6]-3:N[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]N[3x6]N[6])(C[6]C[6]N)(H)	C[6,6](N[3x6]C[6,6]2)(N[6]C[6]CC)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[3x6]N[6])(C[6]C[6]N)(H){1|C<3>,1|H<1>,4|C<4>}	C[6,6](N[3x6]C[6,6]2)(N[6]C[6]CC)(C[6]C[6]H){1|C<3>,1|N<3>,1|N<4>,2|C<4>,3|H<1>}	H(C[6]C[6,6]C[6])	119.7340	0.225	2	119.7340	0.051	2	119.7340	0.051	2	119.5294	0.907	114	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[5,6,6]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]N[5,6,6]C[6])(C[6]C[6]H)(H)	C[6,6](N[5,6,6]C[5,6,6]C[5,6])(C[6]C[6a]2C[6])(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[5,6,6]C[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,4|C<3>}	C[6,6](N[5,6,6]C[5,6,6]C[5,6])(C[6]C[6a]2C[6])(C[6]C[6]H){1|H<1>,1|N<3>,1|O<1>,2|C<4>,6|C<3>}	H(C[6]C[6,6]C[6])	120.0990	0.000	1	120.0990	0.000	1	120.0990	0.000	1	119.5294	0.907	114	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](N[6,6]B[6]C[6])(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|C<4>,3|H<1>}	C[6,6](N[6,6]B[6]C[6])(C[6]C[6]HH)(C[6]C[6]H){1|O<2>,2|C<3>,2|C<4>,3|H<1>}	H(C[6]C[6,6]C[6])	119.6787	0.163	4	119.8200	0.081	10	119.8959	0.085	18	119.5294	0.907	114	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](N[6,6]B[6]C[6])(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|C<4>,3|H<1>}	C[6,6](N[6,6]B[6]C[6])(C[6]C[6]HH)(C[6]C[6]H){1|O<2>,2|C<3>,2|H<1>,3|C<4>}	H(C[6]C[6,6]C[6])	119.7800	0.000	1	119.8200	0.081	10	119.8959	0.085	18	119.5294	0.907	114	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](N[6,6]B[6]C[6])(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|C<4>,3|H<1>}	C[6,6](N[6,6]B[6]C[6])(C[6]C[6]HH)(C[6]C[6]H){1|O<2>,2|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6,6]C[6])	119.8480	0.000	1	119.8200	0.081	10	119.8959	0.085	18	119.5294	0.907	114	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](N[6,6]B[6]C[6])(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|C<4>,3|H<1>}	C[6,6](N[6,6]B[6]C[6])(C[6]C[6]HH)(C[6]C[6]H){1|O<2>,3|C<3>,4|H<1>}	H(C[6]C[6,6]C[6])	119.7635	0.148	2	119.8200	0.081	10	119.8959	0.085	18	119.5294	0.907	114	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](N[6,6]B[6]C[6])(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|C<4>,3|H<1>}	C[6,6](N[6,6]B[6]C[6])(C[6]C[6]HH)(C[6]C[6]H){1|O<2>,3|H<1>,4|C<3>}	H(C[6]C[6,6]C[6])	119.7750	0.000	1	119.8200	0.081	10	119.8959	0.085	18	119.5294	0.907	114	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](N[6,6]B[6]C[6])(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H){1|B<4>,2|C<3>,3|H<1>}	C[6,6](N[6,6]B[6]C[6])(C[6]C[6]HH)(C[6]C[6]H){1|Ru<8>,1|C<3>,1|O<2>,2|F<1>,2|H<1>}	H(C[6]C[6,6]C[6])	120.5550	0.000	1	119.8200	0.081	10	119.8959	0.085	18	119.5294	0.907	114	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](N[6,6]C[6,6]C[6])(C[6]O[6]CH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H){1|C<4>,1|O<2>,2|C<3>,2|H<1>}	C[6,6](N[6,6]C[6,6]C[6])(C[6]O[6]CH)(C[6]C[6]H){2|H<1>,3|C<3>}	H(C[6]C[6,6]C[6])	119.4080	0.000	1	119.4080	0.000	1	119.8959	0.085	18	119.5294	0.907	114	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](N[6,6]Ga[6]C[6])(C[6]C[6,6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H){1|Ga<4>,2|C<3>,3|H<1>}	C[6,6](N[6,6]Ga[6]C[6])(C[6]C[6,6]HH)(C[6]C[6]H){2|Cl<1>,1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6,6]C[6])	119.8595	0.138	2	119.9870	0.033	4	119.8959	0.085	18	119.5294	0.907	114	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](N[6,6]Ga[6]C[6])(C[6]C[6,6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H){1|Ga<5>,2|C<3>,3|H<1>}	C[6,6](N[6,6]Ga[6]C[6])(C[6]C[6,6]HH)(C[6]C[6]H){2|Cl<1>,2|C<3>,2|H<1>,2|N<3>}	H(C[6]C[6,6]C[6])	120.1145	0.122	2	119.9870	0.033	4	119.8959	0.085	18	119.5294	0.907	114	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](N[6,6]In[6]C[6])(C[6]C[6,6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H){1|In<6>,2|C<3>,3|H<1>}	C[6,6](N[6,6]In[6]C[6])(C[6]C[6,6]HH)(C[6]C[6]H){3|Cl<1>,1|N<3>,1|O<3>,2|C<3>,2|H<1>}	H(C[6]C[6,6]C[6])	120.2575	0.066	2	120.2575	0.004	2	119.8959	0.085	18	119.5294	0.907	114	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](N[6,6]O[6,6]C[6])(C[6]C[5,6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<3>,3|H<1>}	C[6,6](N[6,6]O[6,6]C[6])(C[6]C[5,6]HH)(C[6]C[6]H){2|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6,6]C[6])	120.0560	0.000	1	120.0560	0.000	1	119.8959	0.085	18	119.5294	0.907	114	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[6,6]-3:N[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(H)	C[6,6](N[6,6]C[6]2)(N[6]C[6]CC)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,4|C<4>}	C[6,6](N[6,6]C[6]2)(N[6]C[6]CC)(C[6]C[6]H){1|C<3>,1|C<4>,6|H<1>}	H(C[6]C[6,6]C[6])	120.1590	0.000	1	120.1590	0.000	1	120.1590	0.000	1	119.5294	0.907	114	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:4:3:	3:	C[6,6]-3:N[6]-3:H-1:	C[3x6]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[3x6]C[6])(N[6]B[5a]C[6])(H)	C[6,6](C[3x6]C[6,6]N[6,6])(C[6]C[6]HH)(C[6]N[6]H)	H(C[6]C[6,6]N[6])	C[6](C[6,6]C[3x6]C[6])(N[6]B[5a]C[6])(H){1|C<3>,2|C<4>,3|H<1>,3|N<3>}	C[6,6](C[3x6]C[6,6]N[6,6])(C[6]C[6]HH)(C[6]N[6]H){1|B<3>,2|H<1>,4|C<4>}	H(C[6]C[6,6]N[6])	118.6877	0.112	4	118.6877	0.013	4	118.6877	0.013	4	119.5294	0.907	114	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:4:3:	3:	C[6,6]-3:N[6]-3:H-1:	C[6,6]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(N[6]C[6]Ru)(H)	C[6,6](C[6,6]C[6]N[6])(C[6]C[6,6a]HH)(C[6]N[6]H)	H(C[6]C[6,6]N[6])	C[6](C[6,6]C[6,6]C[6])(N[6]C[6]Ru)(H){1|N<3>,2|H<1>,3|C<3>}	C[6,6](C[6,6]C[6]N[6])(C[6]C[6,6a]HH)(C[6]N[6]H){1|Ru<6>,2|H<1>,3|C<3>}	H(C[6]C[6,6]N[6])	120.6860	0.000	1	120.6860	0.000	1	120.6860	0.000	1	119.5294	0.907	114	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	3:4:3:	3:	C[6,6a]-3:C[6,6]-3:H-1:	C[6,6a]-3:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6,6]C[6,6a]C[6,6])(H)	C[6,6](C[6,6a]C[6,6a]C[6a])(C[6,6]N[6]2Ru)(C[6]C[6,6a]H)	H(C[6]C[6,6a]C[6,6])	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6,6]C[6,6a]C[6,6])(H){1|Ru<7>,1|N<2>,2|N<3>,4|C<3>}	C[6,6](C[6,6a]C[6,6a]C[6a])(C[6,6]N[6]2Ru)(C[6]C[6,6a]H){1|H<1>,5|C<3>}	H(C[6]C[6,6a]C[6,6])	119.5740	0.000	1	119.5740	0.000	1	119.5740	0.000	1	119.5294	0.907	114	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:2:	3:	C[6,6]-3:C[6,6]-3:H-1:	C[6,6]-4:C[6]-3:N[6]-2:	C[6]-3:	C[6](C[6,6]C[6,6a]C[6,6])(C[6,6]C[6,6]N[6])(H)	C[6,6](C[6,6]C[6]O[6]O)(C[6]C[6,6]H)(N[6]C[6,6a])	H(C[6]C[6,6]2)	C[6](C[6,6]C[6,6a]C[6,6])(C[6,6]C[6,6]N[6])(H){2|C<4>,3|C<3>,3|O<2>}	C[6,6](C[6,6]C[6]O[6]O)(C[6]C[6,6]H)(N[6]C[6,6a]){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6,6]2)	118.5410	0.000	1	118.5410	0.000	1	118.5410	0.000	1	119.2440	1.063	5	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:2:	3:	C[6,6]-3:C[6]-3:H-1:	C[3x6]-4:C[6]-3:N[6]-2:	C[6]-3:	C[6](C[6,6]C[3x6]N[6])(C[6]C[6,6a]H)(H)	C[6,6](C[3x6]C[6,6a]C[6,6]C[6])(C[6]C[6]H)(N[6]C[6])	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[3x6]N[6])(C[6]C[6,6a]H)(H){2|C<3>,3|C<4>}	C[6,6](C[3x6]C[6,6a]C[6,6]C[6])(C[6]C[6]H)(N[6]C[6]){1|N<3>,3|C<3>,7|H<1>}	H(C[6]C[6,6]C[6])	118.8020	0.000	1	118.8020	0.000	1	118.8020	0.000	1	119.2440	1.063	5	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:2:	3:	C[6,6]-3:C[6]-3:H-1:	C[4,6,6]-4:C[6]-3:O[6]-2:	C[6]-3:	C[6](C[6,6]C[4,6,6]O[6])(C[6]C[6]O)(H)	C[6,6](C[4,6,6]C[4,6]C[4]C[6])(C[6]C[6]H)(O[6]C[6])	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[4,6,6]O[6])(C[6]C[6]O)(H){1|C<3>,2|H<1>,3|C<4>}	C[6,6](C[4,6,6]C[4,6]C[4]C[6])(C[6]C[6]H)(O[6]C[6]){2|H<1>,2|O<1>,6|C<4>}	H(C[6]C[6,6]C[6])	121.0690	0.000	1	121.0690	0.000	1	121.0690	0.000	1	119.2440	1.063	5	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:2:	3:	C[6,6]-3:C[6]-3:H-1:	C[5,6,6]-4:C[6]-3:O[6]-2:	C[6]-3:	C[6](C[6,6]C[5,6,6]O[6])(C[6]O[6]O)(H)	C[6,6](C[5,6,6]C[5,6]C[6]O[5])(C[6]C[6]H)(O[6]C[6])	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6,6]O[6])(C[6]O[6]O)(H){1|O<2>,3|C<4>}	C[6,6](C[5,6,6]C[5,6]C[6]O[5])(C[6]C[6]H)(O[6]C[6]){1|C<3>,1|O<1>,1|O<2>,2|H<1>,5|C<4>}	H(C[6]C[6,6]C[6])	118.8820	0.000	1	118.8820	0.000	1	118.8820	0.000	1	119.2440	1.063	5	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:2:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:O[6]-2:	C[6]-3:	C[6](C[6,6]C[6,6]O[6])(C[6]C[6]O)(H)	C[6,6](C[6,6]C[6]2O)(C[6]C[6]H)(O[6]C[6])	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]O[6])(C[6]C[6]O)(H){1|O<2>,2|H<1>,3|C<4>}	C[6,6](C[6,6]C[6]2O)(C[6]C[6]H)(O[6]C[6]){1|O<1>,2|C<4>,6|H<1>}	H(C[6]C[6,6]C[6])	118.9260	0.000	1	118.9260	0.000	1	118.9260	0.000	1	119.2440	1.063	5	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6,6]-3:H-1:	C[5,6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[5,6,6]C[6])2(H)	C[6,6](C[5,6,6]C[5,6]O[5,6]C[5])(C[6]C[6,6]H)(C[6]C[6]H)	H(C[6]C[6,6]2)	C[6](C[6,6]C[5,6,6]C[6])2(H){1|H<1>,1|O<1>,1|O<2>,6|C<4>}	C[6,6](C[5,6,6]C[5,6]O[5,6]C[5])(C[6]C[6,6]H)(C[6]C[6]H){1|C<3>,4|C<4>,5|H<1>}	H(C[6]C[6,6]2)	118.2890	0.000	2	118.5870	0.266	3	118.6205	0.122	6	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6,6]-3:H-1:	C[5,6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[5,6,6]C[6])2(H)	C[6,6](C[5,6,6]C[5,6]O[5,6]C[5])(C[6]C[6,6]H)(C[6]C[6]H)	H(C[6]C[6,6]2)	C[6](C[6,6]C[5,6,6]C[6])2(H){2|H<1>,2|O<2>,6|C<4>}	C[6,6](C[5,6,6]C[5,6]O[5,6]C[5])(C[6]C[6,6]H)(C[6]C[6]H){5|C<4>,5|H<1>}	H(C[6]C[6,6]2)	119.1830	0.000	1	118.5870	0.266	3	118.6205	0.122	6	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6,6]-3:H-1:	C[5,6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[5,6,6]C[6])2(H)	C[6,6](C[5,6,6]O[5,6]C[5]C[6])(C[6]C[6,6]H)(C[6]C[6]H)	H(C[6]C[6,6]2)	C[6](C[6,6]C[5,6,6]C[6])2(H){1|C<3>,1|O<2>,3|H<1>,5|C<4>}	C[6,6](C[5,6,6]O[5,6]C[5]C[6])(C[6]C[6,6]H)(C[6]C[6]H){1|O<1>,4|C<4>,4|H<1>}	H(C[6]C[6,6]2)	118.8700	0.000	1	118.8700	0.000	1	118.6205	0.122	6	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6,6]-3:H-1:	C[5,6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[5,6,6]C[6])2(H)	C[6,6](C[5,6,6]O[5,6]C[5]C[6])(C[6]C[6,6]H)(C[6]C[6]O)	H(C[6]C[6,6]2)	C[6](C[6,6]C[5,6,6]C[6])2(H){1|H<1>,1|O<1>,1|O<2>,6|C<4>}	C[6,6](C[5,6,6]O[5,6]C[5]C[6])(C[6]C[6,6]H)(C[6]C[6]O){1|C<3>,3|C<4>,6|H<1>}	H(C[6]C[6,6]2)	118.5460	0.000	2	118.5460	0.000	2	118.6205	0.122	6	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6,6]-3:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])2(H)	C[6,6](C[6,6]C[6]2H)(C[6]C[6,6]H)(C[6]C[6]H)	H(C[6]C[6,6]2)	C[6](C[6,6]C[6,6]C[6])2(H){2|C<3>,3|C<4>,4|H<1>}	C[6,6](C[6,6]C[6]2H)(C[6]C[6,6]H)(C[6]C[6]H){1|C<3>,1|O<1>,2|C<4>,4|H<1>}	H(C[6]C[6,6]2)	118.1420	0.000	1	117.9520	0.029	4	117.9520	0.029	4	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6,6]-3:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])2(H)	C[6,6](C[6,6]C[6]2H)(C[6]C[6,6]H)(C[6]C[6]H)	H(C[6]C[6,6]2)	C[6](C[6,6]C[6,6]C[6])2(H){2|C<3>,3|C<4>,4|H<1>}	C[6,6](C[6,6]C[6]2H)(C[6]C[6,6]H)(C[6]C[6]H){2|C<3>,2|C<4>,4|H<1>}	H(C[6]C[6,6]2)	117.8887	0.138	3	117.9520	0.029	4	117.9520	0.029	4	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6,6a]-3:H-1:	C[6,6]-4:C[6,6a]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6a]C[6,6])(C[6,6a]C[6,6a]C[6a])(H)	C[6,6](C[6,6]C[6a]C[6]O[6])(C[6,6a]C[6,6a]C[6a])(C[6]C[6,6a]H)	H(C[6]C[6,6a]C[6,6])	C[6](C[6,6]C[6,6a]C[6,6])(C[6,6a]C[6,6a]C[6a])(H){1|C<4>,1|H<1>,1|O<2>,5|C<3>}	C[6,6](C[6,6]C[6a]C[6]O[6])(C[6,6a]C[6,6a]C[6a])(C[6]C[6,6a]H){1|C<4>,2|H<1>,7|C<3>}	H(C[6]C[6,6a]C[6,6])	118.6200	0.000	1	118.6200	0.000	1	118.6200	0.000	1	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[3,6]-4:C[6,6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[3,6]C[6,6])(C[6]C[6]H)(H)	C[6,6](C[3,6]C[3,6]O[3]H)(C[6,6]C[6,6]N[6])(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[3,6]C[6,6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>,1|O<2>,2|C<4>}	C[6,6](C[3,6]C[3,6]O[3]H)(C[6,6]C[6,6]N[6])(C[6]C[6]H){1|Cu<4>,1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6,6]C[6])	120.2605	0.240	2	120.2605	0.057	2	120.2605	0.057	2	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[3x6]-4:C[6,6a]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6a]C[3x6])(C[6]C[6]C)(H)	C[6,6](C[3x6]C[3x6]C[6,6]C)(C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]C[3x6])(C[6]C[6]C)(H){1|H<1>,2|C<4>,3|C<3>}	C[6,6](C[3x6]C[3x6]C[6,6]C)(C[6,6a]C[6,6a]C[6a])(C[6]C[6]H){1|H<1>,2|C<4>,6|C<3>}	H(C[6]C[6,6]C[6])	117.9960	0.067	4	118.0584	0.023	5	118.0584	0.023	5	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[3x6]-4:C[6,6a]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6a]C[3x6])(C[6]C[6]C)(H)	C[6,6](C[3x6]C[3x6]C[6,6]C)(C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]C[3x6])(C[6]C[6]C)(H){1|H<1>,2|C<4>,3|C<3>}	C[6,6](C[3x6]C[3x6]C[6,6]C)(C[6,6a]C[6,6a]C[6a])(C[6]C[6]H){1|H<1>,3|C<4>,5|C<3>}	H(C[6]C[6,6]C[6])	118.3080	0.000	1	118.0584	0.023	5	118.0584	0.023	5	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[3x6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[3x6]C[6])(C[6]C[6,6]H)(H)	C[6,6](C[3x6]C[3x6]C[6,6]C)(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[3x6]C[6])(C[6]C[6,6]H)(H){1|H<1>,2|C<3>,3|C<4>}	C[6,6](C[3x6]C[3x6]C[6,6]C)(C[6]C[6]H)2{1|H<1>,3|C<3>,3|C<4>}	H(C[6]C[6,6]C[6])	119.3010	0.000	1	119.1500	0.065	5	119.1801	0.370	19	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[3x6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[3x6]C[6])(C[6]C[6,6]H)(H)	C[6,6](C[3x6]C[3x6]C[6,6]C)(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[3x6]C[6])(C[6]C[6,6]H)(H){1|H<1>,2|C<4>,3|C<3>}	C[6,6](C[3x6]C[3x6]C[6,6]C)(C[6]C[6]H)2{1|H<1>,2|C<4>,4|C<3>}	H(C[6]C[6,6]C[6])	119.1123	0.278	4	119.1500	0.065	5	119.1801	0.370	19	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[3x6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[3x6]C[6])(C[6]C[6,6]H)(H)	C[6,6](C[3x6]C[6,6a]C[6,6]C[6])(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[3x6]C[6])(C[6]C[6,6]H)(H){1|C<3>,1|H<1>,1|N<3>,2|C<4>,2|O<2>}	C[6,6](C[3x6]C[6,6a]C[6,6]C[6])(C[6]C[6]H)(C[6]N[6]H){2|C<3>,3|C<4>,5|H<1>}	H(C[6]C[6,6]C[6])	118.9410	0.000	1	118.9410	0.000	1	119.1801	0.370	19	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[3x6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[3x6]C[6])(C[6]C[6,6]O)(H)	C[6,6](C[3x6]C[6,6]2C)(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[3x6]C[6])(C[6]C[6,6]O)(H){1|C<3>,1|H<1>,1|O<2>,4|C<4>}	C[6,6](C[3x6]C[6,6]2C)(C[6]C[6]H)2{1|C<3>,1|O<1>,3|C<4>,3|H<1>}	H(C[6]C[6,6]C[6])	119.6150	0.042	2	119.6150	0.002	2	119.1801	0.370	19	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[3x6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[3x6]C[6])(C[6]C[6]C)(H)	C[6,6](C[3x6]C[3x6]C[6,6]C)(C[6]C[6]C)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[3x6]C[6])(C[6]C[6]C)(H){1|C<2>,1|H<1>,2|C<3>,2|C<4>}	C[6,6](C[3x6]C[3x6]C[6,6]C)(C[6]C[6]C)(C[6]C[6]H){1|C<2>,2|C<4>,4|C<3>}	H(C[6]C[6,6]C[6])	119.0110	0.078	2	119.0110	0.006	2	119.1801	0.370	19	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[3x6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[3x6]C[6])(C[6]C[6]C)(H)	C[6,6](C[3x6]C[3x6]C[6,6]C)(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[3x6]C[6])(C[6]C[6]C)(H){2|C<3>,2|C<4>,2|H<1>}	C[6,6](C[3x6]C[3x6]C[6,6]C)(C[6]C[6]H)2{1|H<1>,2|C<4>,4|C<3>}	H(C[6]C[6,6]C[6])	118.5288	0.155	4	118.5848	0.034	5	119.1801	0.370	19	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[3x6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[3x6]C[6])(C[6]C[6]C)(H)	C[6,6](C[3x6]C[3x6]C[6,6]C)(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[3x6]C[6])(C[6]C[6]C)(H){2|C<3>,2|C<4>,2|H<1>}	C[6,6](C[3x6]C[3x6]C[6,6]C)(C[6]C[6]H)2{1|H<1>,3|C<3>,3|C<4>}	H(C[6]C[6,6]C[6])	118.8090	0.000	1	118.5848	0.034	5	119.1801	0.370	19	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[3x6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[3x6]C[6])(C[6]C[6]H)(H)	C[6,6](C[3x6]C[6,6]2C)(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[3x6]C[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>,3|C<4>}	C[6,6](C[3x6]C[6,6]2C)(C[6]C[6]H)2{1|C<3>,1|O<1>,3|C<4>,3|H<1>}	H(C[6]C[6,6]C[6])	120.5850	0.201	2	120.5850	0.040	2	119.1801	0.370	19	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[3x6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[3x6]C[6])(C[6]C[6]H)(H)	C[6,6](C[3x6]C[6,6]N[6,6]C)(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[3x6]C[6])(C[6]C[6]H)(H){1|N<3>,3|C<4>,3|H<1>}	C[6,6](C[3x6]C[6,6]N[6,6]C)(C[6]C[6]H)2{4|C<4>,4|H<1>}	H(C[6]C[6,6]C[6])	119.1370	0.000	1	119.1370	0.000	1	119.1801	0.370	19	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[3x6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[3x6]C[6])(C[6]C[6]O)(H)	C[6,6](C[3x6]C[6,6]C[6]2)(C[6]C[6,6a]H)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[3x6]C[6])(C[6]C[6]O)(H){1|H<1>,1|O<1>,2|C<3>,2|C<4>}	C[6,6](C[3x6]C[6,6]C[6]2)(C[6]C[6,6a]H)(C[6]C[6]H){1|N<2>,1|O<2>,4|C<3>,4|H<1>}	H(C[6]C[6,6]C[6])	119.2480	0.000	1	119.2480	0.000	1	119.1801	0.370	19	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[5,5,6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[5,5,6,6]C[6])(C[6]C[6]O)(H)	C[6,6](C[5,5,6,6]C[5,5,6]C[5,6a]C[5,6])(C[6]C[6,6a]O)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,5,6,6]C[6])(C[6]C[6]O)(H){1|O<1>,1|O<2>,2|C<3>,3|C<4>}	C[6,6](C[5,5,6,6]C[5,5,6]C[5,6a]C[5,6])(C[6]C[6,6a]O)(C[6]C[6]H){1|H<1>,1|O<1>,2|C<4>,2|O<2>,4|C<3>}	H(C[6]C[6,6]C[6])	118.7235	0.176	2	118.7235	0.031	2	118.7235	0.031	2	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[5,5,6]-4:C[6,6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[5,5,6]C[6,6])(C[6]C[6]H)(H)	C[6,6](C[5,5,6]C[5,5,6]N[5]2)(C[6,6]C[6,6]N[6])(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,5,6]C[6,6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,3|N<3>}	C[6,6](C[5,5,6]C[5,5,6]N[5]2)(C[6,6]C[6,6]N[6])(C[6]C[6]H){1|Co<7>,3|H<1>,3|N<3>,4|C<3>}	H(C[6]C[6,6]C[6])	120.2910	0.181	3	120.2910	0.033	3	120.2910	0.033	3	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[5,6,6]-4:C[6,6a]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[5,6,6]C[6,6a])(C[6]C[6]O)(H)	C[6,6](C[5,6,6]N[5,6]C[5]C[6])(C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6,6]C[6,6a])(C[6]C[6]O)(H){1|H<1>,1|N<3>,4|C<3>}	C[6,6](C[5,6,6]N[5,6]C[5]C[6])(C[6,6a]C[6,6a]C[6a])(C[6]C[6]H){1|C<4>,1|O<1>,2|H<1>,6|C<3>}	H(C[6]C[6,6]C[6])	118.9210	0.000	1	118.9210	0.000	1	118.9210	0.000	1	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[5,6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[5,6,6]C[6])(C[6]C[6,6a]H)(H)	C[6,6](C[5,6,6]C[5,6,6a]2C)(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6,6]C[6])(C[6]C[6,6a]H)(H){1|C<4>,1|H<1>,4|C<3>}	C[6,6](C[5,6,6]C[5,6,6a]2C)(C[6]C[6]H)2{2|H<1>,4|C<3>}	H(C[6]C[6,6]C[6])	119.4935	0.098	2	119.4935	0.010	2	119.2505	0.633	16	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[5,6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[5,6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[5,6,6]C[5,5,6]N[5,6]H)(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6,6]C[6])(C[6]C[6]H)(H){1|N<3>,1|O<1>,2|C<4>,2|H<1>}	C[6,6](C[5,6,6]C[5,5,6]N[5,6]H)(C[6]C[6]H)2{2|C<4>,3|C<3>,3|H<1>}	H(C[6]C[6,6]C[6])	120.1830	0.000	1	120.1830	0.000	1	119.2505	0.633	16	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[5,6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[5,6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[5,6,6]C[5,6,6]C[5,6]H)(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6,6]C[6])(C[6]C[6]H)(H){1|O<1>,2|H<1>,3|C<4>}	C[6,6](C[5,6,6]C[5,6,6]C[5,6]H)(C[6]C[6]H)2{1|C<3>,2|C<4>,2|O<2>,4|H<1>}	H(C[6]C[6,6]C[6])	118.1830	0.000	1	118.9000	1.028	2	119.2505	0.633	16	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[5,6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[5,6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[5,6,6]C[5,6,6]C[5,6]H)(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6,6]C[6])(C[6]C[6]H)(H){1|O<2>,3|C<4>,3|H<1>}	C[6,6](C[5,6,6]C[5,6,6]C[5,6]H)(C[6]C[6]H)2{2|O<2>,3|C<4>,4|H<1>}	H(C[6]C[6,6]C[6])	119.6170	0.000	1	118.9000	1.028	2	119.2505	0.633	16	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[5,6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[5,6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[5,6,6]C[5,6]2Ca)(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6,6]C[6])(C[6]C[6]H)(H){1|Ca<12>,1|C<3>,2|C<4>,2|H<1>}	C[6,6](C[5,6,6]C[5,6]2Ca)(C[6]C[6]H)2{1|C<3>,2|H<1>,3|C<4>}	H(C[6]C[6,6]C[6])	119.8950	0.129	4	119.4746	0.235	8	119.2505	0.633	16	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[5,6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[5,6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[5,6,6]C[5,6]2Ca)(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6,6]C[6])(C[6]C[6]H)(H){1|Ca<12>,1|C<3>,2|H<1>,3|C<4>}	C[6,6](C[5,6,6]C[5,6]2Ca)(C[6]C[6]H)2{1|C<3>,2|H<1>,3|C<4>}	H(C[6]C[6,6]C[6])	119.0542	0.246	4	119.4746	0.235	8	119.2505	0.633	16	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[5,6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[5,6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[5,6,6]C[5,6]2H)(C[6]C[6a]C[6])(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6,6]C[6])(C[6]C[6]H)(H){1|C<4>,2|H<1>,3|C<3>}	C[6,6](C[5,6,6]C[5,6]2H)(C[6]C[6a]C[6])(C[6]C[6]H){1|C<4>,1|N<2>,1|O<2>,3|C<3>,3|H<1>}	H(C[6]C[6,6]C[6])	117.1050	0.000	1	117.1050	0.000	1	119.2505	0.633	16	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[5,6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[5,6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[5,6,6]C[5,6]C[5]C[6])(C[6]C[6]C)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6,6]C[6])(C[6]C[6]H)(H){2|H<1>,5|C<4>}	C[6,6](C[5,6,6]C[5,6]C[5]C[6])(C[6]C[6]C)(C[6]C[6]H){1|C<3>,2|C<4>,9|H<1>}	H(C[6]C[6,6]C[6])	118.5610	0.000	1	118.5610	0.000	1	119.2505	0.633	16	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[5,6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[5,6,6]C[6])(C[6]C[6]O)(H)	C[6,6](C[5,6,6]O[5,6]C[5]C[6])(C[6]C[6,6]H)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6,6]C[6])(C[6]C[6]O)(H){1|Br<1>,1|C<3>,1|O<2>,2|C<4>,2|H<1>}	C[6,6](C[5,6,6]O[5,6]C[5]C[6])(C[6]C[6,6]H)(C[6]C[6]H){1|O<1>,4|C<4>,4|H<1>}	H(C[6]C[6,6]C[6])	119.5750	0.000	1	119.5750	0.000	1	119.2505	0.633	16	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[5,6]-4:C[6,6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6]H)(H)	C[6,6](C[5,6]C[5,6]N[5]O)(C[6,6]C[6,6a]N[6])(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|O<2>,2|N<3>}	C[6,6](C[5,6]C[5,6]N[5]O)(C[6,6]C[6,6a]N[6])(C[6]C[6]H){1|N<2>,1|N<3>,1|O<2>,3|C<3>,3|H<1>}	H(C[6]C[6,6]C[6])	119.7050	0.000	1	119.7050	0.000	1	119.8460	2.078	5	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[5,6]-4:C[6,6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6]H)(H)	C[6,6](C[5,6]C[5,6a]C[5]C[6])(C[6,6]C[6]2)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,4|C<3>}	C[6,6](C[5,6]C[5,6a]C[5]C[6])(C[6,6]C[6]2)(C[6]C[6]H){1|O<1>,1|O<2>,2|C<4>,2|H<1>,5|C<3>}	H(C[6]C[6,6]C[6])	119.3400	0.000	1	119.3400	0.000	1	119.8460	2.078	5	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[5,6]-4:C[6,6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6]H)(H)	C[6,6](C[5,6]C[5]O[5]O[6])(C[6,6]C[5,6]C[6])(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,2|C<3>,2|O<2>}	C[6,6](C[5,6]C[5]O[5]O[6])(C[6,6]C[5,6]C[6])(C[6]C[6]H){1|C<3>,1|H<1>,1|N<3>,1|O<1>,1|O<2>,1|S<2>,3|C<4>}	H(C[6]C[6,6]C[6])	118.9730	0.000	1	120.6640	5.719	2	119.8460	2.078	5	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[5,6]-4:C[6,6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6]H)(H)	C[6,6](C[5,6]C[5]O[5]O[6])(C[6,6]C[5,6]C[6])(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,2|C<3>,2|O<2>}	C[6,6](C[5,6]C[5]O[5]O[6])(C[6,6]C[5,6]C[6])(C[6]C[6]H){1|C<3>,1|H<1>,1|N<3>,1|S<2>,2|O<1>,3|C<4>}	H(C[6]C[6,6]C[6])	122.3550	0.000	1	120.6640	5.719	2	119.8460	2.078	5	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[5,6]-4:C[6,6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6]O)(H)	C[6,6](C[5,6]C[5,6]C[5]C)(C[6,6]C[6]N[6])(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6]O)(H){1|H<1>,1|N<2>,2|C<3>,2|C<4>}	C[6,6](C[5,6]C[5,6]C[5]C)(C[6,6]C[6]N[6])(C[6]C[6]H){1|O<1>,1|O<2>,2|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6,6]C[6])	118.8570	0.000	1	118.8570	0.000	1	119.8460	2.078	5	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[5,6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6,6]H)(H)	C[6,6](C[6,6]C[6,6]C[6]H)(C[5,6]C[5,6]C[5])(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6,6]H)(H){2|H<1>,5|C<4>}	C[6,6](C[6,6]C[6,6]C[6]H)(C[5,6]C[5,6]C[5])(C[6]C[6]H){5|H<1>,7|C<4>}	H(C[6]C[6,6]C[6])	118.8460	0.000	1	118.8460	0.000	1	118.7863	0.005	3	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[5,6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6,6]H)(H)	C[6,6](C[6,6]C[6,6]C[6]O)(C[5,6]C[5,6]C[5])(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6,6]H)(H){1|C<3>,1|O<2>,4|C<4>}	C[6,6](C[6,6]C[6,6]C[6]O)(C[5,6]C[5,6]C[5])(C[6]C[6]H){1|C<3>,1|O<2>,4|H<1>,6|C<4>}	H(C[6]C[6,6]C[6])	118.8060	0.000	1	118.8060	0.000	1	118.7863	0.005	3	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[5,6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6,6a]O)(H)	C[6,6](C[6,6]C[6,6a]C[6]C)(C[5,6]C[5,6]C[5])(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6,6a]O)(H){3|C<3>,3|C<4>}	C[6,6](C[6,6]C[6,6a]C[6]C)(C[5,6]C[5,6]C[5])(C[6]C[6]H){1|C<4>,1|O<1>,1|O<2>,3|C<3>,4|H<1>}	H(C[6]C[6,6]C[6])	118.7070	0.000	1	118.7070	0.000	1	118.7863	0.005	3	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6,6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]2)(C[6]C[6,6]H)(H)	C[6,6](C[6,6]C[6,6]C[6]C)(C[6,6]C[6,6]C[6])(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2)(C[6]C[6,6]H)(H){1|H<1>,6|C<4>}	C[6,6](C[6,6]C[6,6]C[6]C)(C[6,6]C[6,6]C[6])(C[6]C[6]H){1|C<3>,5|H<1>,6|C<4>}	H(C[6]C[6,6]C[6])	118.1785	0.053	2	118.1785	0.003	2	118.6855	0.843	15	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6,6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]2)(C[6]C[6]H)(H)	C[6,6](C[6,6]C[6,6]C[6]Cr)(C[6,6]C[6]O[6])(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2)(C[6]C[6]H)(H){1|Cr<9>,1|C<3>,1|O<2>,4|C<4>}	C[6,6](C[6,6]C[6,6]C[6]Cr)(C[6,6]C[6]O[6])(C[6]C[6]H){1|C<3>,3|C<4>,3|H<1>}	H(C[6]C[6,6]C[6])	118.3030	0.000	1	117.5477	2.087	3	118.6855	0.843	15	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6,6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]2)(C[6]C[6]H)(H)	C[6,6](C[6,6]C[6,6]C[6]Cr)(C[6,6]C[6]O[6])(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2)(C[6]C[6]H)(H){1|Cr<9>,1|O<2>,2|C<3>,3|C<4>}	C[6,6](C[6,6]C[6,6]C[6]Cr)(C[6,6]C[6]O[6])(C[6]C[6]H){1|C<3>,3|C<4>,3|H<1>}	H(C[6]C[6,6]C[6])	115.8820	0.000	1	117.5477	2.087	3	118.6855	0.843	15	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6,6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]2)(C[6]C[6]H)(H)	C[6,6](C[6,6]C[6,6]C[6]Cr)(C[6,6]C[6]O[6])(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2)(C[6]C[6]H)(H){1|Cr<9>,1|O<2>,2|C<4>,3|C<3>}	C[6,6](C[6,6]C[6,6]C[6]Cr)(C[6,6]C[6]O[6])(C[6]C[6]H){1|C<3>,3|C<4>,3|H<1>}	H(C[6]C[6,6]C[6])	118.4580	0.000	1	117.5477	2.087	3	118.6855	0.843	15	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6,6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]2)(C[6]C[6]O)(H)	C[6,6](C[6,6]C[6,6]C[6]C)(C[6,6]C[6]2)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2)(C[6]C[6]O)(H){1|O<2>,2|C<3>,3|C<4>}	C[6,6](C[6,6]C[6,6]C[6]C)(C[6,6]C[6]2)(C[6]C[6]H){1|O<1>,2|C<4>,3|C<3>,4|H<1>}	H(C[6]C[6,6]C[6])	119.0890	0.000	1	119.0890	0.000	1	118.6855	0.843	15	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6,6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]2)(C[6]O[6]O)(H)	C[6,6](C[6,6]C[5,6,6]C[6]C)(C[6,6]C[6]2)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2)(C[6]O[6]O)(H){1|C<3>,4|C<4>}	C[6,6](C[6,6]C[5,6,6]C[6]C)(C[6,6]C[6]2)(C[6]C[6]H){1|C<3>,1|O<1>,1|O<2>,3|C<4>,5|H<1>}	H(C[6]C[6,6]C[6])	119.1270	0.000	1	119.1326	0.159	9	118.6855	0.843	15	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6,6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]2)(C[6]O[6]O)(H)	C[6,6](C[6,6]C[5,6,6]C[6]C)(C[6,6]C[6]2)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2)(C[6]O[6]O)(H){1|C<3>,4|C<4>}	C[6,6](C[6,6]C[5,6,6]C[6]C)(C[6,6]C[6]2)(C[6]C[6]H){1|C<3>,1|O<1>,2|C<4>,2|O<2>,5|H<1>}	H(C[6]C[6,6]C[6])	119.0110	0.000	1	119.1326	0.159	9	118.6855	0.843	15	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6,6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]2)(C[6]O[6]O)(H)	C[6,6](C[6,6]C[5,6,6]C[6]C)(C[6,6]C[6]2)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2)(C[6]O[6]O)(H){1|C<3>,4|C<4>}	C[6,6](C[6,6]C[5,6,6]C[6]C)(C[6,6]C[6]2)(C[6]C[6]H){1|O<1>,1|O<2>,3|C<4>,6|H<1>}	H(C[6]C[6,6]C[6])	118.8257	0.437	3	119.1326	0.159	9	118.6855	0.843	15	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6,6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]2)(C[6]O[6]O)(H)	C[6,6](C[6,6]C[5,6,6]C[6]C)(C[6,6]C[6]2)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2)(C[6]O[6]O)(H){1|C<3>,4|C<4>}	C[6,6](C[6,6]C[5,6,6]C[6]C)(C[6,6]C[6]2)(C[6]C[6]H){1|O<1>,1|O<2>,4|C<4>,5|H<1>}	H(C[6]C[6,6]C[6])	119.2960	0.316	3	119.1326	0.159	9	118.6855	0.843	15	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6,6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]2)(C[6]O[6]O)(H)	C[6,6](C[6,6]C[5,6,6]C[6]C)(C[6,6]C[6]2)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2)(C[6]O[6]O)(H){1|C<3>,4|C<4>}	C[6,6](C[6,6]C[5,6,6]C[6]C)(C[6,6]C[6]2)(C[6]C[6]H){1|O<1>,2|O<2>,3|C<4>,5|H<1>}	H(C[6]C[6,6]C[6])	119.6900	0.000	1	119.1326	0.159	9	118.6855	0.843	15	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[3,6]O)(H)	C[6,6](C[6,6]C[3,6]C[6,6]C)(C[6]C[6]Cl)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[3,6]O)(H){1|Cl<1>,1|C<3>,1|H<1>,4|C<4>}	C[6,6](C[6,6]C[3,6]C[6,6]C)(C[6]C[6]Cl)(C[6]C[6]H){1|O<1>,3|H<1>,4|C<4>}	H(C[6]C[6,6]C[6])	118.4930	0.000	1	118.4930	0.000	1	118.8461	0.590	97	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[3,6]O)(H)	C[6,6](C[6,6]C[3,6]C[6,6]C)(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[3,6]O)(H){1|C<3>,1|O<2>,2|H<1>,3|C<4>}	C[6,6](C[6,6]C[3,6]C[6,6]C)(C[6]C[6]H)2{1|O<1>,1|O<2>,3|C<4>,3|H<1>}	H(C[6]C[6,6]C[6])	118.1750	0.000	2	118.1750	0.000	2	118.8461	0.590	97	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[5a]C[6])(H)	C[6,6](C[6,6]C[6]2H)(C[6]C[6,6]H)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[5a]C[6])(H){1|S<2>,2|C<3>,2|C<4>,4|H<1>}	C[6,6](C[6,6]C[6]2H)(C[6]C[6,6]H)(C[6]C[6]H){2|C<3>,2|C<4>,4|H<1>}	H(C[6]C[6,6]C[6])	117.5180	0.000	1	117.5180	0.000	1	118.8461	0.590	97	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]H)(H)	C[6,6](C[6,6]C[3,6]C[6,6]C)(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]H)(H){1|C<3>,2|H<1>,4|C<4>}	C[6,6](C[6,6]C[3,6]C[6,6]C)(C[6]C[6]H)2{1|O<1>,1|O<2>,3|C<4>,3|H<1>}	H(C[6]C[6,6]C[6])	118.3810	0.000	2	118.3810	0.000	2	118.8461	0.590	97	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]H)(H)	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(C[6]C[6]N)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]H)(H){1|N<2>,2|C<3>,3|C<4>}	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(C[6]C[6]N){1|C<4>,1|O<1>,2|C<3>,3|H<1>}	H(C[6]C[6,6]C[6])	119.0810	0.000	1	119.0810	0.000	1	118.8461	0.590	97	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]H)(H)	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]H)(H){1|C<3>,2|H<1>,4|C<4>}	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)2{1|O<1>,3|C<4>,4|H<1>}	H(C[6]C[6,6]C[6])	118.2918	0.245	4	118.4866	0.093	7	118.8461	0.590	97	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]H)(H)	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]H)(H){1|H<1>,2|C<3>,3|C<4>}	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)2{1|C<3>,1|O<1>,1|O<2>,2|C<4>,3|H<1>}	H(C[6]C[6,6]C[6])	118.8760	0.000	1	118.4866	0.093	7	118.8461	0.590	97	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]H)(H)	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]H)(H){2|C<3>,2|H<1>,3|C<4>}	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)2{1|C<3>,1|O<1>,2|C<4>,3|H<1>}	H(C[6]C[6,6]C[6])	118.6890	0.000	1	118.4866	0.093	7	118.8461	0.590	97	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]H)(H)	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]H)(H){2|C<3>,2|H<1>,3|C<4>}	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)2{1|Cl<1>,1|C<4>,1|O<1>,2|C<3>,2|H<1>}	H(C[6]C[6,6]C[6])	118.6740	0.000	1	118.4866	0.093	7	118.8461	0.590	97	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]H)(H)	C[6,6](C[6,6]C[6,6]C[6]H)(C[6]C[6,6a]H)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]H)(H){1|C<3>,3|C<4>,3|H<1>}	C[6,6](C[6,6]C[6,6]C[6]H)(C[6]C[6,6a]H)(C[6]C[6]H){1|C<3>,1|N<2>,2|C<4>,4|H<1>}	H(C[6]C[6,6]C[6])	118.2310	0.000	1	118.2310	0.000	1	118.8461	0.590	97	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]H)(H)	C[6,6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]H)(H){1|C<3>,3|C<4>,3|H<1>}	C[6,6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)2{1|O<1>,3|C<4>,4|H<1>}	H(C[6]C[6,6]C[6])	118.6070	0.064	3	118.6070	0.004	3	118.8461	0.590	97	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6a]O)(H)	C[6,6](C[6,6]C[6,6a]O[6]O)(C[6]C[6,6a]O)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6a]O)(H){1|O<1>,2|O<2>,3|C<3>}	C[6,6](C[6,6]C[6,6a]O[6]O)(C[6]C[6,6a]O)(C[6]C[6]H){1|O<1>,4|C<3>}	H(C[6]C[6,6]C[6])	118.6785	0.186	2	118.6785	0.035	2	118.8461	0.590	97	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]C)(H)	C[6,6](C[6,6]C[5,6]C[6]H)(C[6]C[6]H)(C[6]O[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]C)(H){1|C<3>,1|O<2>,2|C<4>,3|H<1>}	C[6,6](C[6,6]C[5,6]C[6]H)(C[6]C[6]H)(C[6]O[6]H){1|C<3>,2|H<1>,4|C<4>}	H(C[6]C[6,6]C[6])	118.5355	0.026	2	118.5355	0.001	2	118.8461	0.590	97	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]C)(H)	C[6,6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]C)(H){3|C<4>,4|H<1>}	C[6,6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)2{4|H<1>,5|C<4>}	H(C[6]C[6,6]C[6])	117.9620	0.000	1	117.9620	0.000	1	118.8461	0.590	97	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]C)(H)	C[6,6](C[6,6]C[6,6a]C[6]H)(C[6]C[6a]O[6])(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]C)(H){1|C<4>,1|O<2>,2|H<1>,3|C<3>}	C[6,6](C[6,6]C[6,6a]C[6]H)(C[6]C[6a]O[6])(C[6]C[6]H){1|C<4>,1|H<1>,1|N<3>,5|C<3>}	H(C[6]C[6,6]C[6])	117.8670	0.000	1	117.8670	0.000	1	118.8461	0.590	97	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]C)(H)	C[6,6](C[6,6]C[6]2H)(C[6]C[6,6]H)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]C)(H){1|C<3>,2|C<4>,4|H<1>}	C[6,6](C[6,6]C[6]2H)(C[6]C[6,6]H)(C[6]C[6]H){2|C<3>,2|C<4>,4|H<1>}	H(C[6]C[6,6]C[6])	118.4580	0.000	1	118.4580	0.000	1	118.8461	0.590	97	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]C)(H)	C[6,6](C[6,6]C[6]2H)(C[6]C[6]H)(C[6]O[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]C)(H){1|C<3>,1|O<2>,2|C<4>,3|H<1>}	C[6,6](C[6,6]C[6]2H)(C[6]C[6]H)(C[6]O[6]H){1|C<3>,2|H<1>,4|C<4>}	H(C[6]C[6,6]C[6])	120.2430	0.000	1	120.2430	0.000	1	118.8461	0.590	97	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]C)(H)	C[6,6](C[6,6]C[6]N[6]Os)(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]C)(H){1|Os<8>,1|N<3>,2|C<3>,2|H<1>}	C[6,6](C[6,6]C[6]N[6]Os)(C[6]C[6]H)2{1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6,6]C[6])	119.7030	0.165	2	119.7030	0.027	2	118.8461	0.590	97	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]C[6]2C)(C[6]C[5,6]H)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,1|O<1>,4|C<4>}	C[6,6](C[6,6]C[6]2C)(C[6]C[5,6]H)(C[6]C[6]H){1|C<3>,1|O<2>,3|C<4>,4|H<1>}	H(C[6]C[6,6]C[6])	118.4180	0.000	1	118.4180	0.000	1	118.8461	0.590	97	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]C[6]2C)(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,3|C<4>,3|H<1>}	C[6,6](C[6,6]C[6]2C)(C[6]C[6]H)2{1|O<1>,3|C<4>,4|H<1>}	H(C[6]C[6,6]C[6])	118.4850	0.000	1	118.4850	0.000	1	118.8461	0.590	97	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]C[6]2H)(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){3|H<1>,4|C<4>}	C[6,6](C[6,6]C[6]2H)(C[6]C[6]H)2{1|O<2>,4|C<4>,4|H<1>}	H(C[6]C[6,6]C[6])	118.4284	0.240	5	118.4284	0.058	5	118.8461	0.590	97	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]C[6]2O)(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|C<4>,2|O<2>}	C[6,6](C[6,6]C[6]2O)(C[6]C[6]H)2{1|C<3>,1|C<4>,1|O<1>,4|H<1>}	H(C[6]C[6,6]C[6])	118.6570	0.000	1	118.6570	0.000	1	118.8461	0.590	97	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]C[6]N[6]Dy)(C[6]C[6]Br)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|Dy<13>,1|Br<1>,1|C<3>,1|N<3>,2|C<4>}	C[6,6](C[6,6]C[6]N[6]Dy)(C[6]C[6]Br)(C[6]C[6]H){1|O<2>,2|C<3>,2|H<1>}	H(C[6]C[6,6]C[6])	119.9097	0.026	3	119.9097	0.001	3	118.8461	0.590	97	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]C[6]N[6]H)(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|N<3>,1|O<1>,2|C<4>,2|H<1>}	C[6,6](C[6,6]C[6]N[6]H)(C[6]C[6]H)2{2|C<4>,3|C<3>,3|H<1>}	H(C[6]C[6,6]C[6])	118.9800	0.000	1	118.8695	0.024	2	118.8461	0.590	97	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]C[6]N[6]H)(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|N<3>,2|C<4>,4|H<1>}	C[6,6](C[6,6]C[6]N[6]H)(C[6]C[6]H)2{2|C<3>,3|C<4>,3|H<1>}	H(C[6]C[6,6]C[6])	118.7590	0.000	1	118.8695	0.024	2	118.8461	0.590	97	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]C[6]N[6]Os)(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|Os<8>,1|N<3>,2|C<3>,2|H<1>}	C[6,6](C[6,6]C[6]N[6]Os)(C[6]C[6]H)2{1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6,6]C[6])	120.3520	0.259	2	120.3520	0.067	2	118.8461	0.590	97	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]C[6]N[6]Ti)(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|Ti<12>,1|C<3>,1|C<4>,1|N<3>,2|H<1>}	C[6,6](C[6,6]C[6]N[6]Ti)(C[6]C[6]H)2{1|O<2>,2|C<3>,2|H<1>}	H(C[6]C[6,6]C[6])	120.3972	0.418	5	119.9908	0.305	12	118.8461	0.590	97	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]C[6]N[6]Ti)(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|Ti<12>,1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6,6](C[6,6]C[6]N[6]Ti)(C[6]C[6]H)2{1|O<2>,2|C<3>,2|H<1>}	H(C[6]C[6,6]C[6])	119.6044	0.285	5	119.9908	0.305	12	118.8461	0.590	97	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]C[6]N[6]Ti)(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|Ti<8>,1|C<3>,1|C<4>,1|N<3>,2|H<1>}	C[6,6](C[6,6]C[6]N[6]Ti)(C[6]C[6]H)2{1|O<2>,2|C<3>,2|H<1>}	H(C[6]C[6,6]C[6])	120.5550	0.000	1	119.9908	0.305	12	118.8461	0.590	97	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]C[6]N[6]Ti)(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|Ti<8>,1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6,6](C[6,6]C[6]N[6]Ti)(C[6]C[6]H)2{1|O<2>,2|C<3>,2|H<1>}	H(C[6]C[6,6]C[6])	119.3270	0.000	1	119.9908	0.305	12	118.8461	0.590	97	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]N[6]2Ru)(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|Ru<7>,1|C<3>,2|H<1>,2|N<3>}	C[6,6](C[6,6]N[6]2Ru)(C[6]C[6]H)2{2|C<3>,2|H<1>}	H(C[6]C[6,6]C[6])	120.2350	0.000	1	120.0495	0.069	2	118.8461	0.590	97	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]N[6]2Ru)(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|Ru<7>,1|H<1>,2|C<3>,2|N<3>}	C[6,6](C[6,6]N[6]2Ru)(C[6]C[6]H)2{2|C<3>,2|H<1>}	H(C[6]C[6,6]C[6])	119.8640	0.000	1	120.0495	0.069	2	118.8461	0.590	97	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]N)(H)	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(C[6]C[6]O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]N)(H){1|O<1>,2|H<1>,4|C<4>}	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(C[6]C[6]O){1|N<2>,3|C<4>,5|H<1>}	H(C[6]C[6,6]C[6])	117.8245	0.037	2	117.8245	0.001	2	118.8461	0.590	97	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]N)(H)	C[6,6](C[6,6]N[6]O[6]H)(C[6]C[6,6a]O)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<1>,1|O<2>,2|N<3>}	C[6,6](C[6,6]N[6]O[6]H)(C[6]C[6,6a]O)(C[6]C[6]H){1|C<4>,1|N<3>,3|C<3>}	H(C[6]C[6,6]C[6])	119.2920	0.000	2	119.2920	0.000	2	118.8461	0.590	97	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6,6](C[6,6]C[5,6]C[6]C)(C[6]C[6]H)(C[6]C[6]O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){1|O<1>,2|H<1>,4|C<4>}	C[6,6](C[6,6]C[5,6]C[6]C)(C[6]C[6]H)(C[6]C[6]O){1|O<1>,3|C<4>,5|H<1>}	H(C[6]C[6,6]C[6])	118.4920	0.000	1	118.4920	0.000	1	118.8461	0.590	97	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]Br)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){1|Br<1>,1|C<3>,2|H<1>,3|C<4>}	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]Br)(C[6]C[6]H){1|O<1>,3|C<4>,4|H<1>}	H(C[6]C[6,6]C[6])	118.2490	0.000	1	118.2490	0.000	1	118.8461	0.590	97	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]C)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){1|C<3>,2|H<1>,4|C<4>}	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]C)(C[6]C[6]H){1|O<1>,3|C<4>,5|H<1>}	H(C[6]C[6,6]C[6])	118.2600	0.000	1	118.4755	0.093	2	118.8461	0.590	97	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]C)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){1|H<1>,2|C<3>,3|C<4>}	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]C)(C[6]C[6]H){1|C<3>,1|O<1>,2|C<4>,4|H<1>}	H(C[6]C[6,6]C[6])	118.6910	0.000	1	118.4755	0.093	2	118.8461	0.590	97	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(C[6]C[6]O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|O<1>,3|C<4>}	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(C[6]C[6]O){1|C<3>,1|O<1>,2|C<4>,4|H<1>}	H(C[6]C[6,6]C[6])	119.2190	0.000	1	118.7766	0.410	5	118.8461	0.590	97	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(C[6]C[6]O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){1|C<3>,1|O<1>,2|H<1>,3|C<4>}	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(C[6]C[6]O){1|C<3>,1|O<1>,2|C<4>,4|H<1>}	H(C[6]C[6,6]C[6])	119.6640	0.000	1	118.7766	0.410	5	118.8461	0.590	97	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(C[6]C[6]O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){1|O<1>,2|H<1>,4|C<4>}	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(C[6]C[6]O){1|O<1>,3|C<4>,5|H<1>}	H(C[6]C[6,6]C[6])	118.3333	0.186	3	118.7766	0.410	5	118.8461	0.590	97	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){1|C<3>,3|C<4>,3|H<1>}	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)2{1|C<3>,1|O<1>,1|O<2>,2|C<4>,3|H<1>}	H(C[6]C[6,6]C[6])	118.2660	0.000	1	118.2927	0.078	7	118.8461	0.590	97	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){1|C<3>,3|C<4>,3|H<1>}	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)2{1|O<1>,3|C<4>,4|H<1>}	H(C[6]C[6,6]C[6])	118.1333	0.207	4	118.2927	0.078	7	118.8461	0.590	97	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){2|C<3>,2|C<4>,2|H<1>}	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)2{1|C<3>,1|O<1>,2|C<4>,3|H<1>}	H(C[6]C[6,6]C[6])	118.7110	0.000	1	118.2927	0.078	7	118.8461	0.590	97	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){2|C<3>,2|C<4>,2|H<1>}	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)2{1|Cl<1>,1|C<4>,1|O<1>,2|C<3>,2|H<1>}	H(C[6]C[6,6]C[6])	118.5390	0.000	1	118.2927	0.078	7	118.8461	0.590	97	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6,6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){1|C<3>,2|C<4>,4|H<1>}	C[6,6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)2{1|O<1>,3|C<4>,4|H<1>}	H(C[6]C[6,6]C[6])	118.1233	0.310	3	118.3918	0.352	4	118.8461	0.590	97	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6,6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){3|C<4>,4|H<1>}	C[6,6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)2{1|O<2>,3|C<4>,5|H<1>}	H(C[6]C[6,6]C[6])	119.1970	0.000	1	118.3918	0.352	4	118.8461	0.590	97	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6,6](C[6,6]C[6]2C)(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){1|C<3>,2|H<1>,4|C<4>}	C[6,6](C[6,6]C[6]2C)(C[6]C[6]H)2{1|O<1>,3|C<4>,4|H<1>}	H(C[6]C[6,6]C[6])	118.1000	0.000	1	118.1000	0.000	1	118.8461	0.590	97	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6,6](C[6,6]C[6]2H)(C[6]C[6,6]H)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){1|C<3>,2|C<4>,4|H<1>}	C[6,6](C[6,6]C[6]2H)(C[6]C[6,6]H)(C[6]C[6]H){1|C<3>,1|O<1>,2|C<4>,4|H<1>}	H(C[6]C[6,6]C[6])	118.1610	0.000	1	118.1610	0.000	1	118.8461	0.590	97	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6,6](C[6,6]C[6]2H)(C[6]C[6]C)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|O<2>,4|C<4>}	C[6,6](C[6,6]C[6]2H)(C[6]C[6]C)(C[6]C[6]H){1|C<3>,1|O<1>,2|C<4>,4|H<1>}	H(C[6]C[6,6]C[6])	118.0460	0.000	1	118.0460	0.000	1	118.8461	0.590	97	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6,6](C[6,6]C[6]2O)(C[6]C[6]C)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){1|C<3>,1|O<2>,2|H<1>,3|C<4>}	C[6,6](C[6,6]C[6]2O)(C[6]C[6]C)(C[6]C[6]H){1|O<1>,2|C<4>,2|O<2>,3|H<1>}	H(C[6]C[6,6]C[6])	118.8900	0.000	1	118.8900	0.000	1	118.8461	0.590	97	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6,6](C[6,6]C[6]2O)(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){1|C<4>,1|O<2>,2|C<3>,2|H<1>}	C[6,6](C[6,6]C[6]2O)(C[6]C[6]H)2{1|C<3>,1|C<4>,1|O<1>,4|H<1>}	H(C[6]C[6,6]C[6])	118.4540	0.000	1	118.4540	0.000	1	118.8461	0.590	97	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]S)(H)	C[6,6](C[6,6]C[6]O[6]H)(C[6]C[6,6a]O)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]S)(H){1|C<3>,1|C<4>,1|H<1>,1|O<1>,2|O<2>}	C[6,6](C[6,6]C[6]O[6]H)(C[6]C[6,6a]O)(C[6]C[6]H){1|S<4>,2|O<2>,3|C<3>}	H(C[6]C[6,6]C[6])	118.9100	0.000	1	118.9100	0.000	1	118.8461	0.590	97	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6a]C[6])(H)	C[6,6](C[6,6]C[6]2H)(C[6]C[6,6]H)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6a]C[6])(H){2|C<4>,3|C<3>,4|H<1>}	C[6,6](C[6,6]C[6]2H)(C[6]C[6,6]H)(C[6]C[6]H){2|C<3>,2|C<4>,4|H<1>}	H(C[6]C[6,6]C[6])	117.5190	0.000	1	117.5190	0.000	1	118.8461	0.590	97	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]O[6]C)(H)	C[6,6](C[6,6]C[6]2H)(C[6]C[6]Cl)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]O[6]C)(H){1|Cl<1>,1|C<3>,1|H<1>,2|C<4>}	C[6,6](C[6,6]C[6]2H)(C[6]C[6]Cl)(C[6]C[6]H){1|C<3>,1|C<4>,1|O<1>,2|O<2>,3|H<1>}	H(C[6]C[6,6]C[6])	118.8222	0.418	4	118.8222	0.175	4	118.8461	0.590	97	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]O[6]O)(H)	C[6,6](C[6,6]C[6]2C)(C[6]C[6]C)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]O[6]O)(H){1|C<3>,4|C<4>}	C[6,6](C[6,6]C[6]2C)(C[6]C[6]C)(C[6]C[6]H){1|C<3>,1|C<4>,1|O<1>,1|O<2>,4|H<1>}	H(C[6]C[6,6]C[6])	118.9795	0.028	2	119.0776	0.075	5	118.8461	0.590	97	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]O[6]O)(H)	C[6,6](C[6,6]C[6]2C)(C[6]C[6]C)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]O[6]O)(H){1|C<3>,4|C<4>}	C[6,6](C[6,6]C[6]2C)(C[6]C[6]C)(C[6]C[6]H){1|C<3>,1|O<1>,1|O<2>,2|C<4>,4|H<1>}	H(C[6]C[6,6]C[6])	119.1430	0.365	3	119.0776	0.075	5	118.8461	0.590	97	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:N[6,6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]N[6,6])(C[6]C[6]H)(H)	C[6,6](C[6,6]C[5,6,6]N[6]C)(N[6,6]Ge[5,6]C[6])(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]N[6,6])(C[6]C[6]H)(H){1|Ge<3>,1|C<3>,1|H<1>,1|N<3>,2|C<4>}	C[6,6](C[6,6]C[5,6,6]N[6]C)(N[6,6]Ge[5,6]C[6])(C[6]C[6]H){1|N<3>,1|N<4>,2|C<3>,2|C<4>,3|H<1>}	H(C[6]C[6,6]C[6])	119.8180	0.000	1	119.7015	0.027	2	119.0430	5.990	6	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:N[6,6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]N[6,6])(C[6]C[6]H)(H)	C[6,6](C[6,6]C[5,6,6]N[6]C)(N[6,6]Ge[5,6]C[6])(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]N[6,6])(C[6]C[6]H)(H){1|Ge<3>,1|C<3>,1|H<1>,1|N<3>,2|C<4>}	C[6,6](C[6,6]C[5,6,6]N[6]C)(N[6,6]Ge[5,6]C[6])(C[6]C[6]H){2|C<3>,2|C<4>,2|N<3>,3|H<1>}	H(C[6]C[6,6]C[6])	119.5850	0.000	1	119.7015	0.027	2	119.0430	5.990	6	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:N[6,6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]N[6,6])(C[6]C[6]H)(H)	C[6,6](C[6,6]C[6,6]C[6]H)(N[6,6]C[6]2)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]N[6,6])(C[6]C[6]H)(H){1|C<3>,2|H<1>,3|C<4>}	C[6,6](C[6,6]C[6,6]C[6]H)(N[6,6]C[6]2)(C[6]C[6]H){1|C<3>,1|C<4>,1|N<3>,1|S<1>,7|H<1>}	H(C[6]C[6,6]C[6])	114.1170	0.000	1	118.1997	12.725	3	119.0430	5.990	6	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:N[6,6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]N[6,6])(C[6]C[6]H)(H)	C[6,6](C[6,6]C[6,6]C[6]H)(N[6,6]C[6]2)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]N[6,6])(C[6]C[6]H)(H){1|C<3>,2|H<1>,3|C<4>}	C[6,6](C[6,6]C[6,6]C[6]H)(N[6,6]C[6]2)(C[6]C[6]H){1|C<3>,1|C<4>,1|N<4>,1|O<2>,7|H<1>}	H(C[6]C[6,6]C[6])	120.2410	0.669	2	118.1997	12.725	3	119.0430	5.990	6	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:N[6,6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]N[6,6])(C[6]C[6]H)(H)	C[6,6](C[6,6]C[6,6]C[6]Rh)(N[6,6]C[6]2)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]N[6,6])(C[6]C[6]H)(H){1|Rh<9>,1|H<1>,2|C<3>,2|C<4>}	C[6,6](C[6,6]C[6,6]C[6]Rh)(N[6,6]C[6]2)(C[6]C[6]H){1|C<4>,3|H<1>,4|C<3>}	H(C[6]C[6,6]C[6])	120.2560	0.000	1	120.2560	0.000	1	119.0430	5.990	6	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-4:C[6,6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6]C[6a]C[6]H)(C[6,6]C[6]N[6])(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|N<3>,2|C<4>,2|H<1>}	C[6,6](C[6]C[6a]C[6]H)(C[6,6]C[6]N[6])(C[6]C[6]H){1|C<4>,3|C<3>,6|H<1>}	H(C[6]C[6,6]C[6])	119.3280	0.000	1	119.3280	0.000	1	119.3280	0.000	1	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-4:N[6,6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6]N[6,6]HH)(N[6,6]C[6]2)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>,3|H<1>}	C[6,6](C[6]N[6,6]HH)(N[6,6]C[6]2)(C[6]C[6]H){3|C<3>,4|H<1>}	H(C[6]C[6,6]C[6])	119.8875	0.090	2	119.8875	0.008	2	119.8875	0.008	2	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	P[6]-4:C[6,6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]P[6])(C[6]C[6]O)(H)	C[6,6](P[6]C[6,6a]C[6a]O)(C[6,6]C[6]2)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]P[6])(C[6]C[6]O)(H){1|H<1>,1|O<1>,4|C<3>}	C[6,6](P[6]C[6,6a]C[6a]O)(C[6,6]C[6]2)(C[6]C[6]H){1|H<1>,1|O<1>,6|C<3>}	H(C[6]C[6,6]C[6])	119.1640	0.000	1	119.1640	0.000	1	119.1640	0.000	1	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:N[6,6]-3:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(N[6,6]C[6,6]C[6])(H)	C[6,6](C[6,6]C[6]2H)(C[6]N[6,6]H)(C[6]O[6]O)	H(C[6]C[6,6]N[6,6])	C[6](C[6,6]C[6,6]C[6])(N[6,6]C[6,6]C[6])(H){1|C<3>,1|O<1>,1|O<2>,3|C<4>,4|H<1>}	C[6,6](C[6,6]C[6]2H)(C[6]N[6,6]H)(C[6]O[6]O){1|C<3>,3|C<4>,3|H<1>}	H(C[6]C[6,6]N[6,6])	117.5290	0.000	1	117.5290	0.000	1	117.5290	0.000	1	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:N[6]-3:H-1:	C[3x6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[3x6]C[6])(N[6]C[6]C)(H)	C[6,6](C[3x6]C[6,6a]C[6,6]C[6])(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6,6]N[6])	C[6](C[6,6]C[3x6]C[6])(N[6]C[6]C)(H){2|C<3>,2|C<4>,3|H<1>}	C[6,6](C[3x6]C[6,6a]C[6,6]C[6])(C[6]C[6]H)(C[6]N[6]H){2|C<3>,3|C<4>,5|H<1>}	H(C[6]C[6,6]N[6])	117.2830	0.000	1	117.2830	0.000	1	117.2830	0.000	1	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:N[6]-3:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(N[6]C[6]S)(H)	C[6,6](C[6,6]C[6]O[6]H)(C[6]C[6,6a]O)(C[6]N[6]H)	H(C[6]C[6,6]N[6])	C[6](C[6,6]C[6,6]C[6])(N[6]C[6]S)(H){1|C<4>,1|O<1>,1|O<2>,2|C<3>,2|H<1>}	C[6,6](C[6,6]C[6]O[6]H)(C[6]C[6,6a]O)(C[6]N[6]H){1|C<4>,1|S<4>,2|C<3>,2|H<1>}	H(C[6]C[6,6]N[6])	117.9400	0.000	1	117.9400	0.000	1	117.9400	0.000	1	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6a]-3:C[6,6]-3:H-1:	C[3x6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[3x6]C[6])(H)	C[6,6](C[3x6]C[6,6]C[6]2)(C[6]C[6,6a]H)(C[6]C[6]H)	H(C[6]C[6,6a]C[6,6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[3x6]C[6])(H){2|C<4>,2|H<1>,4|C<3>}	C[6,6](C[3x6]C[6,6]C[6]2)(C[6]C[6,6a]H)(C[6]C[6]H){1|N<2>,1|O<2>,4|C<3>,4|H<1>}	H(C[6]C[6,6a]C[6,6])	118.4960	0.000	1	118.4960	0.000	1	118.4960	0.000	1	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6a]-3:C[6,6]-3:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6,6]C[6])(H)	C[6,6](C[6,6]C[6]O[6]C)(C[6]C[6,6a]H)(C[6]C[6,6a]O)	H(C[6]C[6,6a]C[6,6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6,6]C[6])(H){1|Br<1>,1|C<4>,1|O<1>,1|O<2>,4|C<3>}	C[6,6](C[6,6]C[6]O[6]C)(C[6]C[6,6a]H)(C[6]C[6,6a]O){1|O<1>,4|C<3>}	H(C[6]C[6,6a]C[6,6])	119.9840	0.000	1	119.9840	0.000	1	119.2807	0.158	9	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6a]-3:C[6,6]-3:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6,6]C[6])(H)	C[6,6](C[6,6]C[6]O[6]H)(C[6]C[6,6a]H)(C[6]C[6]N)	H(C[6]C[6,6a]C[6,6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6,6]C[6])(H){1|N<2>,1|O<2>,2|C<3>,2|C<4>,2|H<1>}	C[6,6](C[6,6]C[6]O[6]H)(C[6]C[6,6a]H)(C[6]C[6]N){1|C<4>,2|C<3>,4|H<1>}	H(C[6]C[6,6a]C[6,6])	119.0900	0.000	1	119.0900	0.000	1	119.2807	0.158	9	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6a]-3:C[6,6]-3:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6,6]C[6])(H)	C[6,6](C[6,6]C[6]O[6]H)(C[6]C[6,6a]H)(C[6]C[6]O)	H(C[6]C[6,6a]C[6,6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6,6]C[6])(H){1|O<1>,1|O<2>,2|C<3>,2|C<4>,2|H<1>}	C[6,6](C[6,6]C[6]O[6]H)(C[6]C[6,6a]H)(C[6]C[6]O){1|C<4>,2|C<3>,4|H<1>}	H(C[6]C[6,6a]C[6,6])	119.6750	0.000	1	119.6750	0.000	1	119.2807	0.158	9	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6a]-3:C[6,6]-3:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6,6]C[6])(H)	C[6,6](C[6,6]O[6]2C)(C[6]C[6,6a]H)(C[6]C[6,6]O)	H(C[6]C[6,6a]C[6,6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6,6]C[6])(H){1|C<4>,1|H<1>,1|O<1>,2|O<2>,3|C<3>}	C[6,6](C[6,6]O[6]2C)(C[6]C[6,6a]H)(C[6]C[6,6]O){1|C<4>,3|C<3>}	H(C[6]C[6,6a]C[6,6])	119.1875	0.115	4	119.1875	0.013	4	119.2807	0.158	9	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6a]-3:C[6,6]-3:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]N[6a])(C[6,6]C[6,6]C[6])(H)	C[6,6](C[6,6]C[6,6]C[6]H)(C[6]C[6,6a]H)(C[6]C[6]H)	H(C[6]C[6,6a]C[6,6])	C[6](C[6,6a]C[6,6a]N[6a])(C[6,6]C[6,6]C[6])(H){2|C<4>,2|H<1>,3|C<3>}	C[6,6](C[6,6]C[6,6]C[6]H)(C[6]C[6,6a]H)(C[6]C[6]H){1|C<3>,1|N<2>,2|C<4>,4|H<1>}	H(C[6]C[6,6a]C[6,6])	118.5900	0.000	1	118.5900	0.000	1	119.2807	0.158	9	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:3:	3:	C[6,6a]-3:C[6,6]-3:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6,6]C[6,6]C[6])(H)	C[6,6](C[6,6]C[6]O[6]O)(C[6]C[6,6a]H)(C[6]C[6]O)	H(C[6]C[6,6a]C[6,6])	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6,6]C[6,6]C[6])(H){1|O<1>,2|C<4>,2|O<2>,3|C<3>}	C[6,6](C[6,6]C[6]O[6]O)(C[6]C[6,6a]H)(C[6]C[6]O){1|C<4>,2|C<3>,4|H<1>}	H(C[6]C[6,6a]C[6,6])	119.4370	0.000	1	119.4370	0.000	1	119.2807	0.158	9	118.9301	0.797	202	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:4:	3:	C[5a,6]-3:C[6,6]-3:H-1:	C[6,6]-4:C[6]-3:C[6]-4:	C[6]-3:	C[6](C[5a,6]C[5a,6]O[5a])(C[6,6]C[6,6]C[6])(H)	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[5a,6]H)(C[6]C[6]HH)	H(C[6]C[5a,6]C[6,6])	C[6](C[5a,6]C[5a,6]O[5a])(C[6,6]C[6,6]C[6])(H){1|C<3>,1|N<2>,2|H<1>,4|C<4>}	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[5a,6]H)(C[6]C[6]HH){1|C<3>,1|O<2>,2|C<4>,5|H<1>}	H(C[6]C[5a,6]C[6,6])	122.3910	0.000	1	122.3910	0.000	1	122.3910	0.000	1	119.5304	1.054	11	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:4:	3:	C[6,6]-3:C[5,6]-3:H-1:	C[6,6]-4:C[6]-3:C[6]-4:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[5,6]C[5,6]2)(H)	C[6,6](C[6,6]C[6]2H)(C[6]C[5,6]H)(C[6]C[6]HH)	H(C[6]C[5,6]C[6,6])	C[6](C[6,6]C[6,6]C[6])(C[5,6]C[5,6]2)(H){1|N<3>,2|C<3>,3|H<1>,4|C<4>}	C[6,6](C[6,6]C[6]2H)(C[6]C[5,6]H)(C[6]C[6]HH){1|C<3>,2|C<4>,6|H<1>}	H(C[6]C[5,6]C[6,6])	119.3460	0.000	1	119.0745	0.147	2	119.0745	0.147	2	119.5304	1.054	11	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:4:	3:	C[6,6]-3:C[5,6]-3:H-1:	C[6,6]-4:C[6]-3:C[6]-4:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[5,6]C[5,6]2)(H)	C[6,6](C[6,6]C[6]2H)(C[6]C[5,6]H)(C[6]C[6]HH)	H(C[6]C[5,6]C[6,6])	C[6](C[6,6]C[6,6]C[6])(C[5,6]C[5,6]2)(H){1|N<3>,2|C<3>,3|H<1>,4|C<4>}	C[6,6](C[6,6]C[6]2H)(C[6]C[5,6]H)(C[6]C[6]HH){2|C<3>,2|C<4>,5|H<1>}	H(C[6]C[5,6]C[6,6])	118.8030	0.000	1	119.0745	0.147	2	119.0745	0.147	2	119.5304	1.054	11	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:4:	3:	C[6,6]-3:C[6,6]-3:H-1:	C[5,6,6]-4:C[6]-3:C[6]-4:	C[6]-3:	C[6](C[6,6]C[5,6,6]C[6])2(H)	C[6,6](C[5,6,6]C[5,6]O[5,6]C[5])(C[6]C[6,6]H)(C[6]C[6]HH)	H(C[6]C[6,6]2)	C[6](C[6,6]C[5,6,6]C[6])2(H){1|C<3>,1|O<2>,3|H<1>,5|C<4>}	C[6,6](C[5,6,6]C[5,6]O[5,6]C[5])(C[6]C[6,6]H)(C[6]C[6]HH){1|C<3>,4|C<4>,5|H<1>}	H(C[6]C[6,6]2)	118.9380	0.000	1	118.9380	0.000	1	118.6560	0.159	2	119.5304	1.054	11	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:4:	3:	C[6,6]-3:C[6,6]-3:H-1:	C[5,6,6]-4:C[6]-3:C[6]-4:	C[6]-3:	C[6](C[6,6]C[5,6,6]C[6])2(H)	C[6,6](C[5,6,6]O[5,6]C[5]C[6])(C[6]C[6,6]H)(C[6]C[6]HO)	H(C[6]C[6,6]2)	C[6](C[6,6]C[5,6,6]C[6])2(H){2|H<1>,2|O<2>,6|C<4>}	C[6,6](C[5,6,6]O[5,6]C[5]C[6])(C[6]C[6,6]H)(C[6]C[6]HO){1|C<3>,1|O<2>,3|C<4>,5|H<1>}	H(C[6]C[6,6]2)	118.3740	0.000	1	118.3740	0.000	1	118.6560	0.159	2	119.5304	1.054	11	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:4:	3:	C[6,6a]-3:C[6,6]-3:H-1:	C[3x6]-4:C[6]-3:C[6]-4:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[3x6]C[6])(H)	C[6,6](C[3x6]C[6,6]O[6]2)(C[6]C[6,6a]H)(C[6]C[6]HH)	H(C[6]C[6,6a]C[6,6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[3x6]C[6])(H){1|C<4>,2|O<2>,3|C<3>,3|H<1>}	C[6,6](C[3x6]C[6,6]O[6]2)(C[6]C[6,6a]H)(C[6]C[6]HH){1|C<4>,2|H<1>,4|C<3>}	H(C[6]C[6,6a]C[6,6])	119.4230	0.228	2	119.4230	0.052	2	119.4230	0.052	2	119.5304	1.054	11	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:4:	3:	C[6,6a]-3:C[6,6]-3:H-1:	C[6,6]-4:C[6]-3:C[6]-4:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6,6]C[6])(H)	C[6,6](C[6,6]C[6,6a]C[6a]O[6])(C[6]C[6,6a]H)(C[6]O[6]HH)	H(C[6]C[6,6a]C[6,6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6,6]C[6])(H){2|O<2>,3|H<1>,4|C<3>}	C[6,6](C[6,6]C[6,6a]C[6a]O[6])(C[6]C[6,6a]H)(C[6]O[6]HH){6|C<3>}	H(C[6]C[6,6a]C[6,6])	119.5340	0.000	1	119.5340	0.000	1	119.5340	0.009	4	119.5304	1.054	11	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:4:	3:	C[6,6a]-3:C[6,6]-3:H-1:	C[6,6]-4:C[6]-3:C[6]-4:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6,6]C[6])(H)	C[6,6](C[6,6]C[6]O[6]C)(C[6]C[6,6a]H)(C[6]C[6]CC)	H(C[6]C[6,6a]C[6,6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6,6]C[6])(H){1|C<3>,1|N<3>,1|O<1>,1|O<2>,5|C<4>}	C[6,6](C[6,6]C[6]O[6]C)(C[6]C[6,6a]H)(C[6]C[6]CC){1|C<4>,2|C<3>,4|H<1>}	H(C[6]C[6,6a]C[6,6])	119.5310	0.000	1	119.5310	0.000	1	119.5340	0.009	4	119.5304	1.054	11	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:4:	3:	C[6,6a]-3:C[6,6]-3:H-1:	C[6,6]-4:C[6]-3:C[6]-4:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6,6]C[6])(H)	C[6,6](C[6,6]C[6]O[6]C)(C[6]C[6,6a]H)(C[6]C[6]HH)	H(C[6]C[6,6a]C[6,6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6,6]C[6])(H){1|C<3>,1|O<1>,2|H<1>,2|O<2>,3|C<4>}	C[6,6](C[6,6]C[6]O[6]C)(C[6]C[6,6a]H)(C[6]C[6]HH){1|C<4>,1|O<2>,2|C<3>,3|H<1>}	H(C[6]C[6,6a]C[6,6])	119.4220	0.000	1	119.4220	0.000	1	119.5340	0.009	4	119.5304	1.054	11	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:3:4:	3:	C[6,6a]-3:C[6,6]-3:H-1:	C[6,6]-4:C[6]-3:C[6]-4:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6,6]C[6])(H)	C[6,6](C[6,6]C[6]O[6]H)(C[6]C[6,6a]H)(C[6]C[6]HH)	H(C[6]C[6,6a]C[6,6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6,6]C[6])(H){1|C<3>,1|O<1>,2|C<4>,2|O<2>,3|H<1>}	C[6,6](C[6,6]C[6]O[6]H)(C[6]C[6,6a]H)(C[6]C[6]HH){1|C<4>,2|C<3>,4|H<1>}	H(C[6]C[6,6a]C[6,6])	119.6490	0.000	1	119.6490	0.000	1	119.5340	0.009	4	119.5304	1.054	11	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[3,6,6]-4:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[3,6,6]C[6,6])(C[6]C[5,6]O)(H)	C[6,6](C[3,6,6]C[3,6]C[5,6]O[3])(C[6,6]C[6,6]C[6]C)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[3,6,6]C[6,6])(C[6]C[5,6]O)(H){1|C<3>,1|O<2>,6|C<4>}	C[6,6](C[3,6,6]C[3,6]C[5,6]O[3])(C[6,6]C[6,6]C[6]C)(C[6]C[6]H){1|O<1>,4|H<1>,6|C<4>}	H(C[6]C[6,6]C[6])	117.4240	0.000	1	117.4240	0.000	1	118.8185	0.993	4	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[3,6,6]-4:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[3,6,6]C[6,6])(C[6]O[6]O)(H)	C[6,6](C[3,6,6]C[3,6]C[6]O[3])(C[6,6]C[5,6,6]C[6]C)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[3,6,6]C[6,6])(C[6]O[6]O)(H){1|O<2>,5|C<4>}	C[6,6](C[3,6,6]C[3,6]C[6]O[3])(C[6,6]C[5,6,6]C[6]C)(C[6]C[6]H){1|O<1>,1|O<2>,3|C<4>,6|H<1>}	H(C[6]C[6,6]C[6])	118.8120	0.000	1	119.2833	0.193	3	118.8185	0.993	4	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[3,6,6]-4:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[3,6,6]C[6,6])(C[6]O[6]O)(H)	C[6,6](C[3,6,6]C[3,6]C[6]O[3])(C[6,6]C[5,6,6]C[6]C)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[3,6,6]C[6,6])(C[6]O[6]O)(H){1|O<2>,5|C<4>}	C[6,6](C[3,6,6]C[3,6]C[6]O[3])(C[6,6]C[5,6,6]C[6]C)(C[6]C[6]H){1|O<1>,2|O<2>,3|C<4>,5|H<1>}	H(C[6]C[6,6]C[6])	119.5190	0.228	2	119.2833	0.193	3	118.8185	0.993	4	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[3,6]-4:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[3,6]C[6,6])(C[6]C[6]O)(H)	C[6,6](C[3,6]C[3,6]C[3]H)(C[6,6]C[6,6]C[6]C)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[3,6]C[6,6])(C[6]C[6]O)(H){3|H<1>,5|C<4>}	C[6,6](C[3,6]C[3,6]C[3]H)(C[6,6]C[6,6]C[6]C)(C[6]C[6]H){1|O<1>,3|C<4>,6|H<1>}	H(C[6]C[6,6]C[6])	117.7235	0.016	2	117.7235	0.000	2	117.8650	0.060	3	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[3,6]-4:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[3,6]C[6,6])(C[6]C[6]O)(H)	C[6,6](C[3,6]C[3,6]O[3]H)(C[6,6]C[6,6]C[6]C)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[3,6]C[6,6])(C[6]C[6]O)(H){1|O<2>,3|H<1>,4|C<4>}	C[6,6](C[3,6]C[3,6]O[3]H)(C[6,6]C[6,6]C[6]C)(C[6]C[6]H){1|O<1>,3|C<4>,4|H<1>}	H(C[6]C[6,6]C[6])	118.1480	0.000	1	118.1480	0.000	1	117.8650	0.060	3	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[3x6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[3x6]C[6])(C[6]C[6,6]H)(H)	C[6,6](C[3x6]C[3x6]C[6,6]C)(C[6]C[6]FeH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[3x6]C[6])(C[6]C[6,6]H)(H){1|Fe<7>,1|C<3>,1|H<1>,4|C<4>}	C[6,6](C[3x6]C[3x6]C[6,6]C)(C[6]C[6]FeH)(C[6]C[6]H){1|H<1>,3|C<3>,3|C<4>}	H(C[6]C[6,6]C[6])	119.9200	0.000	1	119.7957	0.025	3	119.1628	0.779	5	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[3x6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[3x6]C[6])(C[6]C[6,6]H)(H)	C[6,6](C[3x6]C[3x6]C[6,6]C)(C[6]C[6]FeH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[3x6]C[6])(C[6]C[6,6]H)(H){1|Fe<7>,1|H<1>,5|C<4>}	C[6,6](C[3x6]C[3x6]C[6,6]C)(C[6]C[6]FeH)(C[6]C[6]H){1|H<1>,2|C<3>,4|C<4>}	H(C[6]C[6,6]C[6])	119.7335	0.166	2	119.7957	0.025	3	119.1628	0.779	5	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[3x6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[3x6]C[6])(C[6]C[6]O)(H)	C[6,6](C[3x6]C[6,6]C[6]O[6])(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[3x6]C[6])(C[6]C[6]O)(H){1|O<2>,3|C<4>,4|H<1>}	C[6,6](C[3x6]C[6,6]C[6]O[6])(C[6]C[6]HH)(C[6]C[6]H){1|N<3>,1|O<1>,3|C<4>,5|H<1>}	H(C[6]C[6,6]C[6])	118.0390	0.000	1	118.0390	0.000	1	119.1628	0.779	5	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[3x6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[3x6]C[6])(C[6]O[6]O)(H)	C[6,6](C[3x6]C[6,6]2C)(C[6]C[5]C[6]C)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[3x6]C[6])(C[6]O[6]O)(H){6|C<4>}	C[6,6](C[3x6]C[6,6]2C)(C[6]C[5]C[6]C)(C[6]C[6]H){1|O<1>,2|O<2>,4|C<4>,5|H<1>}	H(C[6]C[6,6]C[6])	118.3880	0.000	1	118.3880	0.000	1	119.1628	0.779	5	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[4x6]-4:C[3,6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[3,6,6]C[4x6])(C[6]O[6]O)(H)	C[6,6](C[4x6]C[5,6,6]C[3x6]C[6,6])(C[3,6,6]C[3,6]C[6]O[3])(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[3,6,6]C[4x6])(C[6]O[6]O)(H){1|O<2>,5|C<4>}	C[6,6](C[4x6]C[5,6,6]C[3x6]C[6,6])(C[3,6,6]C[3,6]C[6]O[3])(C[6]C[6]H){1|O<1>,3|H<1>,3|O<2>,7|C<4>}	H(C[6]C[6,6]C[6])	118.9868	0.211	4	118.9868	0.044	4	118.9868	0.044	4	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[4x6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[4x6]C[6])(C[6]O[6]O)(H)	C[6,6](C[4x6]C[4x6]C[6,6]C[6])(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[4x6]C[6])(C[6]O[6]O)(H){2|H<1>,4|C<4>}	C[6,6](C[4x6]C[4x6]C[6,6]C[6])(C[6]C[6]HH)(C[6]C[6]H){1|O<1>,3|C<4>,3|O<2>,5|H<1>}	H(C[6]C[6,6]C[6])	118.6850	0.096	2	118.6850	0.009	2	118.6850	0.009	2	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[5,5,6]-4:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[5,5,6]C[6,6])(C[6]O[6]O)(H)	C[6,6](C[5,5,6]C[3x5,6]C[5,6]O[5])(C[6,6]C[6]2C)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,5,6]C[6,6])(C[6]O[6]O)(H){1|O<2>,5|C<4>}	C[6,6](C[5,5,6]C[3x5,6]C[5,6]O[5])(C[6,6]C[6]2C)(C[6]C[6]H){1|O<1>,1|O<2>,2|C<3>,4|C<4>,5|H<1>}	H(C[6]C[6,6]C[6])	118.6900	0.000	1	118.6900	0.000	1	118.6900	0.000	1	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[5,6,6]-4:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[5,6,6]C[6,6])(C[6]C[5,6]O)(H)	C[6,6](C[5,6,6]C[5,6]C[5]C[6])(C[6,6]C[6,6]C[6]C)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6,6]C[6,6])(C[6]C[5,6]O)(H){1|H<1>,2|C<3>,5|C<4>}	C[6,6](C[5,6,6]C[5,6]C[5]C[6])(C[6,6]C[6,6]C[6]C)(C[6]C[6]H){1|C<3>,2|O<1>,4|C<4>,7|H<1>}	H(C[6]C[6,6]C[6])	118.9900	0.000	1	119.1337	0.032	6	119.3835	0.391	11	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[5,6,6]-4:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[5,6,6]C[6,6])(C[6]C[5,6]O)(H)	C[6,6](C[5,6,6]C[5,6]C[5]C[6])(C[6,6]C[6,6]C[6]C)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6,6]C[6,6])(C[6]C[5,6]O)(H){1|H<1>,3|C<3>,4|C<4>}	C[6,6](C[5,6,6]C[5,6]C[5]C[6])(C[6,6]C[6,6]C[6]C)(C[6]C[6]H){1|C<3>,2|O<1>,4|C<4>,6|H<1>}	H(C[6]C[6,6]C[6])	119.1180	0.334	2	119.1337	0.032	6	119.3835	0.391	11	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[5,6,6]-4:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[5,6,6]C[6,6])(C[6]C[5,6]O)(H)	C[6,6](C[5,6,6]C[5,6]C[5]C[6])(C[6,6]C[6,6]C[6]C)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6,6]C[6,6])(C[6]C[5,6]O)(H){1|H<1>,7|C<4>}	C[6,6](C[5,6,6]C[5,6]C[5]C[6])(C[6,6]C[6,6]C[6]C)(C[6]C[6]H){1|O<1>,1|O<2>,5|C<4>,8|H<1>}	H(C[6]C[6,6]C[6])	119.1920	0.099	3	119.1337	0.032	6	119.3835	0.391	11	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[5,6,6]-4:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[5,6,6]C[6,6])(C[6]C[5,6]O)(H)	C[6,6](C[5,6,6]O[5,6]C[6]O[5])(C[6,6]C[6,6]C[6]H)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6,6]C[6,6])(C[6]C[5,6]O)(H){2|H<1>,2|O<2>,4|C<4>}	C[6,6](C[5,6,6]O[5,6]C[6]O[5])(C[6,6]C[6,6]C[6]H)(C[6]C[6]H){1|C<3>,1|O<1>,4|H<1>,5|C<4>}	H(C[6]C[6,6]C[6])	120.3985	0.125	2	120.3985	0.016	2	119.3835	0.391	11	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[5,6,6]-4:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[5,6,6]C[6,6])(C[6]C[5,6]O)(H)	C[6,6](C[5,6,6]O[5,6]C[6]O[5])(C[6,6]C[6,6]C[6]O)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6,6]C[6,6])(C[6]C[5,6]O)(H){1|H<1>,3|O<2>,4|C<4>}	C[6,6](C[5,6,6]O[5,6]C[6]O[5])(C[6,6]C[6,6]C[6]O)(C[6]C[6]H){1|O<1>,4|H<1>,6|C<4>}	H(C[6]C[6,6]C[6])	120.0930	0.000	1	120.0930	0.000	1	119.3835	0.391	11	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[5,6,6]-4:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[5,6,6]C[6,6])(C[6]C[6]H)(H)	C[6,6](C[5,6,6]C[5,6]C[5]C[6])(C[6,6]C[6,6]C[6]C)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6,6]C[6,6])(C[6]C[6]H)(H){1|H<1>,6|C<4>}	C[6,6](C[5,6,6]C[5,6]C[5]C[6])(C[6,6]C[6,6]C[6]C)(C[6]C[6]H){1|O<2>,2|C<4>,3|C<3>,9|H<1>}	H(C[6]C[6,6]C[6])	118.6570	0.000	1	118.7635	0.023	2	119.3835	0.391	11	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[5,6,6]-4:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[5,6,6]C[6,6])(C[6]C[6]H)(H)	C[6,6](C[5,6,6]C[5,6]C[5]C[6])(C[6,6]C[6,6]C[6]C)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6,6]C[6,6])(C[6]C[6]H)(H){1|H<1>,6|C<4>}	C[6,6](C[5,6,6]C[5,6]C[5]C[6])(C[6,6]C[6,6]C[6]C)(C[6]C[6]H){2|C<4>,2|O<2>,3|C<3>,8|H<1>}	H(C[6]C[6,6]C[6])	118.8700	0.000	1	118.7635	0.023	2	119.3835	0.391	11	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[5,6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[5,6,6]C[6])(C[6]C[5,6]O)(H)	C[6,6](C[5,6,6]O[5,6]C[5]C[6])(C[6]C[6]CH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6,6]C[6])(C[6]C[5,6]O)(H){1|C<3>,1|O<2>,2|H<1>,4|C<4>}	C[6,6](C[5,6,6]O[5,6]C[5]C[6])(C[6]C[6]CH)(C[6]C[6]H){1|O<1>,4|H<1>,5|C<4>}	H(C[6]C[6,6]C[6])	120.1490	0.000	1	120.1490	0.000	1	119.1200	1.295	5	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[5,6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[5,6,6]C[6])(C[6]C[6]C)(H)	C[6,6](C[5,6,6]C[5,6]2C)(C[6]C[6]CC)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6,6]C[6])(C[6]C[6]C)(H){1|C<3>,6|C<4>}	C[6,6](C[5,6,6]C[5,6]2C)(C[6]C[6]CC)(C[6]C[6]H){1|C<4>,1|O<2>,3|C<3>,4|H<1>}	H(C[6]C[6,6]C[6])	120.2690	0.000	1	120.2690	0.000	1	119.1200	1.295	5	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[5,6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[5,6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[5,6,6]C[5,6]2H)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6,6]C[6])(C[6]C[6]H)(H){1|C<3>,2|C<4>,4|H<1>}	C[6,6](C[5,6,6]C[5,6]2H)(C[6]C[6]HH)(C[6]C[6]H){1|C<4>,1|N<3>,2|C<3>,4|H<1>}	H(C[6]C[6,6]C[6])	119.2000	0.000	1	119.2000	0.000	1	119.1200	1.295	5	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[5,6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[5,6,6]C[6])(C[6]C[6]O)(H)	C[6,6](C[5,6,6]C[5,6]2O)(C[6]C[6]CH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6,6]C[6])(C[6]C[6]O)(H){1|O<2>,2|H<1>,5|C<4>}	C[6,6](C[5,6,6]C[5,6]2O)(C[6]C[6]CH)(C[6]C[6]H){1|C<3>,1|O<1>,1|O<2>,2|C<4>,4|H<1>}	H(C[6]C[6,6]C[6])	118.3420	0.000	1	118.3420	0.000	1	119.1200	1.295	5	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[5,6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[5,6,6]C[6])(C[6]O[6]O)(H)	C[6,6](C[5,6,6]C[5,6]C[6]O[5])(C[6]C[6]CC)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6,6]C[6])(C[6]O[6]O)(H){1|O<2>,5|C<4>}	C[6,6](C[5,6,6]C[5,6]C[6]O[5])(C[6]C[6]CC)(C[6]C[6]H){1|O<1>,1|O<2>,2|C<3>,2|C<4>,4|H<1>}	H(C[6]C[6,6]C[6])	117.6400	0.000	1	117.6400	0.000	1	119.1200	1.295	5	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[5,6]-4:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6,6]H)(H)	C[6,6](C[5,6]C[5,6]C[5]H)(C[6,6]C[6,6]C[6]H)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6,6]H)(H){2|H<1>,5|C<4>}	C[6,6](C[5,6]C[5,6]C[5]H)(C[6,6]C[6,6]C[6]H)(C[6]C[6]H){1|C<3>,5|H<1>,6|C<4>}	H(C[6]C[6,6]C[6])	119.2440	0.000	1	119.2440	0.000	1	118.8852	0.145	10	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[5,6]-4:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6,6]H)(H)	C[6,6](C[5,6]C[5,6]O[5]C)(C[6,6]C[6,6]C[6]C)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6,6]H)(H){1|O<2>,6|C<4>}	C[6,6](C[5,6]C[5,6]O[5]C)(C[6,6]C[6,6]C[6]C)(C[6]C[6]H){2|C<3>,4|C<4>,4|H<1>}	H(C[6]C[6,6]C[6])	119.0970	0.000	1	119.0970	0.000	1	118.8852	0.145	10	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[5,6]-4:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6,6]O)(H)	C[6,6](C[5,6]C[5,6]C[5]C)(C[6,6]C[6,6]C[6]H)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6,6]O)(H){2|H<1>,6|C<4>}	C[6,6](C[5,6]C[5,6]C[5]C)(C[6,6]C[6,6]C[6]H)(C[6]C[6]H){1|O<1>,4|H<1>,7|C<4>}	H(C[6]C[6,6]C[6])	118.5860	0.000	1	118.5860	0.000	1	118.8852	0.145	10	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[5,6]-4:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6,6]O)(H)	C[6,6](C[5,6]C[5,6]C[5]H)(C[6,6]C[6,6]C[6]O)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6,6]O)(H){1|H<1>,2|O<2>,5|C<4>}	C[6,6](C[5,6]C[5,6]C[5]H)(C[6,6]C[6,6]C[6]O)(C[6]C[6]H){1|O<1>,4|H<1>,7|C<4>}	H(C[6]C[6,6]C[6])	118.4700	0.000	1	118.4700	0.000	1	118.8852	0.145	10	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[5,6]-4:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6,6]O)(H)	C[6,6](C[5,6]C[5,6]C[5]H)(C[6,6]C[6]O[6]O)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6,6]O)(H){1|H<1>,2|O<2>,5|C<4>}	C[6,6](C[5,6]C[5,6]C[5]H)(C[6,6]C[6]O[6]O)(C[6]C[6]H){1|O<1>,4|H<1>,5|C<4>}	H(C[6]C[6,6]C[6])	118.2600	0.000	1	118.2600	0.000	1	118.8852	0.145	10	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[5,6]-4:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6,6]O)(H)	C[6,6](C[5,6]C[5,6]C[5]O)(C[6,6]C[6,6]C[6]H)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6,6]O)(H){1|C<3>,1|H<1>,1|O<2>,4|C<4>}	C[6,6](C[5,6]C[5,6]C[5]O)(C[6,6]C[6,6]C[6]H)(C[6]C[6]H){1|C<3>,1|O<1>,4|H<1>,6|C<4>}	H(C[6]C[6,6]C[6])	119.4200	0.000	1	119.0390	0.090	5	118.8852	0.145	10	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[5,6]-4:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6,6]O)(H)	C[6,6](C[5,6]C[5,6]C[5]O)(C[6,6]C[6,6]C[6]H)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6,6]O)(H){1|H<1>,2|O<2>,5|C<4>}	C[6,6](C[5,6]C[5,6]C[5]O)(C[6,6]C[6,6]C[6]H)(C[6]C[6]H){1|O<1>,4|H<1>,7|C<4>}	H(C[6]C[6,6]C[6])	118.8350	0.348	2	119.0390	0.090	5	118.8852	0.145	10	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[5,6]-4:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6,6]O)(H)	C[6,6](C[5,6]C[5,6]C[5]O)(C[6,6]C[6,6]C[6]H)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6,6]O)(H){1|O<2>,2|H<1>,5|C<4>}	C[6,6](C[5,6]C[5,6]C[5]O)(C[6,6]C[6,6]C[6]H)(C[6]C[6]H){1|O<1>,4|H<1>,7|C<4>}	H(C[6]C[6,6]C[6])	119.0525	0.093	2	119.0390	0.090	5	118.8852	0.145	10	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[5,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[3,6,6]O)(H)	C[6,6](C[6,6]C[3,6,6]C[6]H)(C[5,6]C[5,6]C[5]H)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[3,6,6]O)(H){2|H<1>,6|C<4>}	C[6,6](C[6,6]C[3,6,6]C[6]H)(C[5,6]C[5,6]C[5]H)(C[6]C[6]H){1|O<1>,4|H<1>,7|C<4>}	H(C[6]C[6,6]C[6])	117.9570	0.000	1	117.9570	0.000	1	117.9570	0.000	1	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]2)(C[6]C[3x6]O)(H)	C[6,6](C[6,6]C[4x6]C[6]C)(C[6,6]C[6,6]C[6]C)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2)(C[6]C[3x6]O)(H){8|C<4>}	C[6,6](C[6,6]C[4x6]C[6]C)(C[6,6]C[6,6]C[6]C)(C[6]C[6]H){1|O<1>,1|O<2>,5|C<4>,5|H<1>}	H(C[6]C[6,6]C[6])	117.6520	0.000	1	117.6520	0.000	1	117.7719	0.231	42	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]2)(C[6]C[5,6,6]O)(H)	C[6,6](C[6,6]C[6,6]C[6]C)(C[6,6]C[6,6]C[6]H)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2)(C[6]C[5,6,6]O)(H){1|H<1>,1|O<2>,6|C<4>}	C[6,6](C[6,6]C[6,6]C[6]C)(C[6,6]C[6,6]C[6]H)(C[6]C[6]H){1|C<3>,1|O<1>,4|H<1>,6|C<4>}	H(C[6]C[6,6]C[6])	117.0030	0.000	1	117.1487	0.025	3	117.7719	0.231	42	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]2)(C[6]C[5,6,6]O)(H)	C[6,6](C[6,6]C[6,6]C[6]C)(C[6,6]C[6,6]C[6]H)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2)(C[6]C[5,6,6]O)(H){1|H<1>,1|O<2>,6|C<4>}	C[6,6](C[6,6]C[6,6]C[6]C)(C[6,6]C[6,6]C[6]H)(C[6]C[6]H){1|O<1>,4|H<1>,7|C<4>}	H(C[6]C[6,6]C[6])	117.2215	0.136	2	117.1487	0.025	3	117.7719	0.231	42	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]2)(C[6]C[5,6,6]O)(H)	C[6,6](C[6,6]C[6,6]C[6]C)2(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2)(C[6]C[5,6,6]O)(H){1|C<3>,1|O<2>,6|C<4>}	C[6,6](C[6,6]C[6,6]C[6]C)2(C[6]C[6]H){1|C<3>,1|O<1>,4|H<1>,5|C<4>}	H(C[6]C[6,6]C[6])	117.4530	0.000	1	117.4530	0.000	1	117.7719	0.231	42	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]2)(C[6]C[5,6]O)(H)	C[6,6](C[6,6]C[5,6]C[6]H)(C[6,6]C[6,6]C[6]C)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2)(C[6]C[5,6]O)(H){1|H<1>,7|C<4>}	C[6,6](C[6,6]C[5,6]C[6]H)(C[6,6]C[6,6]C[6]C)(C[6]C[6]H){1|O<1>,5|C<4>,6|H<1>}	H(C[6]C[6,6]C[6])	117.9800	0.000	1	117.9800	0.000	1	117.7719	0.231	42	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]2)(C[6]C[6,6]H)(H)	C[6,6](C[6,6]C[6,6]C[6]C)(C[6,6]C[6,6]C[6]H)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2)(C[6]C[6,6]H)(H){1|H<1>,6|C<4>}	C[6,6](C[6,6]C[6,6]C[6]C)(C[6,6]C[6,6]C[6]H)(C[6]C[6]H){2|C<3>,5|C<4>,5|H<1>}	H(C[6]C[6,6]C[6])	116.7630	0.000	1	116.7630	0.000	1	117.7719	0.231	42	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]2)(C[6]C[6,6]O)(H)	C[6,6](C[6,6]C[6,6]C[6]C)(C[6,6]C[6,6]C[6]H)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2)(C[6]C[6,6]O)(H){1|H<1>,1|O<2>,6|C<4>}	C[6,6](C[6,6]C[6,6]C[6]C)(C[6,6]C[6,6]C[6]H)(C[6]C[6]H){1|C<3>,1|O<1>,4|H<1>,6|C<4>}	H(C[6]C[6,6]C[6])	117.5343	0.304	3	117.6569	0.096	21	117.7719	0.231	42	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]2)(C[6]C[6,6]O)(H)	C[6,6](C[6,6]C[6,6]C[6]C)(C[6,6]C[6,6]C[6]H)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2)(C[6]C[6,6]O)(H){2|H<1>,6|C<4>}	C[6,6](C[6,6]C[6,6]C[6]C)(C[6,6]C[6,6]C[6]H)(C[6]C[6]H){1|C<3>,1|O<1>,4|H<1>,6|C<4>}	H(C[6]C[6,6]C[6])	117.5080	0.021	2	117.6569	0.096	21	117.7719	0.231	42	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]2)(C[6]C[6,6]O)(H)	C[6,6](C[6,6]C[6,6]C[6]C)(C[6,6]C[6,6]C[6]H)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2)(C[6]C[6,6]O)(H){2|H<1>,6|C<4>}	C[6,6](C[6,6]C[6,6]C[6]C)(C[6,6]C[6,6]C[6]H)(C[6]C[6]H){1|O<1>,3|H<1>,8|C<4>}	H(C[6]C[6,6]C[6])	118.7630	0.000	1	117.6569	0.096	21	117.7719	0.231	42	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]2)(C[6]C[6,6]O)(H)	C[6,6](C[6,6]C[6,6]C[6]C)(C[6,6]C[6,6]C[6]H)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2)(C[6]C[6,6]O)(H){2|H<1>,6|C<4>}	C[6,6](C[6,6]C[6,6]C[6]C)(C[6,6]C[6,6]C[6]H)(C[6]C[6]H){1|O<1>,4|H<1>,7|C<4>}	H(C[6]C[6,6]C[6])	117.6275	0.171	15	117.6569	0.096	21	117.7719	0.231	42	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]2)(C[6]C[6,6]O)(H)	C[6,6](C[6,6]C[6,6]C[6]C)2(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2)(C[6]C[6,6]O)(H){1|C<3>,1|H<1>,6|C<4>}	C[6,6](C[6,6]C[6,6]C[6]C)2(C[6]C[6]H){1|C<3>,1|O<1>,4|H<1>,5|C<4>}	H(C[6]C[6,6]C[6])	118.2420	0.000	1	117.8855	0.254	2	117.7719	0.231	42	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]2)(C[6]C[6,6]O)(H)	C[6,6](C[6,6]C[6,6]C[6]C)2(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2)(C[6]C[6,6]O)(H){1|C<3>,6|C<4>}	C[6,6](C[6,6]C[6,6]C[6]C)2(C[6]C[6]H){1|C<3>,1|O<1>,5|C<4>,5|H<1>}	H(C[6]C[6,6]C[6])	117.5290	0.000	1	117.8855	0.254	2	117.7719	0.231	42	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]2)(C[6]C[6]O)(H)	C[6,6](C[6,6]C[6,6]C[6]C)(C[6,6]C[6]2C)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2)(C[6]C[6]O)(H){1|C<2>,1|C<3>,2|H<1>,4|C<4>}	C[6,6](C[6,6]C[6,6]C[6]C)(C[6,6]C[6]2C)(C[6]C[6]H){2|O<1>,4|H<1>,5|C<4>}	H(C[6]C[6,6]C[6])	117.6710	0.000	2	117.9800	0.100	7	117.7719	0.231	42	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]2)(C[6]C[6]O)(H)	C[6,6](C[6,6]C[6,6]C[6]C)(C[6,6]C[6]2C)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2)(C[6]C[6]O)(H){1|C<3>,2|H<1>,5|C<4>}	C[6,6](C[6,6]C[6,6]C[6]C)(C[6,6]C[6]2C)(C[6]C[6]H){1|O<1>,1|O<2>,4|C<4>,6|H<1>}	H(C[6]C[6,6]C[6])	118.5810	0.000	1	117.9800	0.100	7	117.7719	0.231	42	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]2)(C[6]C[6]O)(H)	C[6,6](C[6,6]C[6,6]C[6]C)(C[6,6]C[6]2C)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2)(C[6]C[6]O)(H){2|C<2>,2|C<3>,3|C<4>}	C[6,6](C[6,6]C[6,6]C[6]C)(C[6,6]C[6]2C)(C[6]C[6]H){1|O<1>,2|C<3>,2|C<4>,5|H<1>}	H(C[6]C[6,6]C[6])	117.9435	0.023	2	117.9800	0.100	7	117.7719	0.231	42	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]2)(C[6]C[6]O)(H)	C[6,6](C[6,6]C[6,6]C[6]C)(C[6,6]C[6]2C)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2)(C[6]C[6]O)(H){2|C<3>,2|H<1>,4|C<4>}	C[6,6](C[6,6]C[6,6]C[6]C)(C[6,6]C[6]2C)(C[6]C[6]H){2|O<1>,4|C<4>,5|H<1>}	H(C[6]C[6,6]C[6])	118.0250	0.197	2	117.9800	0.100	7	117.7719	0.231	42	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]2)(C[6]C[6]O)(H)	C[6,6](C[6,6]C[6,6]C[6]C)(C[6,6]C[6]2O)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2)(C[6]C[6]O)(H){1|C<3>,1|O<2>,5|C<4>}	C[6,6](C[6,6]C[6,6]C[6]C)(C[6,6]C[6]2O)(C[6]C[6]H){1|C<3>,1|O<1>,3|C<4>,6|H<1>}	H(C[6]C[6,6]C[6])	118.2600	0.000	1	118.2600	0.000	1	117.7719	0.231	42	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]2)(C[6]C[6]O)(H)	C[6,6](C[6,6]C[6,6]C[6]O)(C[6,6]C[6]O[6]H)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2)(C[6]C[6]O)(H){2|H<1>,2|O<2>,4|C<4>}	C[6,6](C[6,6]C[6,6]C[6]O)(C[6,6]C[6]O[6]H)(C[6]C[6]H){1|O<1>,4|H<1>,5|C<4>}	H(C[6]C[6,6]C[6])	118.7795	0.070	2	118.7795	0.005	2	117.7719	0.231	42	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]2)(C[6]O[6]O)(H)	C[6,6](C[6,6]C[6,6]C[6]H)(C[6,6]C[6]2C)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2)(C[6]O[6]O)(H){1|H<1>,5|C<4>}	C[6,6](C[6,6]C[6,6]C[6]H)(C[6,6]C[6]2C)(C[6]C[6]H){1|C<3>,1|O<1>,2|C<4>,2|O<2>,6|H<1>}	H(C[6]C[6,6]C[6])	118.9560	0.000	1	118.9560	0.000	1	117.7719	0.231	42	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]2)(C[6]O[6]O)(H)	C[6,6](C[6,6]C[6,6]C[6]O)(C[6,6]C[6]2C)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2)(C[6]O[6]O)(H){1|O<2>,5|C<4>}	C[6,6](C[6,6]C[6,6]C[6]O)(C[6,6]C[6]2C)(C[6]C[6]H){1|C<3>,1|O<1>,2|C<4>,4|H<1>,4|O<2>}	H(C[6]C[6,6]C[6])	117.9250	0.000	1	117.9250	0.000	1	117.7719	0.231	42	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]H)(H)	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]H)(H){2|H<1>,5|C<4>}	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]HH)(C[6]C[6]H){1|C<3>,1|O<2>,2|C<4>,5|H<1>}	H(C[6]C[6,6]C[6])	118.8810	0.000	1	118.8810	0.000	1	118.4230	0.986	193	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]H)(H)	C[6,6](C[6,6]C[6,6]C[6]H)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]H)(H){1|C<3>,3|C<4>,3|H<1>}	C[6,6](C[6,6]C[6,6]C[6]H)(C[6]C[6]HH)(C[6]C[6]H){2|C<3>,2|C<4>,5|H<1>}	H(C[6]C[6,6]C[6])	119.3130	0.000	1	119.3130	0.000	1	118.4230	0.986	193	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]H)(H)	C[6,6](C[6,6]C[6,6]N[6]Zr)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]H)(H){1|Zr<7>,1|N<4>,2|H<1>,3|C<4>}	C[6,6](C[6,6]C[6,6]N[6]Zr)(C[6]C[6]HH)(C[6]C[6]H){1|Al<4>,1|C<3>,1|C<4>,1|N<4>,3|H<1>}	H(C[6]C[6,6]C[6])	118.8825	0.189	2	118.8825	0.036	2	118.4230	0.986	193	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]O)(H)	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]O)(H){1|C<3>,3|H<1>,4|C<4>}	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]HH)(C[6]C[6]H){1|O<1>,3|C<4>,5|H<1>}	H(C[6]C[6,6]C[6])	118.1830	0.000	1	118.0760	0.084	4	118.4230	0.986	193	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]O)(H)	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]O)(H){3|H<1>,5|C<4>}	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]HH)(C[6]C[6]H){1|Cl<1>,1|O<1>,3|C<4>,4|H<1>}	H(C[6]C[6,6]C[6])	118.1110	0.000	1	118.0760	0.084	4	118.4230	0.986	193	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]O)(H)	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]O)(H){3|H<1>,5|C<4>}	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]HH)(C[6]C[6]H){1|O<1>,1|O<2>,3|C<4>,4|H<1>}	H(C[6]C[6,6]C[6])	118.3440	0.000	1	118.0760	0.084	4	118.4230	0.986	193	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]O)(H)	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]O)(H){3|H<1>,5|C<4>}	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]HH)(C[6]C[6]H){1|O<1>,3|C<4>,5|H<1>}	H(C[6]C[6,6]C[6])	117.6660	0.000	1	118.0760	0.084	4	118.4230	0.986	193	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]O)(H)	C[6,6](C[6,6]C[6,6]C[6]O)(C[6]C[6]CC)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]O)(H){1|C<3>,1|O<2>,5|C<4>}	C[6,6](C[6,6]C[6,6]C[6]O)(C[6]C[6]CC)(C[6]C[6]H){1|C<3>,1|O<1>,1|O<2>,2|C<4>,4|H<1>}	H(C[6]C[6,6]C[6])	117.8510	0.000	1	117.8510	0.000	1	118.4230	0.986	193	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6a]O)(H)	C[6,6](C[6,6]C[6,6a]C[6]C)(C[6]C[6]CC)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6a]O)(H){2|C<3>,5|C<4>}	C[6,6](C[6,6]C[6,6a]C[6]C)(C[6]C[6]CC)(C[6]C[6]H){1|C<4>,1|O<1>,2|C<3>,4|H<1>}	H(C[6]C[6,6]C[6])	117.9970	0.000	1	117.9970	0.000	1	118.4230	0.986	193	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]C)(H)	C[6,6](C[6,6]C[6,6]C[6]H)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]C)(H){3|C<4>,5|H<1>}	C[6,6](C[6,6]C[6,6]C[6]H)(C[6]C[6]HH)(C[6]C[6]H){1|C<3>,4|C<4>,4|H<1>}	H(C[6]C[6,6]C[6])	118.5650	0.000	1	118.5650	0.000	1	118.4230	0.986	193	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]C)(H)	C[6,6](C[6,6]C[6]O[6]Th)(C[6]C[6,6]CC)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]C)(H){1|Th<17>,1|C<3>,1|H<1>,1|O<3>,3|C<4>}	C[6,6](C[6,6]C[6]O[6]Th)(C[6]C[6,6]CC)(C[6]C[6]H){1|N<3>,2|C<3>,2|C<4>}	H(C[6]C[6,6]C[6])	118.6605	0.537	2	118.6605	0.288	2	118.4230	0.986	193	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]C[6]2Rh)(C[6]C[6]RhH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|Rh<7>,1|C<3>,2|C<4>,2|H<1>}	C[6,6](C[6,6]C[6]2Rh)(C[6]C[6]RhH)(C[6]C[6]H){1|C<4>,2|C<3>,3|H<1>}	H(C[6]C[6,6]C[6])	119.5890	0.000	1	119.5890	0.000	1	118.4230	0.986	193	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]C[6]N[6]Zr)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|Zr<11>,1|C<3>,1|C<4>,1|N<3>,3|H<1>}	C[6,6](C[6,6]C[6]N[6]Zr)(C[6]C[6]HH)(C[6]C[6]H){1|C<3>,1|C<4>,1|C<5>,3|H<1>}	H(C[6]C[6,6]C[6])	117.6170	0.000	1	117.6170	0.000	1	118.4230	0.986	193	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6,6]C[6]O[6]Li)(C[6]C[6,6]CC)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|Li<5>,1|C<3>,1|H<1>,1|O<3>,3|C<4>}	C[6,6](C[6,6]C[6]O[6]Li)(C[6]C[6,6]CC)(C[6]C[6]H){1|Li<4>,1|H<1>,3|C<3>}	H(C[6]C[6,6]C[6])	119.9350	0.000	1	119.9350	0.000	1	118.4230	0.986	193	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]N)(H)	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]N)(H){4|C<4>,4|H<1>}	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]HH)(C[6]C[6]H){1|N<2>,3|C<4>,5|H<1>}	H(C[6]C[6,6]C[6])	118.2600	1.059	3	118.2600	1.121	3	118.4230	0.986	193	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6,6](C[6,6]C[3,6,6]C[6]C)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){1|C<3>,3|C<4>,3|H<1>}	C[6,6](C[6,6]C[3,6,6]C[6]C)(C[6]C[6]HH)(C[6]C[6]H){1|C<3>,1|O<1>,1|O<2>,2|C<4>,3|H<1>}	H(C[6]C[6,6]C[6])	118.5545	0.173	2	118.5545	0.030	2	118.4230	0.986	193	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6,6](C[6,6]C[5,6]C[6]C)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){4|C<4>,4|H<1>}	C[6,6](C[6,6]C[5,6]C[6]C)(C[6]C[6]HH)(C[6]C[6]H){1|C<3>,1|O<1>,3|C<4>,4|H<1>}	H(C[6]C[6,6]C[6])	117.8410	0.000	1	118.0720	0.041	3	118.4230	0.986	193	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6,6](C[6,6]C[5,6]C[6]C)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){4|C<4>,4|H<1>}	C[6,6](C[6,6]C[5,6]C[6]C)(C[6]C[6]HH)(C[6]C[6]H){1|O<1>,2|C<4>,2|O<2>,4|H<1>}	H(C[6]C[6,6]C[6])	118.1875	0.035	2	118.0720	0.041	3	118.4230	0.986	193	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]CH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){3|H<1>,5|C<4>}	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]CH)(C[6]C[6]H){1|O<1>,3|C<4>,5|H<1>}	H(C[6]C[6,6]C[6])	117.6313	0.315	3	117.6313	0.099	3	118.4230	0.986	193	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]FH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){1|F<1>,3|H<1>,4|C<4>}	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]FH)(C[6]C[6]H){1|O<1>,3|C<4>,5|H<1>}	H(C[6]C[6,6]C[6])	118.2690	0.000	1	118.2690	0.000	1	118.4230	0.986	193	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){1|Br<1>,1|C<3>,2|H<1>,3|C<4>}	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]HH)(C[6]C[6]H){1|Cl<1>,1|C<3>,1|O<1>,2|C<4>,3|H<1>}	H(C[6]C[6,6]C[6])	118.4015	0.214	2	118.3915	1.350	116	118.4230	0.986	193	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){1|C<3>,3|C<4>,3|H<1>}	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]HH)(C[6]C[6]H){1|Br<1>,1|C<3>,1|O<1>,2|C<4>,3|H<1>}	H(C[6]C[6,6]C[6])	118.3430	0.059	2	118.3915	1.350	116	118.4230	0.986	193	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){1|C<3>,3|C<4>,3|H<1>}	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]HH)(C[6]C[6]H){1|C<3>,1|F<1>,1|O<1>,2|C<4>,3|H<1>}	H(C[6]C[6,6]C[6])	118.5861	0.373	8	118.3915	1.350	116	118.4230	0.986	193	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){1|C<3>,3|C<4>,3|H<1>}	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]HH)(C[6]C[6]H){1|C<3>,1|O<1>,2|C<4>,4|H<1>}	H(C[6]C[6,6]C[6])	118.8127	1.880	23	118.3915	1.350	116	118.4230	0.986	193	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){1|C<3>,3|C<4>,3|H<1>}	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]HH)(C[6]C[6]H){1|C<4>,1|F<1>,1|O<1>,2|C<3>,3|H<1>}	H(C[6]C[6,6]C[6])	118.3985	0.281	2	118.3915	1.350	116	118.4230	0.986	193	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){1|C<3>,3|C<4>,3|H<1>}	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]HH)(C[6]C[6]H){1|C<4>,1|O<1>,2|C<3>,4|H<1>}	H(C[6]C[6,6]C[6])	118.5080	0.113	2	118.3915	1.350	116	118.4230	0.986	193	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){1|C<3>,3|C<4>,3|H<1>}	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]HH)(C[6]C[6]H){1|Cl<1>,1|C<3>,1|O<1>,2|C<4>,3|H<1>}	H(C[6]C[6,6]C[6])	118.4133	0.390	4	118.3915	1.350	116	118.4230	0.986	193	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){1|C<3>,3|C<4>,4|H<1>}	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]HH)(C[6]C[6]H){1|C<3>,1|O<1>,2|C<4>,5|H<1>}	H(C[6]C[6,6]C[6])	124.4610	0.000	1	118.3915	1.350	116	118.4230	0.986	193	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){2|C<3>,2|C<4>,3|H<1>}	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]HH)(C[6]C[6]H){1|C<4>,1|O<1>,2|C<3>,3|H<1>}	H(C[6]C[6,6]C[6])	118.6680	0.000	1	118.3915	1.350	116	118.4230	0.986	193	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){4|C<4>,4|H<1>}	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]HH)(C[6]C[6]H){1|C<3>,1|O<1>,2|C<4>,5|H<1>}	H(C[6]C[6,6]C[6])	118.0248	0.276	6	118.3915	1.350	116	118.4230	0.986	193	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){4|C<4>,4|H<1>}	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]HH)(C[6]C[6]H){1|O<1>,1|O<2>,3|C<4>,4|H<1>}	H(C[6]C[6,6]C[6])	118.3773	0.329	3	118.3915	1.350	116	118.4230	0.986	193	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){4|C<4>,4|H<1>}	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]HH)(C[6]C[6]H){1|O<1>,1|S<2>,3|C<4>,4|H<1>}	H(C[6]C[6,6]C[6])	118.4046	0.452	5	118.3915	1.350	116	118.4230	0.986	193	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){4|C<4>,4|H<1>}	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]HH)(C[6]C[6]H){1|O<1>,3|C<4>,5|H<1>}	H(C[6]C[6,6]C[6])	118.0723	0.629	56	118.3915	1.350	116	118.4230	0.986	193	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){4|C<4>,4|H<1>}	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]HH)(C[6]C[6]H){1|O<1>,4|C<4>,4|H<1>}	H(C[6]C[6,6]C[6])	120.5930	0.000	1	118.3915	1.350	116	118.4230	0.986	193	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6,6](C[6,6]C[6,6]C[6]H)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){1|O<2>,3|C<4>,4|H<1>}	C[6,6](C[6,6]C[6,6]C[6]H)(C[6]C[6]HH)(C[6]C[6]H){1|O<1>,4|C<4>,4|H<1>}	H(C[6]C[6,6]C[6])	118.6020	0.000	1	118.7585	0.796	17	118.4230	0.986	193	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6,6](C[6,6]C[6,6]C[6]H)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){3|C<4>,5|H<1>}	C[6,6](C[6,6]C[6,6]C[6]H)(C[6]C[6]HH)(C[6]C[6]H){1|O<1>,3|C<4>,5|H<1>}	H(C[6]C[6,6]C[6])	118.7682	0.921	16	118.7585	0.796	17	118.4230	0.986	193	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6,6](C[6,6]C[6,6]C[6]O)(C[6]C[6,6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){1|C<3>,1|O<2>,2|C<4>,3|H<1>}	C[6,6](C[6,6]C[6,6]C[6]O)(C[6]C[6,6]HH)(C[6]C[6]H){1|C<3>,1|O<1>,2|H<1>,4|C<4>}	H(C[6]C[6,6]C[6])	118.8180	0.000	1	118.8180	0.000	1	118.4230	0.986	193	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6,6](C[6,6]C[6,6]C[6]O)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){1|O<2>,3|C<4>,4|H<1>}	C[6,6](C[6,6]C[6,6]C[6]O)(C[6]C[6]HH)(C[6]C[6]H){1|O<1>,3|C<4>,5|H<1>}	H(C[6]C[6,6]C[6])	118.3410	0.000	1	118.1955	0.042	2	118.4230	0.986	193	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6,6](C[6,6]C[6,6]C[6]O)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){1|O<2>,3|C<4>,4|H<1>}	C[6,6](C[6,6]C[6,6]C[6]O)(C[6]C[6]HH)(C[6]C[6]H){1|O<1>,4|C<4>,4|H<1>}	H(C[6]C[6,6]C[6])	118.0500	0.000	1	118.1955	0.042	2	118.4230	0.986	193	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6,6](C[6,6]C[6]2C)(C[6]C[5,6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){2|C<3>,2|C<4>,4|H<1>}	C[6,6](C[6,6]C[6]2C)(C[6]C[5,6]HH)(C[6]C[6]H){1|N<3>,2|C<4>,2|O<1>,3|H<1>}	H(C[6]C[6,6]C[6])	118.3860	0.000	1	118.3860	0.000	1	118.4230	0.986	193	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6,6](C[6,6]C[6]2C)(C[6]C[6]CC)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){1|C<2>,2|H<1>,5|C<4>}	C[6,6](C[6,6]C[6]2C)(C[6]C[6]CC)(C[6]C[6]H){1|C<3>,1|O<1>,3|C<4>,4|H<1>}	H(C[6]C[6,6]C[6])	117.6490	0.000	1	117.6490	0.000	1	118.4230	0.986	193	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6,6](C[6,6]C[6]2C)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){1|C<3>,1|O<2>,2|H<1>,3|C<4>}	C[6,6](C[6,6]C[6]2C)(C[6]C[6]HH)(C[6]C[6]H){1|C<3>,1|O<1>,2|C<4>,4|H<1>}	H(C[6]C[6,6]C[6])	118.1927	0.155	3	118.0520	0.065	9	118.4230	0.986	193	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6,6](C[6,6]C[6]2C)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){1|C<3>,2|H<1>,4|C<4>}	C[6,6](C[6,6]C[6]2C)(C[6]C[6]HH)(C[6]C[6]H){1|C<3>,1|O<1>,1|O<2>,2|C<4>,4|H<1>}	H(C[6]C[6,6]C[6])	117.7190	0.000	1	118.0520	0.065	9	118.4230	0.986	193	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6,6](C[6,6]C[6]2C)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){1|C<3>,3|C<4>,4|H<1>}	C[6,6](C[6,6]C[6]2C)(C[6]C[6]HH)(C[6]C[6]H){2|C<4>,2|O<1>,4|H<1>}	H(C[6]C[6,6]C[6])	117.5520	0.000	1	118.0520	0.065	9	118.4230	0.986	193	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6,6](C[6,6]C[6]2C)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){4|C<4>,4|H<1>}	C[6,6](C[6,6]C[6]2C)(C[6]C[6]HH)(C[6]C[6]H){1|C<3>,1|O<1>,2|C<4>,5|H<1>}	H(C[6]C[6,6]C[6])	118.2015	0.039	2	118.0520	0.065	9	118.4230	0.986	193	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6,6](C[6,6]C[6]2C)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){4|C<4>,4|H<1>}	C[6,6](C[6,6]C[6]2C)(C[6]C[6]HH)(C[6]C[6]H){1|O<1>,3|C<4>,5|H<1>}	H(C[6]C[6,6]C[6])	118.1080	0.003	2	118.0520	0.065	9	118.4230	0.986	193	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6,6](C[6,6]C[6]2C)(C[6]C[6]HO)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){1|C<3>,1|H<1>,2|O<2>,3|C<4>}	C[6,6](C[6,6]C[6]2C)(C[6]C[6]HO)(C[6]C[6]H){1|C<3>,1|O<1>,2|C<4>,4|H<1>}	H(C[6]C[6,6]C[6])	118.4140	0.000	1	118.2390	0.057	6	118.4230	0.986	193	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6,6](C[6,6]C[6]2C)(C[6]C[6]HO)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){1|C<3>,1|O<2>,3|C<4>,3|H<1>}	C[6,6](C[6,6]C[6]2C)(C[6]C[6]HO)(C[6]C[6]H){1|O<1>,4|C<4>,4|H<1>}	H(C[6]C[6,6]C[6])	118.2890	0.152	3	118.2390	0.057	6	118.4230	0.986	193	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6,6](C[6,6]C[6]2C)(C[6]C[6]HO)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){1|H<1>,1|O<2>,2|C<3>,3|C<4>}	C[6,6](C[6,6]C[6]2C)(C[6]C[6]HO)(C[6]C[6]H){1|C<3>,1|O<1>,2|C<4>,4|H<1>}	H(C[6]C[6,6]C[6])	118.0765	0.384	2	118.2390	0.057	6	118.4230	0.986	193	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6,6](C[6,6]C[6]2H)(C[6]C[6,6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){3|C<4>,5|H<1>}	C[6,6](C[6,6]C[6]2H)(C[6]C[6,6]HH)(C[6]C[6]H){1|C<3>,1|C<4>,1|N<3>,1|O<1>,5|H<1>}	H(C[6]C[6,6]C[6])	118.4920	0.000	1	119.2560	1.167	2	118.4230	0.986	193	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6,6](C[6,6]C[6]2H)(C[6]C[6,6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){3|C<4>,5|H<1>}	C[6,6](C[6,6]C[6]2H)(C[6]C[6,6]HH)(C[6]C[6]H){1|O<1>,3|C<4>,5|H<1>}	H(C[6]C[6,6]C[6])	120.0200	0.000	1	119.2560	1.167	2	118.4230	0.986	193	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6,6](C[6,6]C[6]2H)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){3|C<4>,5|H<1>}	C[6,6](C[6,6]C[6]2H)(C[6]C[6]HH)(C[6]C[6]H){1|C<3>,1|O<1>,2|C<4>,5|H<1>}	H(C[6]C[6,6]C[6])	118.5610	0.000	1	118.6990	0.014	3	118.4230	0.986	193	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6,6](C[6,6]C[6]2H)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){3|C<4>,5|H<1>}	C[6,6](C[6,6]C[6]2H)(C[6]C[6]HH)(C[6]C[6]H){1|O<1>,2|C<4>,6|H<1>}	H(C[6]C[6,6]C[6])	118.7680	0.007	2	118.6990	0.014	3	118.4230	0.986	193	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6,6](C[6,6]C[6]2O)(C[6]C[6]CH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){1|C<3>,1|H<1>,2|O<2>,4|C<4>}	C[6,6](C[6,6]C[6]2O)(C[6]C[6]CH)(C[6]C[6]H){2|C<4>,2|H<1>,2|O<1>,2|O<2>}	H(C[6]C[6,6]C[6])	118.4810	0.000	1	118.4810	0.000	1	118.4230	0.986	193	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]O[6]O)(H)	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]O[6]O)(H){2|H<1>,4|C<4>}	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]HH)(C[6]C[6]H){1|O<1>,1|O<2>,2|C<4>,5|H<1>}	H(C[6]C[6,6]C[6])	118.6285	0.241	2	118.6285	0.058	2	118.4230	0.986	193	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]O[6]O)(H)	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]HO)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]O[6]O)(H){1|H<1>,1|O<2>,4|C<4>}	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]HO)(C[6]C[6]H){1|O<1>,1|O<2>,2|C<4>,5|H<1>}	H(C[6]C[6,6]C[6])	118.7720	0.082	2	118.7720	0.007	2	118.4230	0.986	193	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]O[6]O)(H)	C[6,6](C[6,6]C[6]2C)(C[6]C[6]CO)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]O[6]O)(H){1|C<3>,1|O<2>,4|C<4>}	C[6,6](C[6,6]C[6]2C)(C[6]C[6]CO)(C[6]C[6]H){1|C<3>,1|C<4>,1|O<2>,2|O<1>,3|H<1>}	H(C[6]C[6,6]C[6])	118.9485	0.363	2	118.9485	0.132	2	118.4230	0.986	193	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-4:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6,6](C[6]C[3x3,4,3x5,14x6]C[6,6]H)(C[6,6]C[6]N[6]Zr)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|Zr<14>,1|C<5>,1|N<3>,2|C<3>,2|H<1>}	C[6,6](C[6]C[3x3,4,3x5,14x6]C[6,6]H)(C[6,6]C[6]N[6]Zr)(C[6]C[6]H){1|C<4>,2|C<3>,2|H<1>,4|B<6>}	H(C[6]C[6,6]C[6])	119.8590	0.000	1	119.8590	0.000	1	118.3513	0.482	7	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-4:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6,6](C[6]C[6a]2C[6])(C[6,6]C[6]2F)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){1|F<1>,1|H<1>,2|C<4>,3|C<3>}	C[6,6](C[6]C[6a]2C[6])(C[6,6]C[6]2F)(C[6]C[6]H){1|C<4>,1|O<1>,5|C<3>,5|H<1>}	H(C[6]C[6,6]C[6])	118.1000	0.218	6	118.1000	0.048	6	118.3513	0.482	7	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6a]-3:C[6,6]-3:H-1:	C[6,6]-4:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6,6]2)(H)	C[6,6](C[6,6]C[5a,6]C[6,6]H)(C[6,6]C[6]S[6]C)(C[6]C[6,6a]H)	H(C[6]C[6,6a]C[6,6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6,6]2)(H){1|N<2>,1|S<2>,2|C<3>,2|H<1>,3|C<4>}	C[6,6](C[6,6]C[5a,6]C[6,6]H)(C[6,6]C[6]S[6]C)(C[6]C[6,6a]H){2|C<4>,3|H<1>,4|C<3>}	H(C[6]C[6,6a]C[6,6])	117.2480	0.000	1	117.2480	0.000	1	117.2480	0.000	1	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:3:1:	4:4:3:	3:	C[6,6a]-3:C[6,6]-3:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6,6]C[6])(H)	C[6,6](C[6,6]C[5,6]O[6]O)(C[6]C[5,6]HH)(C[6]C[6,6a]H)	H(C[6]C[6,6a]C[6,6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6,6]C[6])(H){2|C<3>,2|C<4>,2|O<2>,3|H<1>}	C[6,6](C[6,6]C[5,6]O[6]O)(C[6]C[5,6]HH)(C[6]C[6,6a]H){1|C<4>,2|C<3>,2|H<1>,2|O<2>}	H(C[6]C[6,6a]C[6,6])	119.9560	0.000	1	119.9560	0.000	1	119.9560	0.000	1	118.4140	0.902	290	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	3:2:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-3:O[6]-2:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]O[6])(C[6]C[6]CC)(H)	C[6,6](C[6,6]C[6]2)(O[6]C[6,6a])(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]O[6])(C[6]C[6]CC)(H){2|H<1>,3|C<3>}	C[6,6](C[6,6]C[6]2)(O[6]C[6,6a])(C[6]C[6]H){1|C<3>,1|H<1>,1|N<2>,1|O<1>,3|C<4>}	H(C[6]C[6,6]C[6])	118.9760	0.000	1	118.9760	0.000	1	118.9760	0.000	1	118.9760	0.000	1	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	3:3:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6,6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6,6a]C[6])(C[6]N[6]CC)(H)	C[6,6](C[6,6,6a]C[6,6a]2)(C[6]C[6]H)(C[6]N[6]C)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6,6a]C[6])(C[6]N[6]CC)(H){1|H<1>,1|N<2>,3|C<3>}	C[6,6](C[6,6,6a]C[6,6a]2)(C[6]C[6]H)(C[6]N[6]C){1|C<3>,1|N<2>,2|C<4>,2|N<3>}	H(C[6]C[6,6]C[6])	118.3590	0.000	1	118.3590	0.000	1	118.3590	0.000	1	117.9863	0.749	3	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	3:3:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]HN)(H)	C[6,6](C[6,6]C[6]2)(C[6]C[6,6]O)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]HN)(H){1|H<1>,1|O<1>,3|C<3>}	C[6,6](C[6,6]C[6]2)(C[6]C[6,6]O)(C[6]C[6]H){1|N<3>,1|O<1>,2|H<1>,3|C<3>}	H(C[6]C[6,6]C[6])	116.9970	0.000	1	116.9970	0.000	1	116.9970	0.000	1	117.9863	0.749	3	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	3:3:3:	3:	C[6,6]-3:C[6]-4:H-1:	N[6]-3:C[6,6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]N[6])(C[6]C[6]HH)(H)	C[6,6](N[6]C[6a]Ge[6])(C[6,6]C[6]2)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]N[6])(C[6]C[6]HH)(H){1|Ge<2>,1|C<4>,2|C<3>,2|H<1>}	C[6,6](N[6]C[6a]Ge[6])(C[6,6]C[6]2)(C[6]C[6]H){1|C<4>,1|N<3>,3|C<3>,4|H<1>}	H(C[6]C[6,6]C[6])	118.6030	0.000	1	118.6030	0.000	1	118.6030	0.000	1	117.9863	0.749	3	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	3:3:4:	3:	C[6,6]-3:C[5,6]-4:H-1:	C[6,6]-3:C[6]-3:C[6]-4:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[5,6]C[5,6]2Zr)(H)	C[6,6](C[6,6]C[6]2)(C[6]C[5,6]H)(C[6]C[6]CC)	H(C[6]C[5,6]C[6,6])	C[6](C[6,6]C[6,6]C[6])(C[5,6]C[5,6]2Zr)(H){2|C<3>,6|C<4>}	C[6,6](C[6,6]C[6]2)(C[6]C[5,6]H)(C[6]C[6]CC){1|Zr<13>,3|H<1>,5|C<4>}	H(C[6]C[5,6]C[6,6])	119.2735	0.336	2	119.2735	0.113	2	119.2735	0.113	2	119.2735	0.113	2	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	3:4:3:	3:	C[6,6]-3:C[5,6]-4:H-1:	C[6,6a]-3:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6a]C[6,6])(C[5,6]C[5,6]C[5]H)(H)	C[6,6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6]2H)(C[6]C[5,6]H)	H(C[6]C[5,6]C[6,6])	C[6](C[6,6]C[6,6a]C[6,6])(C[5,6]C[5,6]C[5]H)(H){1|O<2>,2|C<4>,3|C<3>,4|H<1>}	C[6,6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6]2H)(C[6]C[5,6]H){3|C<3>,3|C<4>,5|H<1>}	H(C[6]C[5,6]C[6,6])	118.6940	1.121	2	118.6940	1.258	2	118.6940	1.258	2	117.6947	3.269	43	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	3:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[5a,6]-3:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[5a,6]C[6,6])(C[6]C[6,6]HH)(H)	C[6,6](C[5a,6]C[5a,6]S[5a])(C[6,6]C[6,6]C[6]C)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5a,6]C[6,6])(C[6]C[6,6]HH)(H){1|C<3>,1|H<1>,1|S<2>,4|C<4>}	C[6,6](C[5a,6]C[5a,6]S[5a])(C[6,6]C[6,6]C[6]C)(C[6]C[6]H){1|C<3>,1|N<2>,3|C<4>,5|H<1>}	H(C[6]C[6,6]C[6])	117.8833	0.190	3	117.8833	0.036	3	117.4932	0.250	6	117.6947	3.269	43	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	3:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[5a,6]-3:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[5a,6]C[6,6])(C[6]C[6]HH)(H)	C[6,6](C[5a,6]N[5a,6]C[5a])(C[6,6]C[6]2H)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5a,6]C[6,6])(C[6]C[6]HH)(H){1|C<3>,1|N<3>,2|C<4>,3|H<1>}	C[6,6](C[5a,6]N[5a,6]C[5a])(C[6,6]C[6]2H)(C[6]C[6]H){2|C<3>,3|C<4>,6|H<1>}	H(C[6]C[6,6]C[6])	117.1030	0.363	3	117.1030	0.131	3	117.4932	0.250	6	117.6947	3.269	43	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	3:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-3:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]2)(C[6]C[6]HH)(H)	C[6,6](C[6,6]C[6,6]C[6])(C[6,6]C[6]2H)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2)(C[6]C[6]HH)(H){1|H<1>,2|C<4>,3|C<3>}	C[6,6](C[6,6]C[6,6]C[6])(C[6,6]C[6]2H)(C[6]C[6]H){2|C<4>,3|C<3>,6|H<1>}	H(C[6]C[6,6]C[6])	117.8785	0.849	2	117.8785	0.721	2	117.8785	0.721	2	117.6947	3.269	43	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	3:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]O[6]CC)(H)	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]O[6]CC)(H){1|N<3>,2|C<4>,2|H<1>}	C[6,6](C[6,6]C[6]N[6])(C[6]C[6]HH)(C[6]C[6]H){1|O<1>,1|O<2>,3|C<4>,4|H<1>}	H(C[6]C[6,6]C[6])	120.0020	0.000	1	120.0020	0.000	1	120.0020	0.000	1	117.6947	3.269	43	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	3:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6a]C[6,6])(C[6]C[5,6]B[5]H)(H)	C[6,6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[5,6]C[6]H)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]C[6,6])(C[6]C[5,6]B[5]H)(H){2|C<4>,2|H<1>,2|O<2>,3|C<3>}	C[6,6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[5,6]C[6]H)(C[6]C[6]H){1|B<3>,2|C<4>,3|C<3>,5|H<1>}	H(C[6]C[6,6]C[6])	120.0510	0.000	1	120.0510	0.000	1	117.5864	4.067	32	117.6947	3.269	43	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	3:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6a]C[6,6])(C[6]C[5,6]HH)(H)	C[6,6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[5,6]C[6]H)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]C[6,6])(C[6]C[5,6]HH)(H){1|Br<1>,1|H<1>,2|C<4>,3|C<3>}	C[6,6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[5,6]C[6]H)(C[6]C[6]H){2|C<3>,3|C<4>,6|H<1>}	H(C[6]C[6,6]C[6])	117.1630	0.000	1	117.8074	1.214	7	117.5864	4.067	32	117.6947	3.269	43	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	3:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6a]C[6,6])(C[6]C[5,6]HH)(H)	C[6,6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[5,6]C[6]H)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]C[6,6])(C[6]C[5,6]HH)(H){1|Cl<1>,1|H<1>,2|C<4>,3|C<3>}	C[6,6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[5,6]C[6]H)(C[6]C[6]H){2|C<3>,3|C<4>,6|H<1>}	H(C[6]C[6,6]C[6])	117.4245	0.462	2	117.8074	1.214	7	117.5864	4.067	32	117.6947	3.269	43	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	3:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6a]C[6,6])(C[6]C[5,6]HH)(H)	C[6,6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[5,6]C[6]H)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]C[6,6])(C[6]C[5,6]HH)(H){1|H<1>,2|C<3>,4|C<4>}	C[6,6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[5,6]C[6]H)(C[6]C[6]H){2|C<3>,3|C<4>,6|H<1>}	H(C[6]C[6,6]C[6])	117.0080	0.000	1	117.8074	1.214	7	117.5864	4.067	32	117.6947	3.269	43	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	3:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6a]C[6,6])(C[6]C[5,6]HH)(H)	C[6,6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[5,6]C[6]H)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]C[6,6])(C[6]C[5,6]HH)(H){1|H<1>,2|C<4>,4|C<3>}	C[6,6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[5,6]C[6]H)(C[6]C[6]H){2|C<3>,3|C<4>,6|H<1>}	H(C[6]C[6,6]C[6])	117.6900	0.000	1	117.8074	1.214	7	117.5864	4.067	32	117.6947	3.269	43	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	3:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6a]C[6,6])(C[6]C[5,6]HH)(H)	C[6,6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[5,6]C[6]H)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]C[6,6])(C[6]C[5,6]HH)(H){1|H<1>,3|C<3>,3|C<4>}	C[6,6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[5,6]C[6]H)(C[6]C[6]H){2|C<3>,3|C<4>,6|H<1>}	H(C[6]C[6,6]C[6])	117.7460	0.000	1	117.8074	1.214	7	117.5864	4.067	32	117.6947	3.269	43	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	3:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6a]C[6,6])(C[6]C[5,6]HH)(H)	C[6,6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[5,6]C[6]H)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]C[6,6])(C[6]C[5,6]HH)(H){1|H<1>,3|C<3>,3|C<4>}	C[6,6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[5,6]C[6]H)(C[6]C[6]H){2|C<4>,3|C<3>,6|H<1>}	H(C[6]C[6,6]C[6])	120.1960	0.000	1	117.8074	1.214	7	117.5864	4.067	32	117.6947	3.269	43	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	3:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6a]C[6,6])(C[6]C[5,6]HH)(H)	C[6,6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6]O[6]H)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]C[6,6])(C[6]C[5,6]HH)(H){1|C<4>,1|H<1>,2|C<3>,3|O<2>}	C[6,6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6]O[6]H)(C[6]C[6]H){2|C<3>,2|C<4>,5|H<1>}	H(C[6]C[6,6]C[6])	117.9160	0.000	1	117.9160	0.000	1	117.5864	4.067	32	117.6947	3.269	43	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	3:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6a]C[6,6])(C[6]C[6,6]HH)(H)	C[6,6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6,6]C[6]C)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]C[6,6])(C[6]C[6,6]HH)(H){1|H<1>,2|C<3>,4|C<4>}	C[6,6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6,6]C[6]C)(C[6]C[6]H){1|C<3>,1|N<2>,3|C<4>,6|H<1>}	H(C[6]C[6,6]C[6])	113.1430	4.463	3	113.1430	19.920	3	117.5864	4.067	32	117.6947	3.269	43	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	3:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6a]C[6,6])(C[6]C[6,6]HH)(H)	C[6,6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6,6]C[6]H)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]C[6,6])(C[6]C[6,6]HH)(H){1|Br<1>,1|H<1>,2|C<4>,3|C<3>}	C[6,6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6,6]C[6]H)(C[6]C[6]H){2|C<3>,3|C<4>,6|H<1>}	H(C[6]C[6,6]C[6])	117.3485	0.071	2	117.3485	0.005	2	117.5864	4.067	32	117.6947	3.269	43	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	3:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6a]C[6,6])(C[6]C[6,6a]HH)(H)	C[6,6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6,6a]C[6]O)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]C[6,6])(C[6]C[6,6a]HH)(H){1|C<4>,1|O<2>,4|C<3>}	C[6,6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6,6a]C[6]O)(C[6]C[6]H){1|O<2>,4|C<3>,5|H<1>}	H(C[6]C[6,6]C[6])	118.2330	0.000	1	118.2330	0.000	1	117.5864	4.067	32	117.6947	3.269	43	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	3:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6a]C[6,6])(C[6]C[6,6a]HH)(H)	C[6,6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6,6a]N[6]H)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]C[6,6])(C[6]C[6,6a]HH)(H){1|H<1>,1|N<3>,4|C<3>}	C[6,6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6,6a]N[6]H)(C[6]C[6]H){1|C<4>,3|H<1>,5|C<3>}	H(C[6]C[6,6]C[6])	118.7210	0.000	1	118.7210	0.000	1	117.5864	4.067	32	117.6947	3.269	43	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	3:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6a]C[6,6])(C[6]C[6]CH)(H)	C[6,6](C[6,6a]C[5a,6,6a]C[6a])(C[6,6]C[6]N[6]H)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]C[6,6])(C[6]C[6]CH)(H){1|C<4>,1|N<3>,2|C<3>,3|H<1>}	C[6,6](C[6,6a]C[5a,6,6a]C[6a])(C[6,6]C[6]N[6]H)(C[6]C[6]H){2|C<4>,4|C<3>,4|H<1>}	H(C[6]C[6,6]C[6])	118.2400	0.372	2	118.3250	0.684	4	117.5864	4.067	32	117.6947	3.269	43	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	3:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6a]C[6,6])(C[6]C[6]CH)(H)	C[6,6](C[6,6a]C[5a,6,6a]C[6a])(C[6,6]C[6]N[6]H)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]C[6,6])(C[6]C[6]CH)(H){1|C<4>,1|N<3>,2|C<3>,3|H<1>}	C[6,6](C[6,6a]C[5a,6,6a]C[6a])(C[6,6]C[6]N[6]H)(C[6]C[6]H){3|C<3>,3|C<4>,4|H<1>}	H(C[6]C[6,6]C[6])	117.4390	0.000	1	118.3250	0.684	4	117.5864	4.067	32	117.6947	3.269	43	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	3:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6a]C[6,6])(C[6]C[6]CH)(H)	C[6,6](C[6,6a]C[5a,6,6a]C[6a])(C[6,6]C[6]N[6]H)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]C[6,6])(C[6]C[6]CH)(H){1|C<4>,1|N<4>,2|C<3>,3|H<1>}	C[6,6](C[6,6a]C[5a,6,6a]C[6a])(C[6,6]C[6]N[6]H)(C[6]C[6]H){2|C<4>,4|C<3>,5|H<1>}	H(C[6]C[6,6]C[6])	119.3810	0.000	1	118.3250	0.684	4	117.5864	4.067	32	117.6947	3.269	43	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	3:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6a]C[6,6])(C[6]C[6]CH)(H)	C[6,6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6]O[6]H)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]C[6,6])(C[6]C[6]CH)(H){1|C<4>,1|O<2>,2|C<3>,3|H<1>}	C[6,6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6]O[6]H)(C[6]C[6]H){1|O<2>,2|C<4>,3|C<3>,3|H<1>}	H(C[6]C[6,6]C[6])	118.2890	0.000	1	118.2890	0.000	1	117.5864	4.067	32	117.6947	3.269	43	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	3:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6a]C[6,6])(C[6]C[6]HH)(H)	C[6,6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6]2H)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]C[6,6])(C[6]C[6]HH)(H){1|H<1>,3|C<3>,3|C<4>}	C[6,6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6]2H)(C[6]C[6]H){2|C<4>,3|C<3>,6|H<1>}	H(C[6]C[6,6]C[6])	118.6940	0.000	1	119.1025	0.334	2	117.5864	4.067	32	117.6947	3.269	43	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	3:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6a]C[6,6])(C[6]C[6]HH)(H)	C[6,6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6]2H)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]C[6,6])(C[6]C[6]HH)(H){2|C<3>,2|H<1>,3|C<4>}	C[6,6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6]2H)(C[6]C[6]H){3|C<3>,3|C<4>,5|H<1>}	H(C[6]C[6,6]C[6])	119.5110	0.000	1	119.1025	0.334	2	117.5864	4.067	32	117.6947	3.269	43	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	3:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6a]C[6,6])(C[6]C[6]HH)(H)	C[6,6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6]N[6]H)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]C[6,6])(C[6]C[6]HH)(H){1|C<4>,1|N<3>,2|H<1>,3|C<3>}	C[6,6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6]N[6]H)(C[6]C[6]H){1|N<3>,2|C<3>,2|C<4>,5|H<1>}	H(C[6]C[6,6]C[6])	118.6930	0.000	1	118.6930	0.000	1	117.5864	4.067	32	117.6947	3.269	43	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	3:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6a]C[6,6])(C[6]C[6]HH)(H)	C[6,6](C[6,6a]C[6a,6a]C[6,6a])(C[6,6]C[6]2H)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]C[6,6])(C[6]C[6]HH)(H){2|C<3>,2|H<1>,3|C<4>}	C[6,6](C[6,6a]C[6a,6a]C[6,6a])(C[6,6]C[6]2H)(C[6]C[6]H){1|C<4>,1|N<3>,4|C<3>,5|H<1>}	H(C[6]C[6,6]C[6])	117.6760	0.000	1	117.6760	0.000	1	117.5864	4.067	32	117.6947	3.269	43	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	3:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6a]C[6,6])(C[6]C[6]HO)(H)	C[6,6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6]2C)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]C[6,6])(C[6]C[6]HO)(H){2|C<4>,2|H<1>,3|C<3>}	C[6,6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6]2C)(C[6]C[6]H){2|C<3>,2|C<4>,2|O<2>,5|H<1>}	H(C[6]C[6,6]C[6])	117.3200	0.000	1	117.3200	0.000	1	117.5864	4.067	32	117.6947	3.269	43	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	3:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6a]C[6,6])(C[6]C[6]HO)(H)	C[6,6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6]N[6]H)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]C[6,6])(C[6]C[6]HO)(H){1|C<4>,1|N<3>,1|O<2>,2|C<3>,2|H<1>}	C[6,6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[6]N[6]H)(C[6]C[6]H){1|C<4>,2|O<2>,3|C<3>,4|H<1>}	H(C[6]C[6,6]C[6])	117.5973	0.282	6	117.5973	0.080	6	117.5864	4.067	32	117.6947	3.269	43	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:2:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6]-4:O[6,6]-2:C[6]-3:	C[6]-3:	C[6](C[6,6]O[6,6]C[6])(C[6]C[6]HO)(H)	C[6,6](C[6]C[6,6a]HO)(O[6,6]C[6,6])(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]O[6,6]C[6])(C[6]C[6]HO)(H){1|C<3>,1|C<4>,1|O<2>,3|H<1>}	C[6,6](C[6]C[6,6a]HO)(O[6,6]C[6,6])(C[6]C[6]H){1|C<4>,1|O<2>,2|C<3>,2|H<1>}	H(C[6]C[6,6]C[6])	121.3890	0.000	1	121.3890	0.000	1	121.3890	0.000	1	121.3890	0.000	1	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:3:2:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:O[6]-2:	C[6]-3:	C[6](C[6,6]C[6,6]O[6])(C[6]C[6,6]HH)(H)	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(O[6]C[6])	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]O[6])(C[6]C[6,6]HH)(H){1|C<3>,5|C<4>}	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(O[6]C[6]){1|O<2>,4|C<4>,4|H<1>}	H(C[6]C[6,6]C[6])	120.3150	0.000	1	120.3150	0.000	1	118.4497	2.616	3	118.3242	1.807	4	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:3:2:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:O[6]-2:	C[6]-3:	C[6](C[6,6]C[6,6]O[6])(C[6]C[6]CC)(H)	C[6,6](C[6,6]C[6]2C)(C[6]C[6]H)(O[6]C[6])	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]O[6])(C[6]C[6]CC)(H){2|C<3>,2|C<4>,2|H<1>}	C[6,6](C[6,6]C[6]2C)(C[6]C[6]H)(O[6]C[6]){1|C<3>,1|O<1>,1|O<2>,2|H<1>,3|C<4>}	H(C[6]C[6,6]C[6])	117.6000	0.000	1	117.6000	0.000	1	118.4497	2.616	3	118.3242	1.807	4	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:3:2:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:O[6]-2:	C[6]-3:	C[6](C[6,6]C[6,6]O[6])(C[6]C[6]CC)(H)	C[6,6](C[6,6]C[6a]C[6]2)(C[6]C[6]H)(O[6]C[6])	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]O[6])(C[6]C[6]CC)(H){1|C<4>,2|H<1>,3|C<3>}	C[6,6](C[6,6]C[6a]C[6]2)(C[6]C[6]H)(O[6]C[6]){1|O<1>,2|H<1>,3|C<3>,4|C<4>}	H(C[6]C[6,6]C[6])	117.4340	0.000	1	117.4340	0.000	1	118.4497	2.616	3	118.3242	1.807	4	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:3:2:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:S[6]-2:	C[6]-3:	C[6](C[6,6]C[6,6]S[6])(C[6]C[6]HH)(H)	C[6,6](C[6,6]C[6]2H)(C[6]C[6]H)(S[6]C[6])	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]S[6])(C[6]C[6]HH)(H){1|C<3>,1|H<1>,3|C<4>}	C[6,6](C[6,6]C[6]2H)(C[6]C[6]H)(S[6]C[6]){1|O<2>,2|C<3>,2|C<4>,4|H<1>}	H(C[6]C[6,6]C[6])	117.9480	0.000	1	117.9480	0.000	1	117.9480	0.000	1	118.3242	1.807	4	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:3:3:	3:	C[6,6]-3:C[6,6]-4:H-1:	C[5,5,6,6]-4:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6,6]C[5,5,6,6]N[6])(C[6,6]C[5,3x6]C[6]H)(H)	C[6,6](C[5,5,6,6]C[5,5,3x6]C[5,5,6]C[6])(C[6]C[6,6]H)(N[6]C[6]C)	H(C[6]C[6,6]2)	C[6](C[6,6]C[5,5,6,6]N[6])(C[6,6]C[5,3x6]C[6]H)(H){1|C<3>,3|H<1>,6|C<4>}	C[6,6](C[5,5,6,6]C[5,5,3x6]C[5,5,6]C[6])(C[6]C[6,6]H)(N[6]C[6]C){1|N<3>,6|C<4>,6|H<1>}	H(C[6]C[6,6]2)	120.2410	0.513	2	120.2410	0.264	2	120.2410	0.264	2	117.9048	1.156	93	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:3:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[3x6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[3x6]C[6])(C[6]C[6,6]HH)(H)	C[6,6](C[3x6]C[6,6]O[6,6]C[6])(C[6]C[6]H)(C[6]O[6]O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[3x6]C[6])(C[6]C[6,6]HH)(H){1|C<3>,1|H<1>,1|O<1>,2|C<4>,2|O<2>}	C[6,6](C[3x6]C[6,6]O[6,6]C[6])(C[6]C[6]H)(C[6]O[6]O){1|O<1>,2|H<1>,5|C<4>}	H(C[6]C[6,6]C[6])	118.3220	0.000	1	118.3220	0.000	1	117.7927	0.245	4	117.9048	1.156	93	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:3:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[3x6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[3x6]C[6])(C[6]C[6]CH)(H)	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6]C[6]H)(C[6]C[6]O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[3x6]C[6])(C[6]C[6]CH)(H){1|C<3>,1|O<1>,2|H<1>,3|C<4>}	C[6,6](C[3x6]C[5,6,6]C[6,6]H)(C[6]C[6]H)(C[6]C[6]O){2|C<3>,2|C<4>,2|O<2>,3|H<1>}	H(C[6]C[6,6]C[6])	117.3700	0.000	1	117.3700	0.000	1	117.7927	0.245	4	117.9048	1.156	93	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:3:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[3x6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[3x6]C[6])(C[6]C[6]HH)(H)	C[6,6](C[3x6]C[6,6,6a]C[6,6]H)(C[6]C[6]H)(C[6]O[6]O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[3x6]C[6])(C[6]C[6]HH)(H){1|C<4>,1|O<1>,1|O<2>,2|C<3>,2|H<1>}	C[6,6](C[3x6]C[6,6,6a]C[6,6]H)(C[6]C[6]H)(C[6]O[6]O){1|C<4>,3|C<3>,3|H<1>}	H(C[6]C[6,6]C[6])	118.1070	0.000	1	118.1070	0.000	1	117.7927	0.245	4	117.9048	1.156	93	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:3:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[3x6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[3x6]C[6])(C[6]C[6]HH)(H)	C[6,6](C[3x6]C[6,6]N[6,6]C)(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[3x6]C[6])(C[6]C[6]HH)(H){1|C<3>,1|N<3>,1|O<2>,2|C<4>,2|H<1>}	C[6,6](C[3x6]C[6,6]N[6,6]C)(C[6]C[6]H)2{4|C<4>,4|H<1>}	H(C[6]C[6,6]C[6])	117.3720	0.000	1	117.3720	0.000	1	117.7927	0.245	4	117.9048	1.156	93	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:3:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[4,6,6]-4:C[6,6a]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[4,6,6]C[6,6a])(C[6]C[6]HH)(H)	C[6,6](C[4,6,6]C[4,6]C[4]O[6])(C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[4,6,6]C[6,6a])(C[6]C[6]HH)(H){1|O<2>,2|C<3>,2|C<4>,2|H<1>}	C[6,6](C[4,6,6]C[4,6]C[4]O[6])(C[6,6a]C[6,6a]C[6a])(C[6]C[6]H){2|C<3>,4|C<4>,5|H<1>}	H(C[6]C[6,6]C[6])	117.9630	0.065	2	117.9630	0.004	2	117.9630	0.004	2	117.9048	1.156	93	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:3:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[5,6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[5,6,6]C[6])(C[6]C[5,6]HH)(H)	C[6,6](C[5,6,6]C[5,5,6]N[5,6]H)(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6,6]C[6])(C[6]C[5,6]HH)(H){1|C<3>,1|C<4>,2|N<3>,3|H<1>}	C[6,6](C[5,6,6]C[5,5,6]N[5,6]H)(C[6]C[6]H)2{2|C<4>,3|C<3>,3|H<1>}	H(C[6]C[6,6]C[6])	119.4140	0.000	1	119.4140	0.000	1	118.4501	1.676	7	117.9048	1.156	93	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:3:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[5,6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[5,6,6]C[6])(C[6]C[5,6]HH)(H)	C[6,6](C[5,6,6]C[5,6]O[5,6]C[5])(C[6]C[6,6]H)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6,6]C[6])(C[6]C[5,6]HH)(H){1|C<3>,1|H<1>,1|O<2>,4|C<4>}	C[6,6](C[5,6,6]C[5,6]O[5,6]C[5])(C[6]C[6,6]H)(C[6]C[6]H){1|C<3>,4|C<4>,5|H<1>}	H(C[6]C[6,6]C[6])	119.6060	0.000	2	118.5840	3.133	3	118.4501	1.676	7	117.9048	1.156	93	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:3:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[5,6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[5,6,6]C[6])(C[6]C[5,6]HH)(H)	C[6,6](C[5,6,6]C[5,6]O[5,6]C[5])(C[6]C[6,6]H)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6,6]C[6])(C[6]C[5,6]HH)(H){1|C<3>,1|H<1>,1|O<2>,4|C<4>}	C[6,6](C[5,6,6]C[5,6]O[5,6]C[5])(C[6]C[6,6]H)(C[6]C[6]H){5|C<4>,5|H<1>}	H(C[6]C[6,6]C[6])	116.5400	0.000	1	118.5840	3.133	3	118.4501	1.676	7	117.9048	1.156	93	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:3:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[5,6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[5,6,6]C[6])(C[6]C[5,6]HH)(H)	C[6,6](C[5,6,6]C[5,6]O[5,6]C[5])(C[6]C[6,6]O)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6,6]C[6])(C[6]C[5,6]HH)(H){1|O<1>,1|O<2>,5|C<4>}	C[6,6](C[5,6,6]C[5,6]O[5,6]C[5])(C[6]C[6,6]O)(C[6]C[6]H){5|C<4>,6|H<1>}	H(C[6]C[6,6]C[6])	117.2780	0.000	1	117.2780	0.000	1	118.4501	1.676	7	117.9048	1.156	93	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:3:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[5,6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[5,6,6]C[6])(C[6]C[6,6]HH)(H)	C[6,6](C[5,6,6]C[5,6,6]C[5,6]H)(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6,6]C[6])(C[6]C[6,6]HH)(H){1|C<3>,3|C<4>,3|H<1>}	C[6,6](C[5,6,6]C[5,6,6]C[5,6]H)(C[6]C[6]H)2{1|C<3>,2|C<4>,2|O<2>,4|H<1>}	H(C[6]C[6,6]C[6])	117.5120	0.000	1	118.3535	1.416	2	118.4501	1.676	7	117.9048	1.156	93	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:3:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[5,6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[5,6,6]C[6])(C[6]C[6,6]HH)(H)	C[6,6](C[5,6,6]C[5,6,6]C[5,6]H)(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6,6]C[6])(C[6]C[6,6]HH)(H){1|C<3>,3|C<4>,3|H<1>}	C[6,6](C[5,6,6]C[5,6,6]C[5,6]H)(C[6]C[6]H)2{2|O<2>,3|C<4>,4|H<1>}	H(C[6]C[6,6]C[6])	119.1950	0.000	1	118.3535	1.416	2	118.4501	1.676	7	117.9048	1.156	93	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:3:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[5,6,6]-4:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6,6]C[5,6,6]N[6])(C[6]C[6]CH)(H)	C[6,6](C[5,6,6]C[5,6]C[5]C[6])(C[6]C[6]H)(N[6]C[6]C)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6,6]N[6])(C[6]C[6]CH)(H){2|H<1>,5|C<4>}	C[6,6](C[5,6,6]C[5,6]C[5]C[6])(C[6]C[6]H)(N[6]C[6]C){2|C<3>,4|C<4>,7|H<1>}	H(C[6]C[6,6]C[6])	117.9410	0.000	1	117.9410	0.000	1	117.9410	0.000	1	117.9048	1.156	93	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:3:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[5,6]-4:C[6,6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6,6]HH)(H)	C[6,6](C[5,6]C[5,6]C[5]C)(C[6,6]C[6,6]C[6])(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6,6]HH)(H){1|C<3>,1|H<1>,5|C<4>}	C[6,6](C[5,6]C[5,6]C[5]C)(C[6,6]C[6,6]C[6])(C[6]C[6]H){5|H<1>,7|C<4>}	H(C[6]C[6,6]C[6])	118.2080	0.033	2	118.2080	0.001	2	118.2080	0.001	2	117.9048	1.156	93	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:3:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6,6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]2)(C[6]C[5,6]HH)(H)	C[6,6](C[6,6]C[5,6]C[6]H)(C[6,6]C[6,6]C[6])(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2)(C[6]C[5,6]HH)(H){1|H<1>,2|C<3>,4|C<4>}	C[6,6](C[6,6]C[5,6]C[6]H)(C[6,6]C[6,6]C[6])(C[6]C[6]H){5|C<4>,7|H<1>}	H(C[6]C[6,6]C[6])	117.0490	0.000	1	119.8290	6.168	3	118.3058	3.040	9	117.9048	1.156	93	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:3:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6,6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]2)(C[6]C[5,6]HH)(H)	C[6,6](C[6,6]C[5,6]C[6]H)(C[6,6]C[6,6]C[6])(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2)(C[6]C[5,6]HH)(H){2|C<3>,2|H<1>,3|C<4>}	C[6,6](C[6,6]C[5,6]C[6]H)(C[6,6]C[6,6]C[6])(C[6]C[6]H){1|C<3>,4|C<4>,7|H<1>}	H(C[6]C[6,6]C[6])	121.2190	0.863	2	119.8290	6.168	3	118.3058	3.040	9	117.9048	1.156	93	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:3:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6,6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]2)(C[6]C[5,6]HH)(H)	C[6,6](C[6,6]C[6,6]C[6]C)(C[6,6]C[5,6]C[6])(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2)(C[6]C[5,6]HH)(H){1|C<3>,6|C<4>}	C[6,6](C[6,6]C[6,6]C[6]C)(C[6,6]C[5,6]C[6])(C[6]C[6]H){6|C<4>,6|H<1>}	H(C[6]C[6,6]C[6])	117.7245	0.063	2	117.7245	0.004	2	118.3058	3.040	9	117.9048	1.156	93	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:3:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6,6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]2)(C[6]C[6,6]HH)(H)	C[6,6](C[6,6]C[6,6]C[6]C)(C[6,6]C[6,6]C[6])(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2)(C[6]C[6,6]HH)(H){1|C<3>,1|H<1>,5|C<4>}	C[6,6](C[6,6]C[6,6]C[6]C)(C[6,6]C[6,6]C[6])(C[6]C[6]H){1|C<3>,4|H<1>,7|C<4>}	H(C[6]C[6,6]C[6])	117.2425	0.780	2	117.2425	0.608	2	118.3058	3.040	9	117.9048	1.156	93	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:3:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6,6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]2)(C[6]C[6,6]HH)(H)	C[6,6](C[6,6]C[6,6]C[6]H)(C[6,6]C[6,6]C[6])(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2)(C[6]C[6,6]HH)(H){1|C<3>,1|H<1>,5|C<4>}	C[6,6](C[6,6]C[6,6]C[6]H)(C[6,6]C[6,6]C[6])(C[6]C[6]H){5|C<4>,7|H<1>}	H(C[6]C[6,6]C[6])	117.0950	0.000	1	117.0950	0.000	1	118.3058	3.040	9	117.9048	1.156	93	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:3:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6,6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]2)(C[6]C[6]HH)(H)	C[6,6](C[6,6]C[6,6]C[6]H)(C[6,6]C[6]2)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2)(C[6]C[6]HH)(H){1|C<3>,3|C<4>,3|H<1>}	C[6,6](C[6,6]C[6,6]C[6]H)(C[6,6]C[6]2)(C[6]C[6]H){1|C<3>,1|N<3>,1|O<2>,3|C<4>,6|H<1>}	H(C[6]C[6,6]C[6])	118.2360	0.000	1	118.2360	0.000	1	118.3058	3.040	9	117.9048	1.156	93	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:3:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[3x6]HH)(H)	C[6,6](C[6,6]C[3x6]C[6]C)(C[6]C[6]H)(C[6]O[6]O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[3x6]HH)(H){1|O<1>,1|O<2>,5|C<4>}	C[6,6](C[6,6]C[3x6]C[6]C)(C[6]C[6]H)(C[6]O[6]O){3|C<4>,5|H<1>}	H(C[6]C[6,6]C[6])	119.5420	0.000	1	119.5420	0.000	1	117.7139	0.842	65	117.9048	1.156	93	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:3:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[5,6,6]CH)(H)	C[6,6](C[6,6]C[5,6,6]C[6]H)(C[6]C[3,6]O)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[5,6,6]CH)(H){1|C<3>,1|H<1>,1|O<1>,4|C<4>}	C[6,6](C[6,6]C[5,6,6]C[6]H)(C[6]C[3,6]O)(C[6]C[6]H){2|O<2>,4|C<4>,4|H<1>}	H(C[6]C[6,6]C[6])	116.2840	0.420	3	116.2840	0.176	3	117.7139	0.842	65	117.9048	1.156	93	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:3:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[5,6]HH)(H)	C[6,6](C[6,6]C[5,6]C[6]C)(C[6]C[6]H)(C[6]O[6]O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[5,6]HH)(H){1|O<1>,1|O<2>,5|C<4>}	C[6,6](C[6,6]C[5,6]C[6]C)(C[6]C[6]H)(C[6]O[6]O){3|C<4>,5|H<1>}	H(C[6]C[6,6]C[6])	118.2555	0.297	4	118.2555	0.088	4	117.7139	0.842	65	117.9048	1.156	93	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:3:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[5,6]HH)(H)	C[6,6](C[6,6]C[5,6]C[6]H)(C[6]C[3,6]O)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[5,6]HH)(H){1|C<3>,1|O<1>,2|H<1>,3|C<4>}	C[6,6](C[6,6]C[5,6]C[6]H)(C[6]C[3,6]O)(C[6]C[6]H){1|C<3>,2|C<4>,2|O<2>,5|H<1>}	H(C[6]C[6,6]C[6])	122.6030	0.000	1	122.6030	0.000	1	117.7139	0.842	65	117.9048	1.156	93	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:3:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]HH)(H)	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6,6a]O)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]HH)(H){1|H<1>,1|O<1>,2|C<3>,3|C<4>}	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6,6a]O)(C[6]C[6]H){1|O<1>,2|C<3>,2|C<4>,3|H<1>}	H(C[6]C[6,6]C[6])	117.6560	0.000	1	117.6560	0.000	1	117.7139	0.842	65	117.9048	1.156	93	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:3:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]HH)(H)	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]C)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]HH)(H){1|C<2>,1|C<3>,1|H<1>,4|C<4>}	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]C)(C[6]C[6]H){1|C<3>,3|C<4>,5|H<1>}	H(C[6]C[6,6]C[6])	117.5565	0.030	2	117.5565	0.001	2	117.7139	0.842	65	117.9048	1.156	93	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:3:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]HH)(H)	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(C[6]O[6]O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]HH)(H){1|C<3>,1|O<1>,1|O<2>,4|C<4>}	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(C[6]O[6]O){3|C<4>,5|H<1>}	H(C[6]C[6,6]C[6])	117.1580	0.000	1	117.1580	0.000	1	117.7139	0.842	65	117.9048	1.156	93	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:3:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]HH)(H)	C[6,6](C[6,6]C[6,6]C[6]H)(C[6]C[6]C)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]HH)(H){1|C<3>,2|H<1>,4|C<4>}	C[6,6](C[6,6]C[6,6]C[6]H)(C[6]C[6]C)(C[6]C[6]H){2|C<3>,3|C<4>,4|H<1>}	H(C[6]C[6,6]C[6])	117.8440	0.000	1	117.8440	0.000	1	117.7139	0.842	65	117.9048	1.156	93	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:3:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]HH)(H)	C[6,6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(C[6]C[6]O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]HH)(H){1|O<1>,2|H<1>,4|C<4>}	C[6,6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(C[6]C[6]O){5|C<4>,5|H<1>}	H(C[6]C[6,6]C[6])	117.9290	0.000	1	117.9290	0.000	1	117.7139	0.842	65	117.9048	1.156	93	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:3:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]HH)(H)	C[6,6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(C[6]O[6]O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]HH)(H){1|O<1>,1|O<2>,2|H<1>,3|C<4>}	C[6,6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(C[6]O[6]O){4|C<4>,4|H<1>}	H(C[6]C[6,6]C[6])	118.0752	0.400	5	118.0752	0.160	5	117.7139	0.842	65	117.9048	1.156	93	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:3:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]HH)(H)	C[6,6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]HH)(H){1|C<3>,3|C<4>,3|H<1>}	C[6,6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)2{1|O<2>,3|C<4>,5|H<1>}	H(C[6]C[6,6]C[6])	118.3000	0.000	1	118.0970	0.082	2	117.7139	0.842	65	117.9048	1.156	93	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:3:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]HH)(H)	C[6,6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]HH)(H){1|C<3>,3|C<4>,3|H<1>}	C[6,6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)2{4|H<1>,5|C<4>}	H(C[6]C[6,6]C[6])	117.8940	0.000	1	118.0970	0.082	2	117.7139	0.842	65	117.9048	1.156	93	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:3:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]HH)(H)	C[6,6](C[6,6]C[6,6]C[6]O)(C[6]C[6]H)(C[6]C[6]O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]HH)(H){1|H<1>,1|O<1>,1|O<2>,4|C<4>}	C[6,6](C[6,6]C[6,6]C[6]O)(C[6]C[6]H)(C[6]C[6]O){1|C<3>,4|H<1>,5|C<4>}	H(C[6]C[6,6]C[6])	117.2530	0.000	1	117.2530	0.000	1	117.7139	0.842	65	117.9048	1.156	93	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:3:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]CC)(H)	C[6,6](C[6,6]C[3,6,6]C[6]O)(C[6]C[6]H)(C[6]C[6]O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]CC)(H){1|C<3>,1|O<1>,1|O<2>,2|C<4>,2|H<1>}	C[6,6](C[6,6]C[3,6,6]C[6]O)(C[6]C[6]H)(C[6]C[6]O){1|C<3>,1|O<2>,2|H<1>,5|C<4>}	H(C[6]C[6,6]C[6])	117.0680	0.000	1	117.0680	0.000	1	117.7139	0.842	65	117.9048	1.156	93	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:3:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]CC)(H)	C[6,6](C[6,6]C[5,6,6]C[6]O)(C[6]C[5,6]O)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]CC)(H){1|O<1>,1|O<2>,2|H<1>,3|C<4>}	C[6,6](C[6,6]C[5,6,6]C[6]O)(C[6]C[5,6]O)(C[6]C[6]H){1|C<3>,1|H<1>,3|O<2>,5|C<4>}	H(C[6]C[6,6]C[6])	116.9310	0.052	2	116.8447	0.024	3	117.7139	0.842	65	117.9048	1.156	93	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:3:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]CC)(H)	C[6,6](C[6,6]C[5,6,6]C[6]O)(C[6]C[5,6]O)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]CC)(H){1|O<1>,1|O<2>,2|H<1>,3|C<4>}	C[6,6](C[6,6]C[5,6,6]C[6]O)(C[6]C[5,6]O)(C[6]C[6]H){1|C<3>,2|H<1>,2|O<2>,5|C<4>}	H(C[6]C[6,6]C[6])	116.6720	0.000	1	116.8447	0.024	3	117.7139	0.842	65	117.9048	1.156	93	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:3:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]CC)(H)	C[6,6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(C[6]C[6]O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]CC)(H){1|O<1>,1|O<2>,2|H<1>,3|C<4>}	C[6,6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(C[6]C[6]O){1|C<3>,4|H<1>,5|C<4>}	H(C[6]C[6,6]C[6])	117.0340	0.182	2	117.0933	0.027	3	117.7139	0.842	65	117.9048	1.156	93	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:3:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]CC)(H)	C[6,6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(C[6]C[6]O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]CC)(H){1|O<1>,3|C<4>,3|H<1>}	C[6,6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(C[6]C[6]O){1|C<3>,4|H<1>,5|C<4>}	H(C[6]C[6,6]C[6])	117.2120	0.000	1	117.0933	0.027	3	117.7139	0.842	65	117.9048	1.156	93	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:3:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]CC)(H)	C[6,6](C[6,6]C[6,6]C[6]O)(C[6]C[5,6]O)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]CC)(H){1|C<3>,1|O<1>,1|O<2>,2|C<4>,2|H<1>}	C[6,6](C[6,6]C[6,6]C[6]O)(C[6]C[5,6]O)(C[6]C[6]H){1|O<2>,2|C<3>,2|H<1>,4|C<4>}	H(C[6]C[6,6]C[6])	117.3390	0.188	2	117.3390	0.035	2	117.7139	0.842	65	117.9048	1.156	93	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:3:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]CC)(H)	C[6,6](C[6,6]C[6,6]C[6]O)(C[6]C[6]H)(C[6]C[6]O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]CC)(H){1|C<3>,1|O<1>,1|O<2>,2|C<4>,2|H<1>}	C[6,6](C[6,6]C[6,6]C[6]O)(C[6]C[6]H)(C[6]C[6]O){1|O<2>,2|C<3>,3|C<4>,3|H<1>}	H(C[6]C[6,6]C[6])	117.5400	0.000	1	117.5400	0.000	1	117.7139	0.842	65	117.9048	1.156	93	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:3:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]CH)(H)	C[6,6](C[6,6]C[6,6a]C[6]H)(C[6]C[6]H)(C[6]O[6]O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]CH)(H){1|C<3>,1|C<4>,1|H<1>,1|O<1>,3|O<2>}	C[6,6](C[6,6]C[6,6a]C[6]H)(C[6]C[6]H)(C[6]O[6]O){1|C<4>,3|C<3>,3|H<1>}	H(C[6]C[6,6]C[6])	118.0770	0.000	1	118.0770	0.000	1	117.7139	0.842	65	117.9048	1.156	93	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:3:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]CH)(H)	C[6,6](C[6,6]C[6]2H)(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]CH)(H){1|C<3>,2|C<4>,4|H<1>}	C[6,6](C[6,6]C[6]2H)(C[6]C[6]H)2{1|O<2>,4|C<4>,4|H<1>}	H(C[6]C[6,6]C[6])	117.3256	0.204	5	117.3256	0.042	5	117.7139	0.842	65	117.9048	1.156	93	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:3:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]CO)(H)	C[6,6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(C[6]C[6]O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]CO)(H){1|O<1>,3|C<4>,3|H<1>}	C[6,6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(C[6]C[6]O){1|O<2>,4|H<1>,5|C<4>}	H(C[6]C[6,6]C[6])	117.7586	0.493	5	117.7586	0.243	5	117.7139	0.842	65	117.9048	1.156	93	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:3:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]HH)(H)	C[6,6](C[6,6]C[5,6]C[6]H)(C[6]C[6]C)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]HH)(H){1|C<2>,1|C<3>,2|C<4>,3|H<1>}	C[6,6](C[6,6]C[5,6]C[6]H)(C[6]C[6]C)(C[6]C[6]H){1|N<3>,2|C<3>,2|C<4>,4|H<1>}	H(C[6]C[6,6]C[6])	117.1320	0.000	1	117.1320	0.000	1	117.7139	0.842	65	117.9048	1.156	93	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:3:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]HH)(H)	C[6,6](C[6,6]C[6]2C)(C[6]C[5a,6]O)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]HH)(H){1|C<3>,1|O<1>,2|H<1>,3|C<4>}	C[6,6](C[6,6]C[6]2C)(C[6]C[5a,6]O)(C[6]C[6]H){1|C<3>,1|O<2>,2|C<4>,5|H<1>}	H(C[6]C[6,6]C[6])	117.3180	0.000	1	117.3180	0.000	1	117.7139	0.842	65	117.9048	1.156	93	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:3:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]HH)(H)	C[6,6](C[6,6]C[6]2C)(C[6]C[6,6]O)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]HH)(H){1|O<1>,2|H<1>,4|C<4>}	C[6,6](C[6,6]C[6]2C)(C[6]C[6,6]O)(C[6]C[6]H){4|C<4>,6|H<1>}	H(C[6]C[6,6]C[6])	119.0640	0.000	1	119.0640	0.000	1	117.7139	0.842	65	117.9048	1.156	93	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:3:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]HH)(H)	C[6,6](C[6,6]C[6]2H)(C[6]C[6]C)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]HH)(H){1|C<2>,1|C<3>,2|C<4>,3|H<1>}	C[6,6](C[6,6]C[6]2H)(C[6]C[6]C)(C[6]C[6]H){1|C<3>,1|N<3>,2|C<4>,5|H<1>}	H(C[6]C[6,6]C[6])	117.4445	0.202	2	117.5070	0.032	3	117.7139	0.842	65	117.9048	1.156	93	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:3:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]HH)(H)	C[6,6](C[6,6]C[6]2H)(C[6]C[6]C)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]HH)(H){1|C<2>,2|C<3>,2|C<4>,2|H<1>}	C[6,6](C[6,6]C[6]2H)(C[6]C[6]C)(C[6]C[6]H){1|C<3>,1|N<3>,2|C<4>,5|H<1>}	H(C[6]C[6,6]C[6])	117.6320	0.000	1	117.5070	0.032	3	117.7139	0.842	65	117.9048	1.156	93	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:3:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]HH)(H)	C[6,6](C[6,6]C[6]2O)(C[6]C[6]C)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]HH)(H){1|H<1>,1|O<2>,2|C<3>,3|C<4>}	C[6,6](C[6,6]C[6]2O)(C[6]C[6]C)(C[6]C[6]H){1|C<3>,1|N<3>,2|C<4>,5|H<1>}	H(C[6]C[6,6]C[6])	117.2270	0.000	1	117.2270	0.000	1	117.7139	0.842	65	117.9048	1.156	93	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:3:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]HH)(H)	C[6,6](C[6,6]C[6]N[6]H)(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]HH)(H){1|C<3>,1|C<4>,1|N<3>,4|H<1>}	C[6,6](C[6,6]C[6]N[6]H)(C[6]C[6]H)2{2|C<3>,3|C<4>,3|H<1>}	H(C[6]C[6,6]C[6])	118.1110	0.000	1	118.0055	0.022	2	117.7139	0.842	65	117.9048	1.156	93	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:3:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]HH)(H)	C[6,6](C[6,6]C[6]N[6]H)(C[6]C[6]H)2	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]HH)(H){1|C<3>,1|C<4>,1|N<3>,4|H<1>}	C[6,6](C[6,6]C[6]N[6]H)(C[6]C[6]H)2{2|C<4>,3|C<3>,3|H<1>}	H(C[6]C[6,6]C[6])	117.9000	0.000	1	118.0055	0.022	2	117.7139	0.842	65	117.9048	1.156	93	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:3:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]HH)(H)	C[6,6](C[6,6]C[6]O[6]C)(C[6]C[6,6a]O)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]HH)(H){1|C<3>,1|H<1>,1|O<1>,2|C<4>,2|O<2>}	C[6,6](C[6,6]C[6]O[6]C)(C[6]C[6,6a]O)(C[6]C[6]H){1|C<4>,1|O<2>,2|C<3>,3|H<1>}	H(C[6]C[6,6]C[6])	117.7182	0.488	8	117.7182	0.238	8	117.7139	0.842	65	117.9048	1.156	93	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:3:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]HO)(H)	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(C[6]C[6]O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]HO)(H){1|O<1>,2|H<1>,4|C<4>}	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(C[6]C[6]O){1|O<2>,3|C<4>,6|H<1>}	H(C[6]C[6,6]C[6])	117.4950	0.000	1	117.4950	0.000	1	117.7139	0.842	65	117.9048	1.156	93	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:3:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]O[6]CC)(H)	C[6,6](C[6,6]C[5,6]O[6]O)(C[6]C[5,6]O)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]O[6]CC)(H){1|O<1>,2|C<4>,2|O<2>}	C[6,6](C[6,6]C[5,6]O[6]O)(C[6]C[5,6]O)(C[6]C[6]H){1|O<2>,2|C<3>,2|H<1>,3|C<4>}	H(C[6]C[6,6]C[6])	118.9820	0.000	1	119.1215	0.039	2	117.7139	0.842	65	117.9048	1.156	93	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:3:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]O[6]CC)(H)	C[6,6](C[6,6]C[5,6]O[6]O)(C[6]C[5,6]O)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]O[6]CC)(H){1|O<1>,2|C<4>,2|O<2>}	C[6,6](C[6,6]C[5,6]O[6]O)(C[6]C[5,6]O)(C[6]C[6]H){1|O<2>,2|H<1>,5|C<4>}	H(C[6]C[6,6]C[6])	119.2610	0.000	1	119.1215	0.039	2	117.7139	0.842	65	117.9048	1.156	93	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:3:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]S[6]HH)(H)	C[6,6](C[6,6]C[6]2H)(C[6]C[6]C)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]S[6]HH)(H){1|C<2>,1|C<3>,1|H<1>,2|C<4>}	C[6,6](C[6,6]C[6]2H)(C[6]C[6]C)(C[6]C[6]H){1|C<3>,1|C<4>,1|N<3>,1|S<2>,5|H<1>}	H(C[6]C[6,6]C[6])	116.5040	0.000	1	116.5040	0.000	1	117.7139	0.842	65	117.9048	1.156	93	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:3:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]N[6])(C[6]C[6]HH)(H)	C[6,6](C[6,6]C[6]2H)(C[6]C[6]H)(N[6]C[6]C)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]N[6])(C[6]C[6]HH)(H){1|C<3>,3|C<4>,3|H<1>}	C[6,6](C[6,6]C[6]2H)(C[6]C[6]H)(N[6]C[6]C){1|C<3>,1|O<1>,2|C<4>,5|H<1>}	H(C[6]C[6,6]C[6])	117.9070	0.000	1	117.9070	0.000	1	117.9070	0.000	1	117.9048	1.156	93	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:3:4:	3:	C[6,6]-3:C[3,6]-4:H-1:	C[5,6,6]-4:C[6]-3:C[6]-4:	C[6]-3:	C[6](C[6,6]C[5,6,6]C[6])(C[3,6]C[3,6]O[3]C)(H)	C[6,6](C[5,6,6]C[5,6]2C)(C[6]C[3,6]H)(C[6]C[6]CC)	H(C[6]C[3,6]C[6,6])	C[6](C[6,6]C[5,6,6]C[6])(C[3,6]C[3,6]O[3]C)(H){7|C<4>}	C[6,6](C[5,6,6]C[5,6]2C)(C[6]C[3,6]H)(C[6]C[6]CC){2|C<3>,2|C<4>,2|O<2>,4|H<1>}	H(C[6]C[3,6]C[6,6])	122.2900	0.000	1	122.2900	0.000	1	122.2900	0.000	1	118.7936	3.838	5	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:3:4:	3:	C[6,6]-3:C[6,6]-4:H-1:	C[5,6,6]-4:C[6]-3:C[6]-4:	C[6]-3:	C[6](C[6,6]C[5,6,6]C[6])(C[6,6]C[6,6]C[6]H)(H)	C[6,6](C[5,6,6]C[5,6]C[5]C[6])(C[6]C[6,6]H)(C[6]C[6]HO)	H(C[6]C[6,6]2)	C[6](C[6,6]C[5,6,6]C[6])(C[6,6]C[6,6]C[6]H)(H){1|O<2>,2|C<3>,4|C<4>,4|H<1>}	C[6,6](C[5,6,6]C[5,6]C[5]C[6])(C[6]C[6,6]H)(C[6]C[6]HO){1|C<3>,1|N<3>,1|O<1>,1|O<2>,3|H<1>,4|C<4>}	H(C[6]C[6,6]2)	117.6960	0.000	1	117.6960	0.000	1	117.6960	0.000	1	118.7936	3.838	5	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:3:4:	3:	C[6,6]-3:C[6,6]-4:H-1:	C[6,6]-4:C[6]-3:C[6]-4:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6,6]C[6,6]2H)(H)	C[6,6](C[6,6]C[6,6]N[6]H)(C[6]C[6,6]H)(C[6]C[6]HH)	H(C[6]C[6,6]2)	C[6](C[6,6]C[6,6]C[6])(C[6,6]C[6,6]2H)(H){2|N<3>,3|C<4>,6|H<1>}	C[6,6](C[6,6]C[6,6]N[6]H)(C[6]C[6,6]H)(C[6]C[6]HH){4|C<4>,5|H<1>}	H(C[6]C[6,6]2)	117.9990	0.000	1	118.0180	0.001	2	117.9940	0.002	3	118.7936	3.838	5	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:3:4:	3:	C[6,6]-3:C[6,6]-4:H-1:	C[6,6]-4:C[6]-3:C[6]-4:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6,6]C[6,6]2H)(H)	C[6,6](C[6,6]C[6,6]N[6]H)(C[6]C[6,6]H)(C[6]C[6]HH)	H(C[6]C[6,6]2)	C[6](C[6,6]C[6,6]C[6])(C[6,6]C[6,6]2H)(H){2|N<4>,3|C<4>,6|H<1>}	C[6,6](C[6,6]C[6,6]N[6]H)(C[6]C[6,6]H)(C[6]C[6]HH){4|C<4>,6|H<1>}	H(C[6]C[6,6]2)	118.0370	0.000	1	118.0180	0.001	2	117.9940	0.002	3	118.7936	3.838	5	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:3:4:	3:	C[6,6]-3:C[6,6]-4:H-1:	C[6,6]-4:C[6]-3:C[6]-4:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6,6]C[6]2O[6])(H)	C[6,6](C[6,6]C[6]2H)(C[6]C[6,6]H)(C[6]C[6]CH)	H(C[6]C[6,6]2)	C[6](C[6,6]C[6,6]C[6])(C[6,6]C[6]2O[6])(H){1|C<3>,5|C<4>,6|H<1>}	C[6,6](C[6,6]C[6]2H)(C[6]C[6,6]H)(C[6]C[6]CH){1|O<2>,4|C<4>,5|H<1>}	H(C[6]C[6,6]2)	117.9460	0.000	1	117.9460	0.000	1	117.9940	0.002	3	118.7936	3.838	5	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[5,6]-4:H-1:	C[5,6,6]-4:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[5,6,6]C[6,6])(C[5,6]C[5,6]O[5]C)(H)	C[6,6](C[5,6,6]C[5,6,6]C[5]C[6])(C[6,6]C[6]2C)(C[6]C[5,6]H)	H(C[6]C[5,6]C[6,6])	C[6](C[6,6]C[5,6,6]C[6,6])(C[5,6]C[5,6]O[5]C)(H){2|C<3>,7|C<4>}	C[6,6](C[5,6,6]C[5,6,6]C[5]C[6])(C[6,6]C[6]2C)(C[6]C[5,6]H){1|C<3>,1|O<1>,2|O<2>,5|C<4>,6|H<1>}	H(C[6]C[5,6]C[6,6])	117.3320	0.000	1	117.3320	0.000	1	117.3320	0.000	1	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[3,6,6]-4:C[5,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[3,6,6]C[5,6])(C[6]C[6,6]HH)(H)	C[6,6](C[3,6,6]C[3,6,6]C[3]C[6])(C[5,6]C[5,6]C[5]C)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[3,6,6]C[5,6])(C[6]C[6,6]HH)(H){1|H<1>,7|C<4>}	C[6,6](C[3,6,6]C[3,6,6]C[3]C[6])(C[5,6]C[5,6]C[5]C)(C[6]C[6]H){1|C<3>,1|O<2>,5|C<4>,7|H<1>}	H(C[6]C[6,6]C[6])	117.9190	0.000	1	118.1075	0.071	2	118.1075	0.071	2	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[3,6,6]-4:C[5,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[3,6,6]C[5,6])(C[6]C[6,6]HH)(H)	C[6,6](C[3,6,6]C[3,6,6]C[3]C[6])(C[5,6]C[5,6]C[5]C)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[3,6,6]C[5,6])(C[6]C[6,6]HH)(H){1|H<1>,7|C<4>}	C[6,6](C[3,6,6]C[3,6,6]C[3]C[6])(C[5,6]C[5,6]C[5]C)(C[6]C[6]H){6|C<4>,8|H<1>}	H(C[6]C[6,6]C[6])	118.2960	0.000	1	118.1075	0.071	2	118.1075	0.071	2	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[3,6,6]-4:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[3,6,6]C[6,6])(C[6]C[5,6]HH)(H)	C[6,6](C[3,6,6]C[3,6,6]C[6]O[3])(C[6,6]C[5,6]C[6]H)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[3,6,6]C[6,6])(C[6]C[5,6]HH)(H){1|H<1>,1|O<2>,6|C<4>}	C[6,6](C[3,6,6]C[3,6,6]C[6]O[3])(C[6,6]C[5,6]C[6]H)(C[6]C[6]H){5|C<4>,7|H<1>}	H(C[6]C[6,6]C[6])	116.8540	0.000	1	116.8540	0.000	1	117.0495	0.076	2	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[3,6,6]-4:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[3,6,6]C[6,6])(C[6]C[6,6]HH)(H)	C[6,6](C[3,6,6]C[3,6,6]C[6]O[3])(C[6,6]C[6,6]C[6]H)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[3,6,6]C[6,6])(C[6]C[6,6]HH)(H){1|H<1>,1|O<2>,6|C<4>}	C[6,6](C[3,6,6]C[3,6,6]C[6]O[3])(C[6,6]C[6,6]C[6]H)(C[6]C[6]H){5|C<4>,7|H<1>}	H(C[6]C[6,6]C[6])	117.2450	0.000	1	117.2450	0.000	1	117.0495	0.076	2	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[3x6]-4:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[3x6]C[6,6])(C[6]C[6]HH)(H)	C[6,6](C[3x6]C[4x6]C[6,6]H)(C[6,6]C[6]2H)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[3x6]C[6,6])(C[6]C[6]HH)(H){4|C<4>,4|H<1>}	C[6,6](C[3x6]C[4x6]C[6,6]H)(C[6,6]C[6]2H)(C[6]C[6]H){2|C<3>,5|C<4>,6|H<1>}	H(C[6]C[6,6]C[6])	117.8955	0.062	2	117.8955	0.004	2	117.8955	0.004	2	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[3x6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[3x6]C[6])(C[6]C[6,6]CH)(H)	C[6,6](C[3x6]C[6,6]C[6]O[6])(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[3x6]C[6])(C[6]C[6,6]CH)(H){1|C<3>,1|O<2>,3|C<4>,3|H<1>}	C[6,6](C[3x6]C[6,6]C[6]O[6])(C[6]C[6]HH)(C[6]C[6]H){2|C<3>,3|C<4>,6|H<1>}	H(C[6]C[6,6]C[6])	117.3030	0.000	1	117.3030	0.000	1	120.0065	8.218	4	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[3x6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[3x6]C[6])(C[6]C[6]CC)(H)	C[6,6](C[3x6]C[3x6]C[6,6]H)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[3x6]C[6])(C[6]C[6]CC)(H){3|C<4>,5|H<1>}	C[6,6](C[3x6]C[3x6]C[6,6]H)(C[6]C[6]HH)(C[6]C[6]H){4|H<1>,6|C<4>}	H(C[6]C[6,6]C[6])	117.7550	0.000	1	117.7550	0.000	1	120.0065	8.218	4	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[3x6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[3x6]C[6])(C[6]O[6]CC)(H)	C[6,6](C[3x6]C[6,6]C[6]O[6])(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[3x6]C[6])(C[6]O[6]CC)(H){1|O<2>,2|H<1>,3|C<4>}	C[6,6](C[3x6]C[6,6]C[6]O[6])(C[6]C[6]HH)(C[6]C[6]H){1|C<2>,2|O<2>,3|H<1>,5|C<4>}	H(C[6]C[6,6]C[6])	122.4840	0.000	2	122.4840	0.000	2	120.0065	8.218	4	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[4x6]-4:C[5,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[4x6]C[5,6])(C[6]C[3x6]HH)(H)	C[6,6](C[4x6]C[4x6]O[6,6]C[6])(C[5,6]C[5,5,6]C[5]O)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[4x6]C[5,6])(C[6]C[3x6]HH)(H){1|C<3>,1|H<1>,2|O<2>,4|C<4>}	C[6,6](C[4x6]C[4x6]O[6,6]C[6])(C[5,6]C[5,5,6]C[5]O)(C[6]C[6]H){1|C<3>,1|O<1>,4|H<1>,7|C<4>}	H(C[6]C[6,6]C[6])	118.0038	0.135	6	118.0038	0.018	6	117.9481	0.037	7	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[4x6]-4:C[5,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[4x6]C[5,6])(C[6]C[3x6]HH)(H)	C[6,6](C[4x6]C[4x6]O[6,6]C[6])(C[5,6]C[5,6]C[5]O)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[4x6]C[5,6])(C[6]C[3x6]HH)(H){1|H<1>,2|O<2>,5|C<4>}	C[6,6](C[4x6]C[4x6]O[6,6]C[6])(C[5,6]C[5,6]C[5]O)(C[6]C[6]H){1|O<2>,5|H<1>,8|C<4>}	H(C[6]C[6,6]C[6])	117.6140	0.000	1	117.6140	0.000	1	117.9481	0.037	7	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[5,6,6]-4:C[4x6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[5,6,6]C[4x6])(C[6]C[3x6]HH)(H)	C[6,6](C[5,6,6]C[5,6,6]C[5]O[6])(C[4x6]C[4x6]O[6,6]C[6])(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6,6]C[4x6])(C[6]C[3x6]HH)(H){1|H<1>,2|O<2>,5|C<4>}	C[6,6](C[5,6,6]C[5,6,6]C[5]O[6])(C[4x6]C[4x6]O[6,6]C[6])(C[6]C[6]H){1|O<2>,5|H<1>,9|C<4>}	H(C[6]C[6,6]C[6])	117.6010	0.000	1	117.6010	0.000	1	117.6010	0.000	1	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[5,6,6]-4:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[5,6,6]C[6,6])(C[6]C[5,6]HH)(H)	C[6,6](C[5,6,6]C[5,6]C[5]C[6])(C[6,6]C[6,6]C[6]C)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6,6]C[6,6])(C[6]C[5,6]HH)(H){1|C<3>,1|H<1>,6|C<4>}	C[6,6](C[5,6,6]C[5,6]C[5]C[6])(C[6,6]C[6,6]C[6]C)(C[6]C[6]H){11|H<1>,1|C<3>,4|C<4>}	H(C[6]C[6,6]C[6])	118.0620	0.000	1	118.0620	0.000	1	117.9555	0.023	2	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[5,6,6]-4:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[5,6,6]C[6,6])(C[6]C[5,6]HO)(H)	C[6,6](C[5,6,6]C[5,6]C[5]C[6])(C[6,6]C[6,6]C[6]C)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6,6]C[6,6])(C[6]C[5,6]HO)(H){1|C<3>,1|H<1>,6|C<4>}	C[6,6](C[5,6,6]C[5,6]C[5]C[6])(C[6,6]C[6,6]C[6]C)(C[6]C[6]H){10|H<1>,1|C<3>,1|O<2>,4|C<4>}	H(C[6]C[6,6]C[6])	117.8490	0.000	1	117.8490	0.000	1	117.9555	0.023	2	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[5,6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[5,6,6]C[6])(C[6]C[6,6]HH)(H)	C[6,6](C[5,6,6]C[5,6,6]C[5]C[6])(C[6]C[5,6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6,6]C[6])(C[6]C[6,6]HH)(H){3|H<1>,5|C<4>}	C[6,6](C[5,6,6]C[5,6,6]C[5]C[6])(C[6]C[5,6]HH)(C[6]C[6]H){3|C<4>,3|O<2>,7|H<1>}	H(C[6]C[6,6]C[6])	118.1200	0.000	1	118.1200	0.000	1	117.3134	0.610	5	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[5,6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[5,6,6]C[6])(C[6]C[6]HH)(H)	C[6,6](C[5,6,6]C[5,6]C[5]C[6])(C[6]C[5,6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6,6]C[6])(C[6]C[6]HH)(H){3|H<1>,5|C<4>}	C[6,6](C[5,6,6]C[5,6]C[5]C[6])(C[6]C[5,6]HH)(C[6]C[6]H){3|C<4>,3|O<2>,7|H<1>}	H(C[6]C[6,6]C[6])	118.0130	0.000	1	118.0130	0.000	1	117.3134	0.610	5	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[5,6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[5,6,6]C[6])(C[6]C[6]HH)(H)	C[6,6](C[5,6,6]C[5,6]C[5]C[6])(C[6]C[6]CC)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6,6]C[6])(C[6]C[6]HH)(H){1|C<3>,1|H<1>,6|C<4>}	C[6,6](C[5,6,6]C[5,6]C[5]C[6])(C[6]C[6]CC)(C[6]C[6]H){1|O<1>,1|O<2>,3|C<4>,7|H<1>}	H(C[6]C[6,6]C[6])	116.5325	0.279	2	116.5325	0.078	2	117.3134	0.610	5	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[5,6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[5,6,6]C[6])(C[6]N[6]HH)(H)	C[6,6](C[5,6,6]C[5,6]N[5,6]H)(C[6]C[6,6a]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6,6]C[6])(C[6]N[6]HH)(H){1|C<4>,1|N<3>,2|C<3>,3|H<1>}	C[6,6](C[5,6,6]C[5,6]N[5,6]H)(C[6]C[6,6a]HH)(C[6]C[6]H){1|C<4>,1|N<3>,3|C<3>,3|H<1>}	H(C[6]C[6,6]C[6])	117.3690	0.000	1	117.3690	0.000	1	117.3134	0.610	5	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[5,6]-4:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[5,6]HH)(H)	C[6,6](C[5,6]C[6]O[5]S[5])(C[6,6]C[5,6]C[6]H)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[5,6]HH)(H){1|C<3>,1|O<2>,1|S<2>,2|H<1>,3|C<4>}	C[6,6](C[5,6]C[6]O[5]S[5])(C[6,6]C[5,6]C[6]H)(C[6]C[6]H){1|C<3>,4|C<4>,7|H<1>}	H(C[6]C[6,6]C[6])	117.8390	0.000	1	117.8390	0.000	1	117.6873	0.159	30	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[5,6]-4:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6,6]HH)(H)	C[6,6](C[5,6]C[3,5,6]C[5]C)(C[6,6]C[6,6]C[6]H)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6,6]HH)(H){2|H<1>,6|C<4>}	C[6,6](C[5,6]C[3,5,6]C[5]C)(C[6,6]C[6,6]C[6]H)(C[6]C[6]H){1|O<2>,6|C<4>,6|H<1>}	H(C[6]C[6,6]C[6])	117.9260	0.000	1	117.9665	0.003	2	117.6873	0.159	30	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[5,6]-4:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6,6]HH)(H)	C[6,6](C[5,6]C[3,5,6]C[5]C)(C[6,6]C[6,6]C[6]H)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6,6]HH)(H){2|H<1>,6|C<4>}	C[6,6](C[5,6]C[3,5,6]C[5]C)(C[6,6]C[6,6]C[6]H)(C[6]C[6]H){6|H<1>,7|C<4>}	H(C[6]C[6,6]C[6])	118.0070	0.000	1	117.9665	0.003	2	117.6873	0.159	30	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[5,6]-4:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6,6]HH)(H)	C[6,6](C[5,6]C[5,6]C[5]C)(C[6,6]C[6,6]C[6]H)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6,6]HH)(H){2|H<1>,6|C<4>}	C[6,6](C[5,6]C[5,6]C[5]C)(C[6,6]C[6,6]C[6]H)(C[6]C[6]H){1|C<3>,6|C<4>,6|H<1>}	H(C[6]C[6,6]C[6])	118.0570	0.000	1	117.5608	0.136	12	117.6873	0.159	30	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[5,6]-4:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6,6]HH)(H)	C[6,6](C[5,6]C[5,6]C[5]C)(C[6,6]C[6,6]C[6]H)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6,6]HH)(H){2|H<1>,6|C<4>}	C[6,6](C[5,6]C[5,6]C[5]C)(C[6,6]C[6,6]C[6]H)(C[6]C[6]H){6|H<1>,7|C<4>}	H(C[6]C[6,6]C[6])	117.5157	0.350	11	117.5608	0.136	12	117.6873	0.159	30	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[5,6]-4:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6,6]HH)(H)	C[6,6](C[5,6]C[5,6]C[5]H)(C[6,6]C[6,6]C[6]C)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6,6]HH)(H){1|C<3>,2|H<1>,5|C<4>}	C[6,6](C[5,6]C[5,6]C[5]H)(C[6,6]C[6,6]C[6]C)(C[6]C[6]H){1|O<2>,2|C<3>,2|C<4>,8|H<1>}	H(C[6]C[6,6]C[6])	117.0570	0.000	1	117.2065	0.023	4	117.6873	0.159	30	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[5,6]-4:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6,6]HH)(H)	C[6,6](C[5,6]C[5,6]C[5]H)(C[6,6]C[6,6]C[6]C)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6,6]HH)(H){2|H<1>,6|C<4>}	C[6,6](C[5,6]C[5,6]C[5]H)(C[6,6]C[6,6]C[6]C)(C[6]C[6]H){1|O<2>,2|C<3>,2|C<4>,8|H<1>}	H(C[6]C[6,6]C[6])	117.2563	0.142	3	117.2065	0.023	4	117.6873	0.159	30	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[5,6]-4:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6,6]HH)(H)	C[6,6](C[5,6]C[5,6]C[5]H)(C[6,6]C[6,6]C[6]H)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6,6]HH)(H){3|H<1>,5|C<4>}	C[6,6](C[5,6]C[5,6]C[5]H)(C[6,6]C[6,6]C[6]H)(C[6]C[6]H){6|H<1>,7|C<4>}	H(C[6]C[6,6]C[6])	118.6060	0.000	1	118.6060	0.000	1	117.6873	0.159	30	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[5,6]-4:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6,6]HH)(H)	C[6,6](C[5,6]C[5,6]O[5]H)(C[6,6]C[6,6]C[6]H)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6,6]HH)(H){1|O<2>,3|H<1>,4|C<4>}	C[6,6](C[5,6]C[5,6]O[5]H)(C[6,6]C[6,6]C[6]H)(C[6]C[6]H){4|H<1>,7|C<4>}	H(C[6]C[6,6]C[6])	118.0320	0.227	3	118.0320	0.052	3	117.6873	0.159	30	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[5,6]-4:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6]HH)(H)	C[6,6](C[5,6]C[5,5,6]O[5]H)(C[6,6]C[6]2H)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6]HH)(H){1|O<2>,3|C<4>,4|H<1>}	C[6,6](C[5,6]C[5,5,6]O[5]H)(C[6,6]C[6]2H)(C[6]C[6]H){2|C<3>,4|H<1>,5|C<4>}	H(C[6]C[6,6]C[6])	118.0000	0.296	2	118.0000	0.087	2	117.6873	0.159	30	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[5,6]-4:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6]HH)(H)	C[6,6](C[5,6]C[5,6]C[5]C)(C[6,6]C[6]2H)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6]HH)(H){1|C<3>,2|H<1>,5|C<4>}	C[6,6](C[5,6]C[5,6]C[5]C)(C[6,6]C[6]2H)(C[6]C[6]H){6|H<1>,7|C<4>}	H(C[6]C[6,6]C[6])	117.7820	0.000	1	117.7820	0.000	1	117.6873	0.159	30	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[5,6]-4:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6]HH)(H)	C[6,6](C[5,6]C[6]O[5]S[5])(C[6,6]C[6]2H)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6]HH)(H){1|H<1>,1|O<2>,1|S<2>,2|C<3>,2|C<4>}	C[6,6](C[5,6]C[6]O[5]S[5])(C[6,6]C[6]2H)(C[6]C[6]H){2|C<3>,3|C<4>,6|H<1>}	H(C[6]C[6,6]C[6])	117.5260	0.000	1	117.5260	0.000	1	117.6873	0.159	30	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[5,6]-4:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6]HO)(H)	C[6,6](C[5,6]C[5,6]O[5]H)(C[6,6]C[6]2C)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6]HO)(H){1|C<2>,1|O<2>,2|H<1>,4|C<4>}	C[6,6](C[5,6]C[5,6]O[5]H)(C[6,6]C[6]2C)(C[6]C[6]H){1|C<3>,1|O<2>,3|C<4>,6|H<1>}	H(C[6]C[6,6]C[6])	117.8430	0.000	1	117.6685	0.061	2	117.6873	0.159	30	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[5,6]-4:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6]HO)(H)	C[6,6](C[5,6]C[5,6]O[5]H)(C[6,6]C[6]2C)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6]HO)(H){1|C<2>,1|O<2>,2|H<1>,4|C<4>}	C[6,6](C[5,6]C[5,6]O[5]H)(C[6,6]C[6]2C)(C[6]C[6]H){1|O<2>,4|C<4>,6|H<1>}	H(C[6]C[6,6]C[6])	117.4940	0.000	1	117.6685	0.061	2	117.6873	0.159	30	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[5,6]-4:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[5,6]C[6,6])(C[6]N[5a,6]HH)(H)	C[6,6](C[5,6]C[6]O[5]S[5])(C[6,6]N[5a,6]C[6]H)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6]C[6,6])(C[6]N[5a,6]HH)(H){1|C<3>,1|H<1>,1|N<3>,1|O<2>,1|S<2>,2|C<4>}	C[6,6](C[5,6]C[6]O[5]S[5])(C[6,6]N[5a,6]C[6]H)(C[6]C[6]H){1|C<3>,1|N<3>,3|C<4>,6|H<1>}	H(C[6]C[6,6]C[6])	117.9430	0.000	1	117.9430	0.000	1	117.6873	0.159	30	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[5,6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[5,6,6]C[6,6])(C[6]C[6]HH)(H)	C[6,6](C[6,6]C[6,6]C[6]C)(C[5,6,6]C[5,6]2C)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6,6]C[6,6])(C[6]C[6]HH)(H){2|C<3>,5|C<4>}	C[6,6](C[6,6]C[6,6]C[6]C)(C[5,6,6]C[5,6]2C)(C[6]C[6]H){1|C<3>,1|O<2>,4|C<4>,6|H<1>}	H(C[6]C[6,6]C[6])	118.2875	0.306	2	118.2875	0.094	2	118.2875	0.094	2	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[5,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6,6a]HH)(H)	C[6,6](C[6,6]C[6,6a]C[6]H)(C[5,6]C[5,6]C[5]H)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6,6a]HH)(H){2|C<3>,2|H<1>,3|C<4>}	C[6,6](C[6,6]C[6,6a]C[6]H)(C[5,6]C[5,6]C[5]H)(C[6]C[6]H){3|C<3>,3|C<4>,6|H<1>}	H(C[6]C[6,6]C[6])	118.0130	0.000	1	118.0130	0.000	1	118.0130	0.000	1	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]2)(C[6]C[5,6]HH)(H)	C[6,6](C[6,6]C[5,6]C[6]H)(C[6,6]C[6,6]C[6]C)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2)(C[6]C[5,6]HH)(H){1|C<3>,1|H<1>,6|C<4>}	C[6,6](C[6,6]C[5,6]C[6]H)(C[6,6]C[6,6]C[6]C)(C[6]C[6]H){5|C<4>,8|H<1>}	H(C[6]C[6,6]C[6])	116.8310	0.225	2	116.7953	0.029	3	117.6001	1.512	48	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]2)(C[6]C[5,6]HH)(H)	C[6,6](C[6,6]C[5,6]C[6]H)(C[6,6]C[6,6]C[6]C)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2)(C[6]C[5,6]HH)(H){1|H<1>,3|C<3>,4|C<4>}	C[6,6](C[6,6]C[5,6]C[6]H)(C[6,6]C[6,6]C[6]C)(C[6]C[6]H){2|C<3>,3|C<4>,6|H<1>}	H(C[6]C[6,6]C[6])	116.7240	0.000	1	116.7953	0.029	3	117.6001	1.512	48	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]2)(C[6]C[5,6]HH)(H)	C[6,6](C[6,6]C[5,6]C[6]H)(C[6,6]C[6,6]C[6]H)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2)(C[6]C[5,6]HH)(H){1|C<3>,3|H<1>,4|C<4>}	C[6,6](C[6,6]C[5,6]C[6]H)(C[6,6]C[6,6]C[6]H)(C[6]C[6]H){2|C<3>,3|C<4>,8|H<1>}	H(C[6]C[6,6]C[6])	120.3065	0.384	2	120.3065	0.147	2	117.6001	1.512	48	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]2)(C[6]C[6,6]HH)(H)	C[6,6](C[6,6]C[6,6]C[6]C)(C[6,6]C[6,6]C[6]H)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2)(C[6]C[6,6]HH)(H){1|C<3>,2|H<1>,5|C<4>}	C[6,6](C[6,6]C[6,6]C[6]C)(C[6,6]C[6,6]C[6]H)(C[6]C[6]H){1|C<3>,5|H<1>,6|C<4>}	H(C[6]C[6,6]C[6])	117.2980	0.000	1	117.1275	0.565	31	117.6001	1.512	48	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]2)(C[6]C[6,6]HH)(H)	C[6,6](C[6,6]C[6,6]C[6]C)(C[6,6]C[6,6]C[6]H)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2)(C[6]C[6,6]HH)(H){1|C<3>,2|H<1>,5|C<4>}	C[6,6](C[6,6]C[6,6]C[6]C)(C[6,6]C[6,6]C[6]H)(C[6]C[6]H){1|C<3>,5|H<1>,7|C<4>}	H(C[6]C[6,6]C[6])	116.8770	0.000	1	117.1275	0.565	31	117.6001	1.512	48	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]2)(C[6]C[6,6]HH)(H)	C[6,6](C[6,6]C[6,6]C[6]C)(C[6,6]C[6,6]C[6]H)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2)(C[6]C[6,6]HH)(H){1|C<3>,2|H<1>,5|C<4>}	C[6,6](C[6,6]C[6,6]C[6]C)(C[6,6]C[6,6]C[6]H)(C[6]C[6]H){5|H<1>,8|C<4>}	H(C[6]C[6,6]C[6])	116.7790	0.000	1	117.1275	0.565	31	117.6001	1.512	48	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]2)(C[6]C[6,6]HH)(H)	C[6,6](C[6,6]C[6,6]C[6]C)(C[6,6]C[6,6]C[6]H)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2)(C[6]C[6,6]HH)(H){1|C<3>,2|H<1>,5|C<4>}	C[6,6](C[6,6]C[6,6]C[6]C)(C[6,6]C[6,6]C[6]H)(C[6]C[6]H){6|H<1>,7|C<4>}	H(C[6]C[6,6]C[6])	116.7310	0.218	2	117.1275	0.565	31	117.6001	1.512	48	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]2)(C[6]C[6,6]HH)(H)	C[6,6](C[6,6]C[6,6]C[6]C)(C[6,6]C[6,6]C[6]H)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2)(C[6]C[6,6]HH)(H){1|H<1>,7|C<4>}	C[6,6](C[6,6]C[6,6]C[6]C)(C[6,6]C[6,6]C[6]H)(C[6]C[6]H){6|C<4>,7|H<1>}	H(C[6]C[6,6]C[6])	117.4405	0.237	2	117.1275	0.565	31	117.6001	1.512	48	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]2)(C[6]C[6,6]HH)(H)	C[6,6](C[6,6]C[6,6]C[6]C)(C[6,6]C[6,6]C[6]H)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2)(C[6]C[6,6]HH)(H){2|H<1>,6|C<4>}	C[6,6](C[6,6]C[6,6]C[6]C)(C[6,6]C[6,6]C[6]H)(C[6]C[6]H){1|C<3>,1|O<2>,5|C<4>,6|H<1>}	H(C[6]C[6,6]C[6])	116.9170	0.000	1	117.1275	0.565	31	117.6001	1.512	48	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]2)(C[6]C[6,6]HH)(H)	C[6,6](C[6,6]C[6,6]C[6]C)(C[6,6]C[6,6]C[6]H)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2)(C[6]C[6,6]HH)(H){2|H<1>,6|C<4>}	C[6,6](C[6,6]C[6,6]C[6]C)(C[6,6]C[6,6]C[6]H)(C[6]C[6]H){1|C<3>,1|O<2>,5|H<1>,6|C<4>}	H(C[6]C[6,6]C[6])	117.0750	0.000	1	117.1275	0.565	31	117.6001	1.512	48	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]2)(C[6]C[6,6]HH)(H)	C[6,6](C[6,6]C[6,6]C[6]C)(C[6,6]C[6,6]C[6]H)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2)(C[6]C[6,6]HH)(H){2|H<1>,6|C<4>}	C[6,6](C[6,6]C[6,6]C[6]C)(C[6,6]C[6,6]C[6]H)(C[6]C[6]H){1|C<3>,5|H<1>,7|C<4>}	H(C[6]C[6,6]C[6])	116.7895	0.194	4	117.1275	0.565	31	117.6001	1.512	48	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]2)(C[6]C[6,6]HH)(H)	C[6,6](C[6,6]C[6,6]C[6]C)(C[6,6]C[6,6]C[6]H)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2)(C[6]C[6,6]HH)(H){2|H<1>,6|C<4>}	C[6,6](C[6,6]C[6,6]C[6]C)(C[6,6]C[6,6]C[6]H)(C[6]C[6]H){1|C<3>,6|C<4>,6|H<1>}	H(C[6]C[6,6]C[6])	117.0933	0.166	9	117.1275	0.565	31	117.6001	1.512	48	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]2)(C[6]C[6,6]HH)(H)	C[6,6](C[6,6]C[6,6]C[6]C)(C[6,6]C[6,6]C[6]H)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2)(C[6]C[6,6]HH)(H){2|H<1>,6|C<4>}	C[6,6](C[6,6]C[6,6]C[6]C)(C[6,6]C[6,6]C[6]H)(C[6]C[6]H){6|H<1>,7|C<4>}	H(C[6]C[6,6]C[6])	117.4072	1.350	9	117.1275	0.565	31	117.6001	1.512	48	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]2)(C[6]C[6,6]HH)(H)	C[6,6](C[6,6]C[6,6]C[6]C)2(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2)(C[6]C[6,6]HH)(H){1|C<3>,7|C<4>}	C[6,6](C[6,6]C[6,6]C[6]C)2(C[6]C[6]H){1|O<1>,5|C<4>,6|H<1>}	H(C[6]C[6,6]C[6])	118.8680	0.000	1	119.7024	0.985	5	117.6001	1.512	48	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]2)(C[6]C[6,6]HH)(H)	C[6,6](C[6,6]C[6,6]C[6]C)2(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2)(C[6]C[6,6]HH)(H){8|C<4>}	C[6,6](C[6,6]C[6,6]C[6]C)2(C[6]C[6]H){5|C<4>,8|H<1>}	H(C[6]C[6,6]C[6])	119.9110	1.012	4	119.7024	0.985	5	117.6001	1.512	48	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]2)(C[6]C[6,6]HO)(H)	C[6,6](C[6,6]C[6,6]C[6]C)(C[6,6]C[6,6]C[6]H)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2)(C[6]C[6,6]HO)(H){2|H<1>,6|C<4>}	C[6,6](C[6,6]C[6,6]C[6]C)(C[6,6]C[6,6]C[6]H)(C[6]C[6]H){1|O<2>,4|H<1>,8|C<4>}	H(C[6]C[6,6]C[6])	116.3280	0.000	1	116.3280	0.000	1	117.6001	1.512	48	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]2)(C[6]C[6]HH)(H)	C[6,6](C[6,6]C[6,6]C[6]C)(C[6,6]C[6]2H)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2)(C[6]C[6]HH)(H){1|C<3>,1|H<1>,6|C<4>}	C[6,6](C[6,6]C[6,6]C[6]C)(C[6,6]C[6]2H)(C[6]C[6]H){4|C<4>,9|H<1>}	H(C[6]C[6,6]C[6])	117.3500	0.055	2	117.3500	0.003	2	117.6001	1.512	48	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]2)(C[6]C[6]HH)(H)	C[6,6](C[6,6]C[6,6]C[6]H)(C[6,6]C[6]O[6]H)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2)(C[6]C[6]HH)(H){1|O<2>,3|H<1>,4|C<4>}	C[6,6](C[6,6]C[6,6]C[6]H)(C[6,6]C[6]O[6]H)(C[6]C[6]H){5|C<4>,6|H<1>}	H(C[6]C[6,6]C[6])	118.4335	0.285	2	118.4335	0.081	2	117.6001	1.512	48	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]2)(C[6]C[6]HH)(H)	C[6,6](C[6,6]C[6,6]C[6]H)2(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2)(C[6]C[6]HH)(H){4|C<4>,4|H<1>}	C[6,6](C[6,6]C[6,6]C[6]H)2(C[6]C[6]H){1|O<2>,5|C<4>,7|H<1>}	H(C[6]C[6,6]C[6])	117.8110	0.000	1	117.8110	0.000	1	117.6001	1.512	48	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]2)(C[6]C[6]HO)(H)	C[6,6](C[6,6]C[6,6]C[6]O)(C[6,6]C[6]O[6]H)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2)(C[6]C[6]HO)(H){1|C<3>,2|H<1>,2|O<2>,3|C<4>}	C[6,6](C[6,6]C[6,6]C[6]O)(C[6,6]C[6]O[6]H)(C[6]C[6]H){1|O<2>,5|C<4>,5|H<1>}	H(C[6]C[6,6]C[6])	118.6360	0.000	1	118.6360	0.000	1	117.6001	1.512	48	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[3]C[6]C)(H)	C[6,6](C[6,6]C[6,6]C[6]H)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[3]C[6]C)(H){1|O<2>,4|C<4>,6|H<1>}	C[6,6](C[6,6]C[6,6]C[6]H)(C[6]C[6]HH)(C[6]C[6]H){4|H<1>,6|C<4>}	H(C[6]C[6,6]C[6])	117.3945	0.105	4	117.3945	0.011	4	117.6125	0.581	272	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[3x6]HO)(H)	C[6,6](C[6,6]C[3x6]C[6]H)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[3x6]HO)(H){4|C<4>,4|H<1>}	C[6,6](C[6,6]C[3x6]C[6]H)(C[6]C[6]HH)(C[6]C[6]H){1|O<2>,3|H<1>,6|C<4>}	H(C[6]C[6,6]C[6])	117.2990	0.000	1	117.2990	0.000	1	117.6125	0.581	272	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[5,6]CH)(H)	C[6,6](C[6,6]C[5,6]C[6]H)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[5,6]CH)(H){2|C<3>,2|C<4>,4|H<1>}	C[6,6](C[6,6]C[5,6]C[6]H)(C[6]C[6]HH)(C[6]C[6]H){1|O<2>,2|C<3>,2|C<4>,4|H<1>}	H(C[6]C[6,6]C[6])	120.0695	0.129	2	120.0695	0.017	2	117.6125	0.581	272	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[5,6]ClH)(H)	C[6,6](C[6,6]C[5,6]O[6]H)(C[6]O[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[5,6]ClH)(H){1|C<4>,3|O<2>,4|H<1>}	C[6,6](C[6,6]C[5,6]O[6]H)(C[6]O[6]HH)(C[6]C[6]H){1|Cl<1>,1|O<2>,2|C<4>,2|H<1>}	H(C[6]C[6,6]C[6])	119.0720	0.000	1	119.0720	0.000	1	117.6125	0.581	272	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[5,6]HH)(H)	C[6,6](C[6,6]C[5,6]2H)(C[6]C[5,6,6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[5,6]HH)(H){3|H<1>,5|C<4>}	C[6,6](C[6,6]C[5,6]2H)(C[6]C[5,6,6]HH)(C[6]C[6]H){1|O<2>,3|H<1>,6|C<4>}	H(C[6]C[6,6]C[6])	117.1570	0.000	1	117.1570	0.000	1	117.6125	0.581	272	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[5,6]HH)(H)	C[6,6](C[6,6]C[5,6]C[6]H)(C[6]C[5,6]CH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[5,6]HH)(H){1|C<3>,3|H<1>,4|C<4>}	C[6,6](C[6,6]C[5,6]C[6]H)(C[6]C[5,6]CH)(C[6]C[6]H){2|C<3>,2|C<4>,6|H<1>}	H(C[6]C[6,6]C[6])	121.1440	0.000	1	121.1440	0.000	1	117.6125	0.581	272	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[5,6]HH)(H)	C[6,6](C[6,6]C[5,6]C[6]H)(C[6]C[5,6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[5,6]HH)(H){1|C<3>,3|C<4>,4|H<1>}	C[6,6](C[6,6]C[5,6]C[6]H)(C[6]C[5,6]HH)(C[6]C[6]H){2|C<3>,2|C<4>,6|H<1>}	H(C[6]C[6,6]C[6])	121.7560	0.000	1	121.7560	0.000	1	117.6125	0.581	272	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[5,6]HH)(H)	C[6,6](C[6,6]C[5,6]C[6]H)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[5,6]HH)(H){1|C<3>,3|C<4>,4|H<1>}	C[6,6](C[6,6]C[5,6]C[6]H)(C[6]C[6]HH)(C[6]C[6]H){1|C<3>,2|C<4>,7|H<1>}	H(C[6]C[6,6]C[6])	119.8200	0.000	1	119.8200	0.000	1	117.6125	0.581	272	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[5,6]HO)(H)	C[6,6](C[6,6]C[5,6]O[6]H)(C[6]O[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[5,6]HO)(H){1|C<4>,3|O<2>,4|H<1>}	C[6,6](C[6,6]C[5,6]O[6]H)(C[6]O[6]HH)(C[6]C[6]H){2|C<4>,2|H<1>,2|O<2>}	H(C[6]C[6,6]C[6])	117.3890	0.246	4	117.3890	0.060	4	117.6125	0.581	272	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[5]C[6]C)(H)	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[5]C[6]C)(H){1|Re<8>,4|H<1>,6|C<4>}	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]HH)(C[6]C[6]H){5|C<4>,5|H<1>}	H(C[6]C[6,6]C[6])	116.1470	0.000	1	116.1470	0.000	1	117.6125	0.581	272	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]CH)(H)	C[6,6](C[6,6]C[6,6]O[6]H)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]CH)(H){1|C<3>,1|O<2>,2|C<4>,4|H<1>}	C[6,6](C[6,6]C[6,6]O[6]H)(C[6]C[6]HH)(C[6]C[6]H){1|C<3>,3|H<1>,4|C<4>}	H(C[6]C[6,6]C[6])	117.5330	0.000	1	117.5330	0.000	1	117.6125	0.581	272	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]HH)(H)	C[6,6](C[6,6]C[5,6]C[6,6]H)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]HH)(H){2|C<3>,2|C<4>,3|H<1>}	C[6,6](C[6,6]C[5,6]C[6,6]H)(C[6]C[6]HH)(C[6]C[6]H){1|Fe<10>,2|C<3>,2|C<4>,4|H<1>}	H(C[6]C[6,6]C[6])	119.2040	0.000	1	119.2040	0.000	1	117.6125	0.581	272	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]HH)(H)	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[5,6]HO)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]HH)(H){1|O<2>,2|H<1>,5|C<4>}	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[5,6]HO)(C[6]C[6]H){4|H<1>,6|C<4>}	H(C[6]C[6,6]C[6])	116.9350	0.000	1	116.9350	0.000	1	117.6125	0.581	272	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]HH)(H)	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]HH)(H){1|C<3>,3|H<1>,4|C<4>}	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]HH)(C[6]C[6]H){1|O<1>,3|C<4>,6|H<1>}	H(C[6]C[6,6]C[6])	117.7040	0.000	1	117.4284	0.135	141	117.6125	0.581	272	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]HH)(H)	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]HH)(H){1|C<3>,3|H<1>,4|C<4>}	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]HH)(C[6]C[6]H){1|O<2>,3|C<4>,6|H<1>}	H(C[6]C[6,6]C[6])	117.3420	0.464	2	117.4284	0.135	141	117.6125	0.581	272	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]HH)(H)	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]HH)(H){2|H<1>,5|C<4>}	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]HH)(C[6]C[6]H){1|C<3>,1|O<1>,2|C<4>,6|H<1>}	H(C[6]C[6,6]C[6])	117.0620	0.000	1	117.4284	0.135	141	117.6125	0.581	272	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]HH)(H)	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]HH)(H){3|H<1>,5|C<4>}	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]HH)(C[6]C[6]H){1|B<4>,3|C<4>,6|H<1>}	H(C[6]C[6,6]C[6])	117.3870	0.243	3	117.4284	0.135	141	117.6125	0.581	272	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]HH)(H)	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]HH)(H){3|H<1>,5|C<4>}	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]HH)(C[6]C[6]H){1|C<3>,3|C<4>,6|H<1>}	H(C[6]C[6,6]C[6])	117.1835	0.145	4	117.4284	0.135	141	117.6125	0.581	272	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]HH)(H)	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]HH)(H){3|H<1>,5|C<4>}	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]HH)(C[6]C[6]H){1|Cl<1>,3|C<4>,6|H<1>}	H(C[6]C[6,6]C[6])	117.4973	0.177	6	117.4284	0.135	141	117.6125	0.581	272	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]HH)(H)	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]HH)(H){3|H<1>,5|C<4>}	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]HH)(C[6]C[6]H){1|N<2>,3|C<4>,6|H<1>}	H(C[6]C[6,6]C[6])	117.6233	0.269	3	117.4284	0.135	141	117.6125	0.581	272	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]HH)(H)	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]HH)(H){3|H<1>,5|C<4>}	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]HH)(C[6]C[6]H){1|N<3>,3|C<4>,6|H<1>}	H(C[6]C[6,6]C[6])	117.4373	0.275	7	117.4284	0.135	141	117.6125	0.581	272	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]HH)(H)	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]HH)(H){3|H<1>,5|C<4>}	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]HH)(C[6]C[6]H){1|N<4>,3|C<4>,6|H<1>}	H(C[6]C[6,6]C[6])	117.7330	0.048	3	117.4284	0.135	141	117.6125	0.581	272	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]HH)(H)	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]HH)(H){3|H<1>,5|C<4>}	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]HH)(C[6]C[6]H){1|O<2>,3|C<4>,6|H<1>}	H(C[6]C[6,6]C[6])	117.4204	0.394	109	117.4284	0.135	141	117.6125	0.581	272	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]HH)(H)	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]HH)(H){3|H<1>,5|C<4>}	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]HH)(C[6]C[6]H){3|C<4>,7|H<1>}	H(C[6]C[6,6]C[6])	117.5640	0.048	2	117.4284	0.135	141	117.6125	0.581	272	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]HH)(H)	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]HN)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]HH)(H){1|N<3>,2|H<1>,5|C<4>}	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]HN)(C[6]C[6]H){1|O<2>,3|C<4>,6|H<1>}	H(C[6]C[6,6]C[6])	117.4855	0.186	2	117.4855	0.035	2	117.6125	0.581	272	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]HH)(H)	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]HO)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]HH)(H){1|O<2>,2|H<1>,5|C<4>}	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]HO)(C[6]C[6]H){1|O<2>,3|C<4>,6|H<1>}	H(C[6]C[6,6]C[6])	117.5700	0.000	1	117.5700	0.000	1	117.6125	0.581	272	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]HH)(H)	C[6,6](C[6,6]C[6,6]C[6]H)(C[6]C[5,6]CC)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]HH)(H){2|H<1>,6|C<4>}	C[6,6](C[6,6]C[6,6]C[6]H)(C[6]C[5,6]CC)(C[6]C[6]H){1|C<3>,2|O<2>,3|C<4>,4|H<1>}	H(C[6]C[6,6]C[6])	116.8120	0.000	1	117.0765	0.140	2	117.6125	0.581	272	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]HH)(H)	C[6,6](C[6,6]C[6,6]C[6]H)(C[6]C[5,6]CC)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]HH)(H){2|H<1>,6|C<4>}	C[6,6](C[6,6]C[6,6]C[6]H)(C[6]C[5,6]CC)(C[6]C[6]H){2|C<3>,2|C<4>,2|O<2>,4|H<1>}	H(C[6]C[6,6]C[6])	117.3410	0.000	1	117.0765	0.140	2	117.6125	0.581	272	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]HH)(H)	C[6,6](C[6,6]C[6,6]C[6]H)(C[6]C[6,6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]HH)(H){4|C<4>,4|H<1>}	C[6,6](C[6,6]C[6,6]C[6]H)(C[6]C[6,6]HH)(C[6]C[6]H){1|O<2>,4|H<1>,5|C<4>}	H(C[6]C[6,6]C[6])	117.9410	0.163	2	117.9410	0.026	2	117.6125	0.581	272	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]HH)(H)	C[6,6](C[6,6]C[6,6]C[6]H)(C[6]C[6]CC)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]HH)(H){2|H<1>,6|C<4>}	C[6,6](C[6,6]C[6,6]C[6]H)(C[6]C[6]CC)(C[6]C[6]H){1|C<3>,1|O<2>,3|C<4>,5|H<1>}	H(C[6]C[6,6]C[6])	117.6385	0.402	13	117.6464	0.150	14	117.6125	0.581	272	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]HH)(H)	C[6,6](C[6,6]C[6,6]C[6]H)(C[6]C[6]CC)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]HH)(H){2|H<1>,6|C<4>}	C[6,6](C[6,6]C[6,6]C[6]H)(C[6]C[6]CC)(C[6]C[6]H){1|O<2>,4|C<4>,5|H<1>}	H(C[6]C[6,6]C[6])	117.7490	0.000	1	117.6464	0.150	14	117.6125	0.581	272	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]HH)(H)	C[6,6](C[6,6]C[6,6]C[6]H)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]HH)(H){1|C<3>,3|C<4>,4|H<1>}	C[6,6](C[6,6]C[6,6]C[6]H)(C[6]C[6]HH)(C[6]C[6]H){4|C<4>,6|H<1>}	H(C[6]C[6,6]C[6])	117.3520	0.000	1	117.9935	0.871	13	117.6125	0.581	272	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]HH)(H)	C[6,6](C[6,6]C[6,6]C[6]H)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]HH)(H){1|C<3>,3|C<4>,4|H<1>}	C[6,6](C[6,6]C[6,6]C[6]H)(C[6]C[6]HH)(C[6]C[6]H){5|C<4>,5|H<1>}	H(C[6]C[6,6]C[6])	117.4940	0.136	2	117.9935	0.871	13	117.6125	0.581	272	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]HH)(H)	C[6,6](C[6,6]C[6,6]C[6]H)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]HH)(H){1|C<3>,3|H<1>,4|C<4>}	C[6,6](C[6,6]C[6,6]C[6]H)(C[6]C[6]HH)(C[6]C[6]H){1|C<3>,3|C<4>,6|H<1>}	H(C[6]C[6,6]C[6])	117.3450	0.000	1	117.9935	0.871	13	117.6125	0.581	272	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]HH)(H)	C[6,6](C[6,6]C[6,6]C[6]H)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]HH)(H){2|C<3>,2|C<4>,3|H<1>}	C[6,6](C[6,6]C[6,6]C[6]H)(C[6]C[6]HH)(C[6]C[6]H){1|C<4>,1|N<3>,2|C<3>,5|H<1>}	H(C[6]C[6,6]C[6])	117.7450	0.000	1	117.9935	0.871	13	117.6125	0.581	272	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]HH)(H)	C[6,6](C[6,6]C[6,6]C[6]H)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]HH)(H){2|C<3>,2|C<4>,4|H<1>}	C[6,6](C[6,6]C[6,6]C[6]H)(C[6]C[6]HH)(C[6]C[6]H){1|Br<1>,1|O<2>,2|C<3>,2|H<1>,3|C<4>}	H(C[6]C[6,6]C[6])	117.0980	0.000	1	117.9935	0.871	13	117.6125	0.581	272	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]HH)(H)	C[6,6](C[6,6]C[6,6]C[6]H)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]HH)(H){2|C<3>,2|C<4>,4|H<1>}	C[6,6](C[6,6]C[6,6]C[6]H)(C[6]C[6]HH)(C[6]C[6]H){1|O<2>,2|C<3>,3|C<4>,3|H<1>}	H(C[6]C[6,6]C[6])	119.6060	1.435	2	117.9935	0.871	13	117.6125	0.581	272	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]HH)(H)	C[6,6](C[6,6]C[6,6]C[6]H)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]HH)(H){4|C<4>,4|H<1>}	C[6,6](C[6,6]C[6,6]C[6]H)(C[6]C[6]HH)(C[6]C[6]H){1|C<3>,1|O<2>,3|H<1>,5|C<4>}	H(C[6]C[6,6]C[6])	117.9180	0.000	1	117.9935	0.871	13	117.6125	0.581	272	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]HH)(H)	C[6,6](C[6,6]C[6,6]C[6]H)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]HH)(H){4|C<4>,4|H<1>}	C[6,6](C[6,6]C[6,6]C[6]H)(C[6]C[6]HH)(C[6]C[6]H){1|C<3>,4|C<4>,5|H<1>}	H(C[6]C[6,6]C[6])	117.9830	0.000	1	117.9935	0.871	13	117.6125	0.581	272	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]HH)(H)	C[6,6](C[6,6]C[6,6]C[6]H)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]HH)(H){4|C<4>,4|H<1>}	C[6,6](C[6,6]C[6,6]C[6]H)(C[6]C[6]HH)(C[6]C[6]H){1|C<3>,4|H<1>,5|C<4>}	H(C[6]C[6,6]C[6])	118.0917	0.686	3	117.9935	0.871	13	117.6125	0.581	272	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]HH)(H)	C[6,6](C[6,6]C[6,6]C[6]H)(C[6]O[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]HH)(H){1|C<3>,1|O<2>,3|C<4>,3|H<1>}	C[6,6](C[6,6]C[6,6]C[6]H)(C[6]O[6]HH)(C[6]C[6]H){1|C<3>,2|C<4>,5|H<1>}	H(C[6]C[6,6]C[6])	119.1580	0.000	1	119.1580	0.000	1	117.6125	0.581	272	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]HO)(H)	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]CH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]HO)(H){2|H<1>,6|C<4>}	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]CH)(C[6]C[6]H){2|O<2>,3|H<1>,5|C<4>}	H(C[6]C[6,6]C[6])	121.8740	0.000	1	121.8740	0.000	1	117.6125	0.581	272	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]HO)(H)	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]HO)(H){3|H<1>,5|C<4>}	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]HH)(C[6]C[6]H){2|O<2>,3|C<4>,5|H<1>}	H(C[6]C[6,6]C[6])	117.3988	0.328	6	117.3988	0.108	6	117.6125	0.581	272	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]CC)(H)	C[6,6](C[6,6]C[3,6,6]C[6]O)(C[6]C[5,6]HO)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]CC)(H){1|C<3>,2|C<4>,2|O<2>,3|H<1>}	C[6,6](C[6,6]C[3,6,6]C[6]O)(C[6]C[5,6]HO)(C[6]C[6]H){1|C<3>,1|H<1>,1|O<1>,1|O<2>,5|C<4>}	H(C[6]C[6,6]C[6])	117.0710	0.000	1	117.0710	0.000	1	117.6125	0.581	272	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]CC)(H)	C[6,6](C[6,6]C[5,6,6]C[6]O)(C[6]C[5,6]HO)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]CC)(H){2|O<2>,3|C<4>,3|H<1>}	C[6,6](C[6,6]C[5,6,6]C[6]O)(C[6]C[5,6]HO)(C[6]C[6]H){1|C<3>,1|H<1>,3|O<2>,5|C<4>}	H(C[6]C[6,6]C[6])	116.4975	0.518	2	116.4975	0.269	2	117.6125	0.581	272	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]CC)(H)	C[6,6](C[6,6]C[6,6]C[6]H)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]CC)(H){3|C<4>,5|H<1>}	C[6,6](C[6,6]C[6,6]C[6]H)(C[6]C[6]HH)(C[6]C[6]H){1|C<3>,1|O<2>,3|H<1>,5|C<4>}	H(C[6]C[6,6]C[6])	117.6070	0.000	1	117.1220	0.207	9	117.6125	0.581	272	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]CC)(H)	C[6,6](C[6,6]C[6,6]C[6]H)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]CC)(H){3|C<4>,5|H<1>}	C[6,6](C[6,6]C[6,6]C[6]H)(C[6]C[6]HH)(C[6]C[6]H){1|C<3>,4|H<1>,5|C<4>}	H(C[6]C[6,6]C[6])	117.0678	0.584	5	117.1220	0.207	9	117.6125	0.581	272	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]CC)(H)	C[6,6](C[6,6]C[6,6]C[6]H)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]CC)(H){3|C<4>,5|H<1>}	C[6,6](C[6,6]C[6,6]C[6]H)(C[6]C[6]HH)(C[6]C[6]H){4|H<1>,6|C<4>}	H(C[6]C[6,6]C[6])	117.0507	0.117	3	117.1220	0.207	9	117.6125	0.581	272	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]CC)(H)	C[6,6](C[6,6]C[6,6]C[6]H)(C[6]C[6]HO)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]CC)(H){1|O<2>,3|C<4>,4|H<1>}	C[6,6](C[6,6]C[6,6]C[6]H)(C[6]C[6]HO)(C[6]C[6]H){1|C<3>,4|H<1>,5|C<4>}	H(C[6]C[6,6]C[6])	117.7460	0.126	4	117.7460	0.016	4	117.6125	0.581	272	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]CH)(H)	C[6,6](C[6,6]C[6]2C)(C[6]C[6]CH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]CH)(H){3|H<1>,5|C<4>}	C[6,6](C[6,6]C[6]2C)(C[6]C[6]CH)(C[6]C[6]H){1|C<3>,2|C<4>,7|H<1>}	H(C[6]C[6,6]C[6])	116.6305	0.148	2	116.6305	0.022	2	117.6125	0.581	272	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]CH)(H)	C[6,6](C[6,6]C[6]2H)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]CH)(H){1|O<2>,3|C<4>,4|H<1>}	C[6,6](C[6,6]C[6]2H)(C[6]C[6]HH)(C[6]C[6]H){1|C<3>,3|C<4>,6|H<1>}	H(C[6]C[6,6]C[6])	118.5575	1.337	4	118.5575	1.788	4	117.6125	0.581	272	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]ClH)(H)	C[6,6](C[6,6]C[6]O[6]H)(C[6]O[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]ClH)(H){1|C<4>,3|O<2>,4|H<1>}	C[6,6](C[6,6]C[6]O[6]H)(C[6]O[6]HH)(C[6]C[6]H){1|Cl<1>,1|O<2>,2|C<4>,2|H<1>}	H(C[6]C[6,6]C[6])	118.5310	0.116	2	118.5310	0.013	2	117.6125	0.581	272	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]HH)(H)	C[6,6](C[6,6]C[6,6]C[6]H)(C[6]C[6]CC)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]HH)(H){1|C<2>,2|H<1>,5|C<4>}	C[6,6](C[6,6]C[6,6]C[6]H)(C[6]C[6]CC)(C[6]C[6]H){2|C<3>,2|C<4>,6|H<1>}	H(C[6]C[6,6]C[6])	117.5020	0.000	1	117.5020	0.000	1	117.6125	0.581	272	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]HH)(H)	C[6,6](C[6,6]C[6,6]C[6]H)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]HH)(H){1|C<3>,2|C<4>,2|S<4>,3|H<1>}	C[6,6](C[6,6]C[6,6]C[6]H)(C[6]C[6]HH)(C[6]C[6]H){1|C<3>,2|C<4>,6|H<1>}	H(C[6]C[6,6]C[6])	118.4783	1.588	3	118.4783	2.522	3	117.6125	0.581	272	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]HH)(H)	C[6,6](C[6,6]C[6]2C)(C[6]C[5,6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]HH)(H){1|C<3>,3|C<4>,4|H<1>}	C[6,6](C[6,6]C[6]2C)(C[6]C[5,6]HH)(C[6]C[6]H){1|O<1>,2|C<4>,2|O<2>,4|H<1>}	H(C[6]C[6,6]C[6])	117.5140	0.000	1	117.5140	0.000	1	117.6125	0.581	272	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]HH)(H)	C[6,6](C[6,6]C[6]2C)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]HH)(H){2|C<3>,2|H<1>,3|C<4>}	C[6,6](C[6,6]C[6]2C)(C[6]C[6]HH)(C[6]C[6]H){1|C<3>,1|C<4>,2|O<2>,5|H<1>}	H(C[6]C[6,6]C[6])	117.5080	0.000	1	117.3392	0.025	4	117.6125	0.581	272	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]HH)(H)	C[6,6](C[6,6]C[6]2C)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]HH)(H){4|C<4>,4|H<1>}	C[6,6](C[6,6]C[6]2C)(C[6]C[6]HH)(C[6]C[6]H){1|O<2>,3|C<4>,6|H<1>}	H(C[6]C[6,6]C[6])	117.3990	0.000	1	117.3392	0.025	4	117.6125	0.581	272	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]HH)(H)	C[6,6](C[6,6]C[6]2C)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]HH)(H){4|C<4>,4|H<1>}	C[6,6](C[6,6]C[6]2C)(C[6]C[6]HH)(C[6]C[6]H){3|C<4>,7|H<1>}	H(C[6]C[6,6]C[6])	117.2250	0.133	2	117.3392	0.025	4	117.6125	0.581	272	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]HH)(H)	C[6,6](C[6,6]C[6]2C)(C[6]C[6]HO)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]HH)(H){1|H<1>,1|O<2>,2|C<3>,3|C<4>}	C[6,6](C[6,6]C[6]2C)(C[6]C[6]HO)(C[6]C[6]H){1|C<3>,2|C<4>,6|H<1>}	H(C[6]C[6,6]C[6])	117.1800	0.000	1	117.1800	0.000	1	117.6125	0.581	272	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]HH)(H)	C[6,6](C[6,6]C[6]2H)(C[6]B[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]HH)(H){1|B<4>,2|C<4>,5|H<1>}	C[6,6](C[6,6]C[6]2H)(C[6]B[6]HH)(C[6]C[6]H){1|P<4>,2|C<3>,2|C<4>,5|H<1>}	H(C[6]C[6,6]C[6])	117.2460	0.000	1	117.2460	0.000	1	117.6125	0.581	272	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]HH)(H)	C[6,6](C[6,6]C[6]2H)(C[6]C[6]CC)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]HH)(H){2|H<1>,6|C<4>}	C[6,6](C[6,6]C[6]2H)(C[6]C[6]CC)(C[6]C[6]H){1|C<3>,3|C<4>,6|H<1>}	H(C[6]C[6,6]C[6])	117.6360	0.000	1	117.7365	0.066	4	117.6125	0.581	272	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]HH)(H)	C[6,6](C[6,6]C[6]2H)(C[6]C[6]CC)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]HH)(H){2|H<1>,6|C<4>}	C[6,6](C[6,6]C[6]2H)(C[6]C[6]CC)(C[6]C[6]H){1|O<2>,2|C<3>,2|C<4>,5|H<1>}	H(C[6]C[6,6]C[6])	117.4500	0.000	1	117.7365	0.066	4	117.6125	0.581	272	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]HH)(H)	C[6,6](C[6,6]C[6]2H)(C[6]C[6]CC)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]HH)(H){2|H<1>,6|C<4>}	C[6,6](C[6,6]C[6]2H)(C[6]C[6]CC)(C[6]C[6]H){4|C<4>,6|H<1>}	H(C[6]C[6,6]C[6])	117.9300	0.177	2	117.7365	0.066	4	117.6125	0.581	272	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]HH)(H)	C[6,6](C[6,6]C[6]2H)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]HH)(H){1|C<3>,1|O<2>,2|C<4>,3|H<1>}	C[6,6](C[6,6]C[6]2H)(C[6]C[6]HH)(C[6]C[6]H){1|C<4>,1|N<2>,2|C<3>,5|H<1>}	H(C[6]C[6,6]C[6])	116.9880	0.000	1	117.2403	0.497	3	117.6125	0.581	272	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]HH)(H)	C[6,6](C[6,6]C[6]2H)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]HH)(H){1|C<3>,1|O<2>,2|C<4>,3|H<1>}	C[6,6](C[6,6]C[6]2H)(C[6]C[6]HH)(C[6]C[6]H){1|C<4>,2|C<3>,6|H<1>}	H(C[6]C[6,6]C[6])	118.0370	0.000	1	117.2403	0.497	3	117.6125	0.581	272	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]HH)(H)	C[6,6](C[6,6]C[6]2H)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]HH)(H){1|C<3>,2|C<4>,2|S<4>,3|H<1>}	C[6,6](C[6,6]C[6]2H)(C[6]C[6]HH)(C[6]C[6]H){1|C<4>,2|C<3>,6|H<1>}	H(C[6]C[6,6]C[6])	116.6960	0.000	1	117.2403	0.497	3	117.6125	0.581	272	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]HH)(H)	C[6,6](C[6,6]C[6]2H)(C[6]N[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]HH)(H){1|C<3>,1|C<4>,1|N<3>,5|H<1>}	C[6,6](C[6,6]C[6]2H)(C[6]N[6]HH)(C[6]C[6]H){1|C<3>,1|S<4>,2|C<4>,4|H<1>}	H(C[6]C[6,6]C[6])	117.6926	0.359	5	117.7704	0.110	7	117.6125	0.581	272	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]HH)(H)	C[6,6](C[6,6]C[6]2H)(C[6]N[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]HH)(H){1|N<3>,2|C<4>,5|H<1>}	C[6,6](C[6,6]C[6]2H)(C[6]N[6]HH)(C[6]C[6]H){1|C<4>,1|S<4>,2|C<3>,5|H<1>}	H(C[6]C[6,6]C[6])	117.9650	0.195	2	117.7704	0.110	7	117.6125	0.581	272	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]HH)(H)	C[6,6](C[6,6]C[6]N[6]H)(C[6]C[6]HO)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]HH)(H){1|N<3>,1|O<2>,2|C<4>,4|H<1>}	C[6,6](C[6,6]C[6]N[6]H)(C[6]C[6]HO)(C[6]C[6]H){2|C<3>,3|C<4>,4|H<1>}	H(C[6]C[6,6]C[6])	117.9274	0.153	5	117.9274	0.023	5	117.6125	0.581	272	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]HH)(H)	C[6,6](C[6,6]C[6]O[6]H)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]HH)(H){1|O<2>,2|C<4>,5|H<1>}	C[6,6](C[6,6]C[6]O[6]H)(C[6]C[6]HH)(C[6]C[6]H){1|C<3>,1|C<4>,1|O<2>,5|H<1>}	H(C[6]C[6,6]C[6])	118.3620	0.000	1	118.3620	0.000	1	117.6125	0.581	272	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]HN)(H)	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]HN)(H){1|O<2>,3|H<1>,4|C<4>}	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]HH)(C[6]C[6]H){1|C<3>,1|N<3>,1|O<2>,2|C<4>,5|H<1>}	H(C[6]C[6,6]C[6])	117.2890	0.000	1	117.2890	0.000	1	117.6125	0.581	272	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]HO)(H)	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]HO)(H){4|C<4>,4|H<1>}	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]HH)(C[6]C[6]H){1|O<2>,3|C<4>,6|H<1>}	H(C[6]C[6,6]C[6])	116.9680	0.000	1	116.9680	0.000	1	117.6125	0.581	272	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]HO)(H)	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]HO)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]HO)(H){1|O<2>,3|H<1>,4|C<4>}	C[6,6](C[6,6]C[6,6]C[6]C)(C[6]C[6]HO)(C[6]C[6]H){1|O<2>,3|C<4>,6|H<1>}	H(C[6]C[6,6]C[6])	117.2195	0.435	2	117.2195	0.189	2	117.6125	0.581	272	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]HO)(H)	C[6,6](C[6,6]C[6]2C)(C[6]C[5,6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]HO)(H){4|C<4>,4|H<1>}	C[6,6](C[6,6]C[6]2C)(C[6]C[5,6]HH)(C[6]C[6]H){2|O<2>,3|C<4>,5|H<1>}	H(C[6]C[6,6]C[6])	117.5790	0.000	1	117.5790	0.000	1	117.6125	0.581	272	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]HO)(H)	C[6,6](C[6,6]C[6]2C)(C[6]C[6]HO)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]HO)(H){1|C<2>,1|O<2>,2|H<1>,4|C<4>}	C[6,6](C[6,6]C[6]2C)(C[6]C[6]HO)(C[6]C[6]H){1|O<2>,3|C<4>,6|H<1>}	H(C[6]C[6,6]C[6])	117.8290	0.000	1	117.8290	0.000	1	117.6125	0.581	272	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]HO)(H)	C[6,6](C[6,6]C[6]2H)(C[6]C[6]CC)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]HO)(H){1|C<3>,3|H<1>,4|C<4>}	C[6,6](C[6,6]C[6]2H)(C[6]C[6]CC)(C[6]C[6]H){1|C<3>,1|C<4>,1|O<2>,6|H<1>}	H(C[6]C[6,6]C[6])	117.5250	0.000	1	117.8400	0.075	3	117.6125	0.581	272	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]HO)(H)	C[6,6](C[6,6]C[6]2H)(C[6]C[6]CC)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]HO)(H){1|C<3>,3|H<1>,4|C<4>}	C[6,6](C[6,6]C[6]2H)(C[6]C[6]CC)(C[6]C[6]H){1|C<3>,1|O<2>,2|C<4>,5|H<1>}	H(C[6]C[6,6]C[6])	117.9975	0.018	2	117.8400	0.075	3	117.6125	0.581	272	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6a]C[6]H)(H)	C[6,6](C[6,6]C[6]N[6]H)(C[6]C[6a]N[6]H)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6a]C[6]H)(H){1|C<4>,2|N<3>,3|C<3>,4|H<1>}	C[6,6](C[6,6]C[6]N[6]H)(C[6]C[6a]N[6]H)(C[6]C[6]H){1|C<4>,1|S<4>,2|H<1>,6|C<3>}	H(C[6]C[6,6]C[6])	117.6390	0.000	1	117.6390	0.000	1	117.6125	0.581	272	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]N[5a,6]HH)(H)	C[6,6](C[6,6]C[6,6a]N[5a,6]H)(C[6]O[6]CC)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]N[5a,6]HH)(H){1|H<1>,1|N<3>,1|O<2>,2|C<3>,2|C<4>}	C[6,6](C[6,6]C[6,6a]N[5a,6]H)(C[6]O[6]CC)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6,6]C[6])	117.2340	0.000	1	117.2340	0.000	1	117.6125	0.581	272	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]N[5a,6]HH)(H)	C[6,6](C[6,6]N[5a,6]C[6]H)(C[6]C[6,6]C[6a]H)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]N[5a,6]HH)(H){1|C<4>,1|N<3>,2|H<1>,3|C<3>}	C[6,6](C[6,6]N[5a,6]C[6]H)(C[6]C[6,6]C[6a]H)(C[6]C[6]H){1|N<3>,4|H<1>,5|C<3>}	H(C[6]C[6,6]C[6])	117.8150	0.000	1	117.8150	0.000	1	117.6125	0.581	272	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]N[6]HH)(H)	C[6,6](C[6,6]C[6]O[6]H)(C[6]N[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]N[6]HH)(H){1|C<3>,1|C<4>,1|N<3>,1|O<2>,3|H<1>}	C[6,6](C[6,6]C[6]O[6]H)(C[6]N[6]HH)(C[6]C[6]H){1|C<3>,1|N<3>,1|O<2>,4|H<1>}	H(C[6]C[6,6]C[6])	119.7360	0.000	1	119.7870	0.005	2	117.6125	0.581	272	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]N[6]HH)(H)	C[6,6](C[6,6]C[6]O[6]H)(C[6]N[6]HH)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]N[6]HH)(H){1|C<4>,1|N<3>,1|O<2>,4|H<1>}	C[6,6](C[6,6]C[6]O[6]H)(C[6]N[6]HH)(C[6]C[6]H){1|N<3>,1|O<2>,5|H<1>}	H(C[6]C[6,6]C[6])	119.8380	0.000	1	119.7870	0.005	2	117.6125	0.581	272	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6,6]-4:S[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]S[6])(C[6]C[6]HH)(H)	C[6,6](C[6,6]C[6]2H)(S[6]N[5,6]OO)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]S[6])(C[6]C[6]HH)(H){1|C<3>,1|H<1>,1|N<3>,2|C<4>,2|O<1>}	C[6,6](C[6,6]C[6]2H)(S[6]N[5,6]OO)(C[6]C[6]H){1|C<3>,1|C<4>,1|N<2>,5|H<1>}	H(C[6]C[6,6]C[6])	118.6640	0.000	1	118.6640	0.000	1	118.6640	0.000	1	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6]-4:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]HH)(H)	C[6,6](C[6]C[5a,6]HH)(C[6,6]C[6]2C)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]HH)(H){1|C<3>,3|C<4>,4|H<1>}	C[6,6](C[6]C[5a,6]HH)(C[6,6]C[6]2C)(C[6]C[6]H){1|C<3>,2|C<4>,2|O<2>,4|H<1>}	H(C[6]C[6,6]C[6])	117.4290	0.000	1	117.4290	0.000	1	117.9935	0.637	2	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	3:4:1:	4:4:3:	3:	C[6,6]-3:C[6]-4:H-1:	C[6]-4:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]HO)(H)	C[6,6](C[6]C[6,6a]HH)(C[6,6]O[6]2H)(C[6]C[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]HO)(H){1|C<3>,1|C<4>,2|O<2>,4|H<1>}	C[6,6](C[6]C[6,6a]HH)(C[6,6]O[6]2H)(C[6]C[6]H){1|C<4>,1|H<1>,1|O<2>,2|C<3>}	H(C[6]C[6,6]C[6])	118.5580	0.000	1	118.5580	0.000	1	117.9935	0.637	2	117.6556	0.758	382	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	4:3:1:	3:3:2:	3:	C[5,6]-4:C[6,6]-3:H-1:	C[6,6]-3:C[6]-3:O[6]-2:	C[6]-3:	C[6](C[5,6]C[5,6a]N[5,5a]C[6])(C[6,6]C[6,6]O[6])(H)	C[6,6](C[6,6]C[6]N[6])(C[6]C[5,6]H)(O[6]C[6,6a])	H(C[6]C[5,6]C[6,6])	C[6](C[5,6]C[5,6a]N[5,5a]C[6])(C[6,6]C[6,6]O[6])(H){1|H<1>,1|N<2>,6|C<3>}	C[6,6](C[6,6]C[6]N[6])(C[6]C[5,6]H)(O[6]C[6,6a]){1|H<1>,1|N<3>,4|C<3>}	H(C[6]C[5,6]C[6,6])	118.9650	0.000	1	118.9650	0.000	1	118.9650	0.000	1	118.5970	0.271	2	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	4:3:1:	3:3:2:	3:	C[5,6]-4:C[6,6]-3:H-1:	C[6,6]-3:C[6]-3:S[6]-2:	C[6]-3:	C[6](C[5,6]C[5,6a]N[5,5a]C[6])(C[6,6]C[6,6]S[6])(H)	C[6,6](C[6,6]C[6]N[6])(C[6]C[5,6]H)(S[6]C[6,6a])	H(C[6]C[5,6]C[6,6])	C[6](C[5,6]C[5,6a]N[5,5a]C[6])(C[6,6]C[6,6]S[6])(H){1|H<1>,1|N<2>,6|C<3>}	C[6,6](C[6,6]C[6]N[6])(C[6]C[5,6]H)(S[6]C[6,6a]){1|H<1>,1|N<3>,4|C<3>}	H(C[6]C[5,6]C[6,6])	118.2290	0.000	1	118.2290	0.000	1	118.2290	0.000	1	118.5970	0.271	2	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	4:3:1:	3:3:3:	3:	C[5,6]-4:C[6,6]-3:H-1:	C[6,6a]-3:N[6,6]-3:C[6]-3:	C[6]-3:	C[6](C[5,6]C[5,6a]C[5]C[6])(C[6,6]C[6,6a]N[6,6])(H)	C[6,6](C[6,6a]C[6,6a]C[6a])(N[6,6]C[6]S[6])(C[6]C[5,6]H)	H(C[6]C[5,6]C[6,6])	C[6](C[5,6]C[5,6a]C[5]C[6])(C[6,6]C[6,6a]N[6,6])(H){1|C<4>,1|H<1>,1|N<3>,1|O<1>,1|S<4>,5|C<3>}	C[6,6](C[6,6a]C[6,6a]C[6a])(N[6,6]C[6]S[6])(C[6]C[5,6]H){1|C<4>,1|O<2>,2|O<1>,3|H<1>,4|C<3>}	H(C[6]C[5,6]C[6,6])	117.2585	0.155	2	117.2585	0.024	2	117.2585	0.024	2	117.2585	0.024	2	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	4:3:1:	3:3:4:	3:	C[4,4,6]-4:C[6,6]-3:H-1:	C[6]-3:C[6,6]-3:C[6]-4:	C[6]-3:	C[6](C[4,4,6]O[5x4]2C[6])(C[6,6]C[6,6]C[6])(H)	C[6,6](C[6]C[4,4,6]H)(C[6,6]C[6]2)(C[6]C[6]HH)	H(C[6]C[4,4,6]C[6,6])	C[6](C[4,4,6]O[5x4]2C[6])(C[6,6]C[6,6]C[6])(H){1|C<3>,1|O<2>,2|C<4>,2|C<6>,2|H<1>}	C[6,6](C[6]C[4,4,6]H)(C[6,6]C[6]2)(C[6]C[6]HH){1|C<3>,1|C<4>,1|N<3>,1|O<2>,2|O<3>,3|H<1>}	H(C[6]C[4,4,6]C[6,6])	119.1700	0.000	1	119.1700	0.000	1	119.1700	0.000	1	119.7419	0.973	14	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	4:3:1:	3:3:4:	3:	C[5,6]-4:C[6,6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-4:	C[6]-3:	C[6](C[5,6]C[5,6,6]O[5]H)(C[6,6]C[6,6]C[6])(H)	C[6,6](C[6,6]C[6,6]C[6])(C[6]C[5,6]H)(C[6]O[6]CH)	H(C[6]C[5,6]C[6,6])	C[6](C[5,6]C[5,6,6]O[5]H)(C[6,6]C[6,6]C[6])(H){1|O<2>,2|C<3>,2|H<1>,3|C<4>}	C[6,6](C[6,6]C[6,6]C[6])(C[6]C[5,6]H)(C[6]O[6]CH){1|C<3>,1|O<2>,2|H<1>,3|C<4>}	H(C[6]C[5,6]C[6,6])	119.4553	0.142	3	119.4735	0.015	4	119.3892	0.097	11	119.7419	0.973	14	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	4:3:1:	3:3:4:	3:	C[5,6]-4:C[6,6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-4:	C[6]-3:	C[6](C[5,6]C[5,6,6]O[5]H)(C[6,6]C[6,6]C[6])(H)	C[6,6](C[6,6]C[6,6]C[6])(C[6]C[5,6]H)(C[6]O[6]CH)	H(C[6]C[5,6]C[6,6])	C[6](C[5,6]C[5,6,6]O[5]H)(C[6,6]C[6,6]C[6])(H){1|O<2>,2|C<4>,2|H<1>,3|C<3>}	C[6,6](C[6,6]C[6,6]C[6])(C[6]C[5,6]H)(C[6]O[6]CH){1|C<3>,1|O<2>,2|H<1>,3|C<4>}	H(C[6]C[5,6]C[6,6])	119.5280	0.000	1	119.4735	0.015	4	119.3892	0.097	11	119.7419	0.973	14	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	4:3:1:	3:3:4:	3:	C[5,6]-4:C[6,6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-4:	C[6]-3:	C[6](C[5,6]C[5,6,6]O[5]H)(C[6,6]C[6,6]C[6])(H)	C[6,6](C[6,6]C[6,6]C[6])(C[6]C[5,6]H)(C[6]O[6]HH)	H(C[6]C[5,6]C[6,6])	C[6](C[5,6]C[5,6,6]O[5]H)(C[6,6]C[6,6]C[6])(H){1|O<2>,2|C<3>,2|C<4>,3|H<1>}	C[6,6](C[6,6]C[6,6]C[6])(C[6]C[5,6]H)(C[6]O[6]HH){1|C<3>,1|O<2>,2|H<1>,3|C<4>}	H(C[6]C[5,6]C[6,6])	119.3525	0.507	4	119.3525	0.257	4	119.3892	0.097	11	119.7419	0.973	14	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	4:3:1:	3:3:4:	3:	C[5,6]-4:C[6,6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-4:	C[6]-3:	C[6](C[5,6]C[5,6,6]O[5]H)(C[6,6]C[6,6]C[6])(H)	C[6,6](C[6,6]C[6,6]C[6])(C[6]C[5,6]H)(C[6]O[6]HO)	H(C[6]C[5,6]C[6,6])	C[6](C[5,6]C[5,6,6]O[5]H)(C[6,6]C[6,6]C[6])(H){2|C<3>,2|C<4>,2|H<1>,2|O<2>}	C[6,6](C[6,6]C[6,6]C[6])(C[6]C[5,6]H)(C[6]O[6]HO){1|C<3>,1|O<2>,2|H<1>,3|C<4>}	H(C[6]C[5,6]C[6,6])	119.2350	0.000	1	119.2350	0.000	1	119.3892	0.097	11	119.7419	0.973	14	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	4:3:1:	3:3:4:	3:	C[5,6]-4:C[6,6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-4:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Zr)(C[6,6]C[6,6]C[6])(H)	C[6,6](C[6,6]C[6]2)(C[6]C[5,6]H)(C[6]C[6]CC)	H(C[6]C[5,6]C[6,6])	C[6](C[5,6]C[5,6]C[5]Zr)(C[6,6]C[6,6]C[6])(H){1|C<3>,1|C<5>,6|C<4>}	C[6,6](C[6,6]C[6]2)(C[6]C[5,6]H)(C[6]C[6]CC){1|Zr<13>,3|H<1>,5|C<4>}	H(C[6]C[5,6]C[6,6])	119.3710	0.303	2	119.3710	0.092	2	119.3892	0.097	11	119.7419	0.973	14	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	4:3:1:	3:3:4:	3:	C[6,6]-4:C[6,6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-4:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]Cr)(C[6,6]C[6,6]C[6])(H)	C[6,6](C[6,6]C[6]2)(C[6]C[6,6]H)(C[6]C[6]CC)	H(C[6]C[6,6]2)	C[6](C[6,6]C[6,6]C[6]Cr)(C[6,6]C[6,6]C[6])(H){1|C<3>,1|H<1>,6|C<4>}	C[6,6](C[6,6]C[6]2)(C[6]C[6,6]H)(C[6]C[6]CC){1|Cr<9>,3|H<1>,5|C<4>}	H(C[6]C[6,6]2)	121.9680	0.266	2	121.9680	0.071	2	121.9680	0.071	2	119.7419	0.973	14	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	4:3:1:	3:4:3:	3:	C[3x6]-4:C[6,6]-3:H-1:	N[5,6]-3:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[3x6]C[3x6]C[6,6]C[6])(C[6,6]C[6,6]N[5,6])(H)	C[6,6](N[5,6]C[5,6,6]C[5])(C[6,6]C[5,6]C[6]C)(C[6]C[3x6]H)	H(C[6]C[3x6]C[6,6])	C[6](C[3x6]C[3x6]C[6,6]C[6])(C[6,6]C[6,6]N[5,6])(H){1|C<3>,1|O<2>,4|H<1>,7|C<4>}	C[6,6](N[5,6]C[5,6,6]C[5])(C[6,6]C[5,6]C[6]C)(C[6]C[3x6]H){1|O<2>,4|H<1>,8|C<4>}	H(C[6]C[3x6]C[6,6])	116.5350	0.000	1	116.5350	0.000	1	116.5350	0.000	1	116.5350	0.000	1	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	4:3:1:	4:3:2:	3:	C[6]-4:C[6,6]-3:H-1:	C[6,6]-4:C[6]-3:O[6]-2:	C[6]-3:	C[6](C[6]C[5,6]C[6a]H)(C[6,6]C[6,6]O[6])(H)	C[6,6](C[6,6]C[5,6]C[6]H)(C[6]C[6]H)(O[6]C[6])	H(C[6]C[6,6]C[6])	C[6](C[6]C[5,6]C[6a]H)(C[6,6]C[6,6]O[6])(H){2|C<4>,2|H<1>,4|C<3>}	C[6,6](C[6,6]C[5,6]C[6]H)(C[6]C[6]H)(O[6]C[6]){2|C<4>,3|H<1>,4|C<3>}	H(C[6]C[6,6]C[6])	121.4010	0.061	2	121.4010	0.004	2	121.4010	0.004	2	121.4010	0.004	2	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	4:3:1:	4:3:3:	3:	C[3,6]-4:C[6,6]-3:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[3,6]C[3,6]O[3]H)(C[6,6]C[6,6]C[6])(H)	C[6,6](C[6,6]C[6]2H)(C[6]C[3,6]H)(C[6]O[6]O)	H(C[6]C[3,6]C[6,6])	C[6](C[3,6]C[3,6]O[3]H)(C[6,6]C[6,6]C[6])(H){1|C<3>,1|H<1>,1|O<1>,1|O<2>,2|C<4>}	C[6,6](C[6,6]C[6]2H)(C[6]C[3,6]H)(C[6]O[6]O){1|O<2>,2|C<4>,5|H<1>}	H(C[6]C[3,6]C[6,6])	119.4490	0.000	1	119.4490	0.000	1	119.4490	0.000	1	117.9863	1.607	3	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	4:3:1:	4:3:3:	3:	C[5,6]-4:C[6,6]-3:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]O)(C[6,6]C[6,6]C[6])(H)	C[6,6](C[6,6]C[6]2C)(C[6]C[5,6]H)(C[6]C[6]H)	H(C[6]C[5,6]C[6,6])	C[6](C[5,6]C[5,6]C[5]O)(C[6,6]C[6,6]C[6])(H){1|C<3>,2|H<1>,2|O<2>,5|C<4>}	C[6,6](C[6,6]C[6]2C)(C[6]C[5,6]H)(C[6]C[6]H){1|C<3>,1|O<2>,3|C<4>,4|H<1>}	H(C[6]C[5,6]C[6,6])	117.3050	0.000	1	117.3050	0.000	1	117.3050	0.000	1	117.9863	1.607	3	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	4:3:1:	4:3:3:	3:	C[6,6]-4:C[6,6]-3:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]H)(C[6,6]C[6,6]C[6])(H)	C[6,6](C[6,6]C[6]2O)(C[6]C[6,6]H)(C[6]C[6]C)	H(C[6]C[6,6]2)	C[6](C[6,6]C[6,6]C[6]H)(C[6,6]C[6,6]C[6])(H){1|C<3>,1|O<2>,3|H<1>,5|C<4>}	C[6,6](C[6,6]C[6]2O)(C[6]C[6,6]H)(C[6]C[6]C){1|C<3>,1|N<3>,3|C<4>,4|H<1>}	H(C[6]C[6,6]2)	117.2050	0.000	1	117.2050	0.000	1	117.2050	0.000	1	117.9863	1.607	3	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	4:3:1:	4:3:4:	3:	C[5,6]-4:C[6,6]-3:H-1:	C[6,6]-4:C[6]-3:C[6]-4:	C[6]-3:	C[6](C[5,6]C[5,3x6]O[5]H)(C[6,6]C[6,6]C[6])(H)	C[6,6](C[6,6]C[4x6]C[6]H)(C[6]C[5,6]H)(C[6]C[6]HH)	H(C[6]C[5,6]C[6,6])	C[6](C[5,6]C[5,3x6]O[5]H)(C[6,6]C[6,6]C[6])(H){1|C<3>,4|C<4>,4|H<1>}	C[6,6](C[6,6]C[4x6]C[6]H)(C[6]C[5,6]H)(C[6]C[6]HH){1|C<3>,1|O<2>,3|H<1>,5|C<4>}	H(C[6]C[5,6]C[6,6])	118.2830	0.000	1	118.2830	0.000	1	117.9697	1.591	6	117.8623	1.407	7	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	4:3:1:	4:3:4:	3:	C[5,6]-4:C[6,6]-3:H-1:	C[6,6]-4:C[6]-3:C[6]-4:	C[6]-3:	C[6](C[5,6]C[5,5,6]C[5,6]H)(C[6,6]C[6,6]C[6])(H)	C[6,6](C[6,6]C[6]2C)(C[6]C[5,6]H)(C[6]C[6]CH)	H(C[6]C[5,6]C[6,6])	C[6](C[5,6]C[5,5,6]C[5,6]H)(C[6,6]C[6,6]C[6])(H){1|C<3>,1|O<2>,2|H<1>,7|C<4>}	C[6,6](C[6,6]C[6]2C)(C[6]C[5,6]H)(C[6]C[6]CH){1|O<2>,3|C<4>,6|H<1>}	H(C[6]C[5,6]C[6,6])	116.3180	0.000	1	116.3180	0.000	1	117.9697	1.591	6	117.8623	1.407	7	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	4:3:1:	4:3:4:	3:	C[5,6]-4:C[6,6]-3:H-1:	C[6,6]-4:C[6]-3:C[6]-4:	C[6]-3:	C[6](C[5,6]C[5,6,6]O[5]H)(C[6,6]C[6,6]C[6])(H)	C[6,6](C[6,6]C[6,6]C[6]H)(C[6]C[5,6]H)(C[6]C[6]HH)	H(C[6]C[5,6]C[6,6])	C[6](C[5,6]C[5,6,6]O[5]H)(C[6,6]C[6,6]C[6])(H){1|C<3>,4|C<4>,4|H<1>}	C[6,6](C[6,6]C[6,6]C[6]H)(C[6]C[5,6]H)(C[6]C[6]HH){1|O<2>,3|H<1>,6|C<4>}	H(C[6]C[5,6]C[6,6])	119.4040	0.000	1	119.4040	0.000	1	117.9697	1.591	6	117.8623	1.407	7	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	4:3:1:	4:3:4:	3:	C[5,6]-4:C[6,6]-3:H-1:	C[6,6]-4:C[6]-3:C[6]-4:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]H)(C[6,6]C[6,6]C[6])(H)	C[6,6](C[6,6]C[6]2C)(C[6]C[5,6]H)(C[6]C[6]CH)	H(C[6]C[5,6]C[6,6])	C[6](C[5,6]C[5,6]C[5]H)(C[6,6]C[6,6]C[6])(H){1|C<3>,2|H<1>,2|O<2>,6|C<4>}	C[6,6](C[6,6]C[6]2C)(C[6]C[5,6]H)(C[6]C[6]CH){1|O<2>,3|C<4>,6|H<1>}	H(C[6]C[5,6]C[6,6])	116.7640	0.000	1	116.7640	0.000	1	117.9697	1.591	6	117.8623	1.407	7	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	4:3:1:	4:3:4:	3:	C[5,6]-4:C[6,6]-3:H-1:	C[6,6]-4:C[6]-3:C[6]-4:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]H)(C[6,6]C[6,6]C[6])(H)	C[6,6](C[6,6]C[6]2H)(C[6]C[5,6]H)(C[6]C[6]HO)	H(C[6]C[5,6]C[6,6])	C[6](C[5,6]C[5,6]C[5]H)(C[6,6]C[6,6]C[6])(H){2|O<2>,3|H<1>,6|C<4>}	C[6,6](C[6,6]C[6]2H)(C[6]C[5,6]H)(C[6]C[6]HO){1|C<3>,1|O<2>,3|C<4>,5|H<1>}	H(C[6]C[5,6]C[6,6])	119.2330	0.000	1	119.2330	0.000	1	117.9697	1.591	6	117.8623	1.407	7	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	4:3:1:	4:3:4:	3:	C[5,6]-4:C[6,6]-3:H-1:	C[6,6]-4:C[6]-3:C[6]-4:	C[6]-3:	C[6](C[5,6]C[6]N[5]S[5])(C[6,6]C[6,6]C[6])(H)	C[6,6](C[6,6]C[6,6]C[6]H)(C[6]C[5,6]H)(C[6]C[6]HH)	H(C[6]C[5,6]C[6,6])	C[6](C[5,6]C[6]N[5]S[5])(C[6,6]C[6,6]C[6])(H){1|N<2>,2|C<3>,3|C<4>,5|H<1>}	C[6,6](C[6,6]C[6,6]C[6]H)(C[6]C[5,6]H)(C[6]C[6]HH){1|N<3>,1|S<2>,3|C<4>,5|H<1>}	H(C[6]C[5,6]C[6,6])	117.8160	0.000	1	117.8160	0.000	1	117.9697	1.591	6	117.8623	1.407	7	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	4:3:1:	4:3:4:	3:	C[6,6]-4:C[6,6]-3:H-1:	C[6,6]-4:C[6]-3:C[6]-4:	C[6]-3:	C[6](C[6,6]C[6,6]O[6]C)(C[6,6]C[6,6]C[6])(H)	C[6,6](C[6,6]C[6]2O)(C[6]C[6,6]H)(C[6]C[6]CH)	H(C[6]C[6,6]2)	C[6](C[6,6]C[6,6]O[6]C)(C[6,6]C[6,6]C[6])(H){1|C<3>,1|O<2>,2|H<1>,5|C<4>}	C[6,6](C[6,6]C[6]2O)(C[6]C[6,6]H)(C[6]C[6]CH){1|O<2>,4|C<4>,5|H<1>}	H(C[6]C[6,6]2)	117.2180	0.000	1	117.2180	0.000	1	117.2180	0.000	1	117.8623	1.407	7	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	4:3:1:	4:4:3:	3:	C[5,6]-4:C[6,6]-3:H-1:	C[5,6]-4:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[5,6]C[5,3x6]O[5]H)(C[6,6]C[5,6]C[6,6])(H)	C[6,6](C[5,6]C[5,6]O[5]H)(C[6,6]C[4x6]C[6]H)(C[6]C[5,6]H)	H(C[6]C[5,6]C[6,6])	C[6](C[5,6]C[5,3x6]O[5]H)(C[6,6]C[5,6]C[6,6])(H){1|C<3>,1|O<2>,3|H<1>,4|C<4>}	C[6,6](C[5,6]C[5,6]O[5]H)(C[6,6]C[4x6]C[6]H)(C[6]C[5,6]H){1|O<2>,3|H<1>,7|C<4>}	H(C[6]C[5,6]C[6,6])	118.3710	0.000	1	118.3710	0.000	1	118.3710	0.000	1	117.9530	0.088	4	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	4:3:1:	4:4:3:	3:	C[6,6]-4:C[6,6]-3:H-1:	C[6,6]-4:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]H)(C[6,6]C[6,6]2)(H)	C[6,6](C[6,6]C[6,6]C[6]H)(C[6,6]C[6,6]C[6]O)(C[6]C[6,6]H)	H(C[6]C[6,6]2)	C[6](C[6,6]C[6,6]C[6]H)(C[6,6]C[6,6]2)(H){1|O<1>,2|H<1>,2|O<2>,5|C<4>}	C[6,6](C[6,6]C[6,6]C[6]H)(C[6,6]C[6,6]C[6]O)(C[6]C[6,6]H){1|O<2>,2|C<3>,4|H<1>,6|C<4>}	H(C[6]C[6,6]2)	117.6840	0.000	1	117.6840	0.000	1	117.8137	0.015	3	117.9530	0.088	4	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6,6]	H	4:3:1:	4:4:3:	3:	C[6,6]-4:C[6,6]-3:H-1:	C[6,6]-4:C[6,6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]H)(C[6,6]C[6,6]2)(H)	C[6,6](C[6,6]C[6,6]C[6]H)2(C[6]C[6,6]H)	H(C[6]C[6,6]2)	C[6](C[6,6]C[6,6]C[6]H)(C[6,6]C[6,6]2)(H){1|O<1>,1|O<2>,3|H<1>,5|C<4>}	C[6,6](C[6,6]C[6,6]C[6]H)2(C[6]C[6,6]H){2|C<3>,5|H<1>,6|C<4>}	H(C[6]C[6,6]2)	117.8785	0.069	2	117.8785	0.005	2	117.8137	0.015	3	117.9530	0.088	4	118.7581	1.845	1854	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	2:3:1:	2:3:1:	3:	C[6]-2:C[6]-3:H-1:	C[6]-2:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6])(C[6]C[6]H)(H){1|B<3>,1|C<3>}	C[6](C[6]C[6,6])(C[6]C[6]H)(H){1|B<3>,1|C<3>}	H(C[6]C[6]2)	125.7090	0.000	1	125.7090	0.000	1	125.7090	0.000	1	121.6720	11.583	17	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	2:3:1:	2:3:1:	3:	C[6]-2:C[6]-3:H-1:	N[6]-2:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a])(C[6]N[6]H)(H)	C[6](N[6]C[6,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a])(C[6]N[6]H)(H){1|C<3>,1|N<3>}	C[6](N[6]C[6,6a])(C[6]C[6]H)(H){1|C<3>,1|N<3>}	H(C[6]C[6]2)	121.5450	0.000	1	118.5275	18.211	2	118.5275	18.211	2	121.6720	11.583	17	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	2:3:1:	2:3:1:	3:	C[6]-2:C[6]-3:H-1:	N[6]-2:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a])(C[6]N[6]H)(H)	C[6](N[6]C[6,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a])(C[6]N[6]H)(H){2|C<3>}	C[6](N[6]C[6,6a])(C[6]C[6]H)(H){2|C<3>}	H(C[6]C[6]2)	115.5100	0.000	1	118.5275	18.211	2	118.5275	18.211	2	121.6720	11.583	17	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	2:3:1:	2:3:1:	3:	N[6]-2:C[6]-3:H-1:	C[6]-2:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a])(C[6]C[6]H)(H){1|C<3>,1|N<3>}	C[6](C[6]C[6,6a])(C[6]N[6]H)(H){1|C<3>,1|N<3>}	H(C[6]C[6]N[6])	120.5600	0.000	1	120.4220	0.038	2	120.4220	0.038	2	121.6720	11.583	17	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	2:3:1:	2:3:1:	3:	N[6]-2:C[6]-3:H-1:	C[6]-2:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a])(C[6]C[6]H)(H){2|C<3>}	C[6](C[6]C[6,6a])(C[6]N[6]H)(H){2|C<3>}	H(C[6]C[6]N[6])	120.2840	0.000	1	120.4220	0.038	2	120.4220	0.038	2	121.6720	11.583	17	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	2:3:1:	2:3:1:	3:	O[6]-2:C[6]-3:H-1:	O[6]-2:C[6]-3:H-1:	C[6]-3:	C[6](O[6]C[6,6a])(C[6]O[6]H)(H)	C[6](O[6]C[6,6a])(C[6]O[6]H)(H)	H(C[6]C[6]O[6])	C[6](O[6]C[6,6a])(C[6]O[6]H)(H){2|C<3>}	C[6](O[6]C[6,6a])(C[6]O[6]H)(H){2|C<3>}	H(C[6]C[6]O[6])	118.2285	0.134	2	118.2285	0.018	2	118.2285	0.018	2	121.6720	11.583	17	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	2:3:1:	2:3:1:	3:	S[6]-2:C[6]-3:H-1:	S[6]-2:C[6]-3:H-1:	C[6]-3:	C[6](S[6]C[5,6])(C[6]S[6]H)(H)	C[6](S[6]C[5,6])(C[6]S[6]H)(H)	H(C[6]C[6]S[6])	C[6](S[6]C[5,6])(C[6]S[6]H)(H){1|C<3>,1|S<2>}	C[6](S[6]C[5,6])(C[6]S[6]H)(H){1|C<3>,1|S<2>}	H(C[6]C[6]S[6])	122.8359	3.173	10	122.8359	10.067	10	122.8359	10.067	10	121.6720	11.583	17	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	2:3:1:	2:3:3:	3:	O[6]-2:C[6]-3:H-1:	O[6]-2:C[6]-3:C-3:	C[6]-3:	C[6](O[6]C[6,6a])(C[6]O[6]C)(H)	C[6](O[6]C[6,6a])(C[6]O[6]H)(COO)	H(C[6]C[6]O[6])	C[6](O[6]C[6,6a])(C[6]O[6]C)(H){2|C<3>}	C[6](O[6]C[6,6a])(C[6]O[6]H)(COO){2|C<3>}	H(C[6]C[6]O[6])	126.6180	0.000	1	126.6180	0.000	1	126.6180	0.000	1	118.6240	47.928	3	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	2:3:1:	2:3:3:	3:	S[6]-2:C[6]-3:H-1:	S[6]-2:C[6]-3:C-3:	C[6]-3:	C[6](S[6]C[5x3,5x5,21x6])(C[6]S[6]C)(H)	C[6](S[6]C[5x3,5x5,21x6])(C[6]S[6]H)(CC[5]O)	H(C[6]C[6]S[6])	C[6](S[6]C[5x3,5x5,21x6])(C[6]S[6]C)(H){1|C<6>,4|B<6>}	C[6](S[6]C[5x3,5x5,21x6])(C[6]S[6]H)(CC[5]O){1|C<6>,4|B<6>}	H(C[6]C[6]S[6])	114.6270	0.000	2	114.6270	0.000	2	114.6270	0.000	2	118.6240	47.928	3	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	2:3:1:	2:3:4:	3:	C[6]-2:C[6]-3:H-1:	N[6]-2:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[5a,6])(C[6]N[6]C)(H)	C[6](N[6]C[5a,6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[5a,6])(C[6]N[6]C)(H){1|C<3>,1|N<2>}	C[6](N[6]C[5a,6])(C[6]C[6]H)(CH3){1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.0050	0.000	1	120.0050	0.000	1	120.0050	0.000	1	115.6210	38.439	2	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	2:3:1:	2:3:4:	3:	S[6]-2:C[6]-3:H-1:	S[6]-2:C[6]-3:C-4:	C[6]-3:	C[6](S[6]C[5a,6])(C[6]S[6]C)(H)	C[6](S[6]C[5a,6])(C[6]S[6]H)(CCHH)	H(C[6]C[6]S[6])	C[6](S[6]C[5a,6])(C[6]S[6]C)(H){2|C<3>}	C[6](S[6]C[5a,6])(C[6]S[6]H)(CCHH){2|C<3>}	H(C[6]C[6]S[6])	111.2370	0.000	1	111.2370	0.000	1	111.2370	0.000	1	115.6210	38.439	2	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	2:3:1:	3:3:1:	3:	C[6]-2:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[3x6])(C[6]C[6]H)(H)	C[6](C[6]C[3x6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[3x6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[3x6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>}	H(C[6]C[6]2)	109.1810	0.000	1	109.1810	0.000	1	118.2405	7.767	31	117.9871	3.512	81	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	2:3:1:	3:3:1:	3:	C[6]-2:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6])(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){2|C<3>}	H(C[6]C[6]2)	119.6440	0.000	1	119.0794	6.302	14	118.2405	7.767	31	117.9871	3.512	81	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	2:3:1:	3:3:1:	3:	C[6]-2:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>}	H(C[6]C[6]2)	116.3380	0.000	1	119.0794	6.302	14	118.2405	7.767	31	117.9871	3.512	81	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	2:3:1:	3:3:1:	3:	C[6]-2:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){2|C<3>}	H(C[6]C[6]2)	116.0870	0.000	1	119.0794	6.302	14	118.2405	7.767	31	117.9871	3.512	81	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	2:3:1:	3:3:1:	3:	C[6]-2:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>}	H(C[6]C[6]2)	119.1670	0.000	1	119.0794	6.302	14	118.2405	7.767	31	117.9871	3.512	81	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	2:3:1:	3:3:1:	3:	C[6]-2:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|N<3>}	H(C[6]C[6]2)	122.2920	0.000	1	119.0794	6.302	14	118.2405	7.767	31	117.9871	3.512	81	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	2:3:1:	3:3:1:	3:	C[6]-2:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|S<2>}	H(C[6]C[6]2)	117.4953	1.818	3	119.0794	6.302	14	118.2405	7.767	31	117.9871	3.512	81	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	2:3:1:	3:3:1:	3:	C[6]-2:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|N<3>}	H(C[6]C[6]2)	120.1270	0.000	1	119.0794	6.302	14	118.2405	7.767	31	117.9871	3.512	81	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	2:3:1:	3:3:1:	3:	C[6]-2:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){2|C<3>}	H(C[6]C[6]2)	123.8700	0.000	1	119.0794	6.302	14	118.2405	7.767	31	117.9871	3.512	81	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	2:3:1:	3:3:1:	3:	C[6]-2:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6])(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>}	H(C[6]C[6]2)	122.4890	0.000	1	119.0794	6.302	14	118.2405	7.767	31	117.9871	3.512	81	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	2:3:1:	3:3:1:	3:	C[6]-2:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6])(C[6]C[6]H)(H){1|Ru<8>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ru<8>,2|C<4>}	H(C[6]C[6]2)	119.1500	0.000	1	119.0794	6.302	14	118.2405	7.767	31	117.9871	3.512	81	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	2:3:1:	3:3:1:	3:	C[6]-2:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6])(C[6]C[6]H)(H){1|Se<4>,1|C<3>,1|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){2|C<3>}	H(C[6]C[6]2)	118.5540	0.000	1	119.0794	6.302	14	118.2405	7.767	31	117.9871	3.512	81	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	2:3:1:	3:3:1:	3:	C[6]-2:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6])(C[6]C[6]H)(H){1|Zr<13>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Zr<13>,2|C<4>}	H(C[6]C[6]2)	116.9070	0.000	1	119.0794	6.302	14	118.2405	7.767	31	117.9871	3.512	81	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	2:3:1:	3:3:1:	3:	C[6]-2:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6])(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H){1|C<3>,1|N<3>}	H(C[6]C[6]2)	117.3620	0.000	1	119.1845	3.383	4	118.2405	7.767	31	117.9871	3.512	81	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	2:3:1:	3:3:1:	3:	C[6]-2:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6])(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H){2|C<3>}	H(C[6]C[6]2)	118.5270	0.000	1	119.1845	3.383	4	118.2405	7.767	31	117.9871	3.512	81	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	2:3:1:	3:3:1:	3:	C[6]-2:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6])(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H){2|C<3>}	H(C[6]C[6]2)	121.7130	0.000	1	119.1845	3.383	4	118.2405	7.767	31	117.9871	3.512	81	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	2:3:1:	3:3:1:	3:	C[6]-2:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6])(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6])(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H){1|C<3>,1|N<3>}	H(C[6]C[6]2)	119.1360	0.000	1	119.1845	3.383	4	118.2405	7.767	31	117.9871	3.512	81	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	2:3:1:	3:3:1:	3:	C[6]-2:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){2|C<3>}	H(C[6]C[6]2)	117.3300	0.000	1	116.7207	4.151	4	118.2405	7.767	31	117.9871	3.512	81	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	2:3:1:	3:3:1:	3:	C[6]-2:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|N<3>}	H(C[6]C[6]2)	119.3410	0.000	1	116.7207	4.151	4	118.2405	7.767	31	117.9871	3.512	81	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	2:3:1:	3:3:1:	3:	C[6]-2:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){2|C<3>}	H(C[6]C[6]2)	115.1230	0.000	1	116.7207	4.151	4	118.2405	7.767	31	117.9871	3.512	81	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	2:3:1:	3:3:1:	3:	C[6]-2:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){2|C<3>}	H(C[6]C[6]2)	115.0890	0.000	1	116.7207	4.151	4	118.2405	7.767	31	117.9871	3.512	81	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	2:3:1:	3:3:1:	3:	C[6]-2:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a])(C[6]C[6]H)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6,6a]C)(C[6]C[6]H)(H){2|C<3>}	H(C[6]C[6]2)	117.8160	0.000	1	117.8160	0.000	1	118.2405	7.767	31	117.9871	3.512	81	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	2:3:1:	3:3:1:	3:	C[6]-2:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H){1|C<3>,1|N<2>}	H(C[6]C[6]2)	119.1070	0.000	1	118.2466	3.931	7	118.2405	7.767	31	117.9871	3.512	81	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	2:3:1:	3:3:1:	3:	C[6]-2:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H){2|C<3>}	H(C[6]C[6]2)	118.1032	2.132	6	118.2466	3.931	7	118.2405	7.767	31	117.9871	3.512	81	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	2:3:1:	3:3:1:	3:	C[6]-2:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a])(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a])(C[6]N[6]H)(H){1|Cu<5>,2|C<3>}	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(H){2|C<3>}	H(C[6]C[6]2)	118.8030	0.000	1	118.8030	0.000	1	117.2100	3.110	3	117.9871	3.512	81	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	2:3:1:	3:3:1:	3:	C[6]-2:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a])(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Re)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a])(C[6]N[6]H)(H){1|Re<6>,2|C<3>}	C[6](N[6]C[6,6a]Re)(C[6]C[6]H)(H){2|C<3>}	H(C[6]C[6]2)	115.3150	0.000	1	115.3150	0.000	1	117.2100	3.110	3	117.9871	3.512	81	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	2:3:1:	3:3:1:	3:	C[6]-2:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a])(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a])(C[6]N[6]H)(H){1|Ru<8>,2|C<3>}	C[6](N[6]C[6,6a]Ru)(C[6]C[6]H)(H){2|C<3>}	H(C[6]C[6]2)	117.5120	0.000	1	117.5120	0.000	1	117.2100	3.110	3	117.9871	3.512	81	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	2:3:1:	3:3:1:	3:	N[6]-2:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[5,6])(C[6]C[6]H)(H){1|Ru<10>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Ru<10>,2|C<4>}	H(C[6]C[6]N[6])	117.1527	0.064	4	117.1766	0.006	5	117.6069	0.296	22	117.9871	3.512	81	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	2:3:1:	3:3:1:	3:	N[6]-2:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[5,6])(C[6]C[6]H)(H){2|C<4>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]N[6])	117.2720	0.000	1	117.1766	0.006	5	117.6069	0.296	22	117.9871	3.512	81	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	2:3:1:	3:3:1:	3:	N[6]-2:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[5,6])(C[6]C[6]H)(H){1|Fe<10>,1|N<3>,2|C<4>}	C[6](C[6]C[5,6]N)(C[6]N[6]H)(H){1|Fe<10>,2|C<4>}	H(C[6]C[6]N[6])	117.0500	0.000	1	117.0500	0.000	1	117.6069	0.296	22	117.9871	3.512	81	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	2:3:1:	3:3:1:	3:	N[6]-2:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[5,6])(C[6]C[6]H)(H){1|N<3>,2|C<3>}	C[6](C[6]N[5,6]C[6])(C[6]N[6]H)(H){2|C<3>,2|N<3>}	H(C[6]C[6]N[6])	117.8130	0.000	1	117.8130	0.000	1	117.6069	0.296	22	117.9871	3.512	81	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	2:3:1:	3:3:1:	3:	N[6]-2:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[5,6])(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[6]N[5,6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	118.1190	0.000	1	117.8853	0.051	10	117.6069	0.296	22	117.9871	3.512	81	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	2:3:1:	3:3:1:	3:	N[6]-2:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[5,6])(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[6]N[5,6]H)(C[6]N[6]H)(H){1|C<3>,1|N<2>}	H(C[6]C[6]N[6])	117.8593	0.222	9	117.8853	0.051	10	117.6069	0.296	22	117.9871	3.512	81	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	2:3:1:	3:3:1:	3:	N[6]-2:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[5,6])(C[6]C[6]H)(H){3|N<3>}	C[6](C[6]N[5,6]N)(C[6]N[6]H)(H){1|C<3>,1|N<2>}	H(C[6]C[6]N[6])	117.1150	0.544	2	117.1150	0.296	2	117.6069	0.296	22	117.9871	3.512	81	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	2:3:1:	3:3:1:	3:	N[6]-2:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6])(C[6]C[6]H)(H){1|Mo<9>,1|H<1>,2|C<4>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Mo<9>,2|C<4>}	H(C[6]C[6]N[6])	117.1660	0.034	2	117.1660	0.001	2	117.6069	0.296	22	117.9871	3.512	81	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	2:3:1:	3:3:1:	3:	N[6]-2:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6])(C[6]C[6]H)(H)	C[6](C[6]N[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|N<4>}	C[6](C[6]N[6,6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	119.1910	0.000	1	119.1910	0.000	1	117.6069	0.296	22	117.9871	3.512	81	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	2:3:1:	3:3:1:	3:	N[6]-2:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[5,6])(C[6]N[6]H)(H)	C[6](N[6]C[5,6]Cu)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[5,6])(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|S<2>}	C[6](N[6]C[5,6]Cu)(C[6]N[6]H)(H){1|C<3>,1|S<2>}	H(C[6]C[6]N[6])	116.9300	0.000	1	116.9300	0.000	1	118.4107	0.615	19	117.9871	3.512	81	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	2:3:1:	3:3:1:	3:	N[6]-2:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6])(C[6]N[6]H)(H)	C[6](N[6]C[6,6]Cu)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6])(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|N<3>}	C[6](N[6]C[6,6]Cu)(C[6]N[6]H)(H){2|C<3>}	H(C[6]C[6]N[6])	119.4325	1.672	2	119.4325	2.797	2	118.4107	0.615	19	117.9871	3.512	81	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	2:3:1:	3:3:1:	3:	N[6]-2:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a])(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a])(C[6]N[6]H)(H){3|C<3>}	C[6](N[6]C[6,6a]C)(C[6]N[6]H)(H){2|C<3>}	H(C[6]C[6]N[6])	118.3340	0.000	1	118.3340	0.000	1	118.4107	0.615	19	117.9871	3.512	81	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	2:3:1:	3:3:1:	3:	N[6]-2:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a])(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]C[6a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a])(C[6]N[6]H)(H){3|C<3>}	C[6](N[6]C[6,6a]C[6a])(C[6]N[6]H)(H){4|C<3>}	H(C[6]C[6]N[6])	118.7067	0.112	3	118.7067	0.012	3	118.4107	0.615	19	117.9871	3.512	81	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	2:3:1:	3:3:1:	3:	N[6]-2:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a])(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Cu)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a])(C[6]N[6]H)(H){1|Cu<5>,2|C<3>}	C[6](N[6]C[6,6a]Cu)(C[6]N[6]H)(H){2|C<3>}	H(C[6]C[6]N[6])	119.0065	0.815	2	119.0065	0.665	2	118.4107	0.615	19	117.9871	3.512	81	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	2:3:1:	3:3:1:	3:	N[6]-2:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a])(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a])(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](N[6]C[6,6a]H)(C[6]N[6]H)(H){2|C<3>}	H(C[6]C[6]N[6])	118.5910	0.000	1	118.5910	0.000	1	118.4107	0.615	19	117.9871	3.512	81	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	2:3:1:	3:3:1:	3:	N[6]-2:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a])(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Ir)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a])(C[6]N[6]H)(H){1|Ir<6>,2|C<3>}	C[6](N[6]C[6,6a]Ir)(C[6]N[6]H)(H){2|C<3>}	H(C[6]C[6]N[6])	118.3025	0.179	2	118.3025	0.032	2	118.4107	0.615	19	117.9871	3.512	81	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	2:3:1:	3:3:1:	3:	N[6]-2:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a])(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Ni)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a])(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|N<2>}	C[6](N[6]C[6,6a]Ni)(C[6]N[6]H)(H){2|C<3>}	H(C[6]C[6]N[6])	117.8420	0.000	1	117.8420	0.000	1	118.4107	0.615	19	117.9871	3.512	81	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	2:3:1:	3:3:1:	3:	N[6]-2:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a])(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]O)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a])(C[6]N[6]H)(H){1|O<1>,2|C<3>}	C[6](N[6]C[6,6a]O)(C[6]N[6]H)(H){2|C<3>}	H(C[6]C[6]N[6])	118.0950	0.000	1	118.0950	0.000	1	118.4107	0.615	19	117.9871	3.512	81	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	2:3:1:	3:3:1:	3:	N[6]-2:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a])(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Os)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a])(C[6]N[6]H)(H){1|Os<4>,2|C<3>}	C[6](N[6]C[6,6a]Os)(C[6]N[6]H)(H){2|C<3>}	H(C[6]C[6]N[6])	118.3070	0.000	1	117.8777	0.360	3	118.4107	0.615	19	117.9871	3.512	81	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	2:3:1:	3:3:1:	3:	N[6]-2:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a])(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Os)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a])(C[6]N[6]H)(H){1|Os<5>,2|C<3>}	C[6](N[6]C[6,6a]Os)(C[6]N[6]H)(H){2|C<3>}	H(C[6]C[6]N[6])	118.1340	0.000	1	117.8777	0.360	3	118.4107	0.615	19	117.9871	3.512	81	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	2:3:1:	3:3:1:	3:	N[6]-2:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a])(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Os)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a])(C[6]N[6]H)(H){1|Os<6>,2|C<3>}	C[6](N[6]C[6,6a]Os)(C[6]N[6]H)(H){2|C<3>}	H(C[6]C[6]N[6])	117.1920	0.000	1	117.8777	0.360	3	118.4107	0.615	19	117.9871	3.512	81	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	2:3:1:	3:3:1:	3:	N[6]-2:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a])(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Pd)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a])(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|N<3>}	C[6](N[6]C[6,6a]Pd)(C[6]N[6]H)(H){2|C<3>}	H(C[6]C[6]N[6])	118.7350	0.000	1	118.7350	0.000	1	118.4107	0.615	19	117.9871	3.512	81	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	2:3:1:	3:3:1:	3:	N[6]-2:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a])(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Ru)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a])(C[6]N[6]H)(H){1|Ru<6>,2|C<3>}	C[6](N[6]C[6,6a]Ru)(C[6]N[6]H)(H){2|C<3>}	H(C[6]C[6]N[6])	118.0410	0.000	1	118.0410	0.000	1	118.4107	0.615	19	117.9871	3.512	81	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	2:3:1:	3:3:1:	3:	O[6]-2:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](O[6]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]C[6]O)(C[6]O[6]H)(H)	H(C[6]C[6]O[6])	C[6](O[6]C[5,6])(C[6]C[6]H)(H){1|C<4>,1|O<1>,2|C<3>}	C[6](C[6]C[6]O)(C[6]O[6]H)(H){1|C<4>,2|H<1>}	H(C[6]C[6]O[6])	116.6745	0.036	2	116.6745	0.001	2	116.6745	0.001	2	117.9871	3.512	81	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	2:3:1:	3:3:1:	3:	S[6]-2:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](S[6]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]S[6]H)(H)	H(C[6]C[6]S[6])	C[6](S[6]C[5,6])(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]S[6]H)(H){2|C<3>}	H(C[6]C[6]S[6])	116.1815	1.091	2	116.1815	1.190	2	116.1815	1.190	2	117.9871	3.512	81	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	2:3:1:	3:3:1:	3:	Se[6]-2:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](Se[6]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]Se[6]H)(H)	H(C[6]Se[6]C[6])	C[6](Se[6]C[5,6])(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]Se[6]H)(H){2|C<3>}	H(C[6]Se[6]C[6])	119.5800	0.000	1	119.5800	0.000	1	118.5000	2.333	2	117.9871	3.512	81	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	2:3:1:	3:3:1:	3:	Se[6]-2:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](Se[6]C[5a,6])(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)(C[6]Se[6]H)(H)	H(C[6]Se[6]C[6])	C[6](Se[6]C[5a,6])(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[5a,6]H)(C[6]Se[6]H)(H){2|C<3>}	H(C[6]Se[6]C[6])	117.4200	0.000	1	117.4200	0.000	1	118.5000	2.333	2	117.9871	3.512	81	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	2:3:1:	3:3:2:	3:	N[6]-2:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](N[6]C[6,6a])(C[6]C[6]C)(H)	C[6](C[6]C[6,6a]O)(C[6]N[6]H)(CN)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a])(C[6]C[6]C)(H){1|C<3>,1|N<3>,1|O<1>}	C[6](C[6]C[6,6a]O)(C[6]N[6]H)(CN){2|C<3>}	H(C[6]C[6]N[6])	117.6430	0.000	1	117.6430	0.000	1	117.6430	0.000	1	117.6430	0.000	1	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	2:3:1:	3:3:3:	3:	C[6]-2:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[5,6])(C[6]C[6]C)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(CHH)	H(C[6]C[6]2)	C[6](C[6]C[5,6])(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(CHH){1|C<3>,1|P<4>}	H(C[6]C[6]2)	118.1560	0.000	1	118.1560	0.000	1	118.1560	0.000	1	118.1079	0.382	9	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	2:3:1:	3:3:3:	3:	C[6]-2:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6,6])(C[6]C[6]N)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6,6])(C[6]C[6]N)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(NCC){1|C<3>,1|O<2>}	H(C[6]C[6]2)	118.7760	0.000	1	118.7760	0.000	1	118.7760	0.000	1	118.1079	0.382	9	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	2:3:1:	3:3:3:	3:	N[6]-2:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6,6a])(C[6]C[6]C)(H)	C[6](C[6]N[6,6a]N)(C[6]N[6]H)(CCO)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a])(C[6]C[6]C)(H){1|C<3>,1|N<2>,1|N<3>}	C[6](C[6]N[6,6a]N)(C[6]N[6]H)(CCO){2|C<3>}	H(C[6]C[6]N[6])	116.6250	0.000	1	116.6250	0.000	1	116.6250	0.000	1	118.1079	0.382	9	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	2:3:1:	3:3:3:	3:	N[6]-2:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6,6a])(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]H)(C[6]N[6]H)(CHN)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a])(C[6]N[6]C)(H){1|H<1>,2|C<3>}	C[6](N[6]C[6,6a]H)(C[6]N[6]H)(CHN){2|C<3>}	H(C[6]C[6]N[6])	118.1955	0.476	2	118.1955	0.226	2	118.2357	0.062	6	118.1079	0.382	9	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	2:3:1:	3:3:3:	3:	N[6]-2:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6,6a])(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Ni)(C[6]N[6]H)(CHN)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a])(C[6]N[6]C)(H){1|Ni<6>,2|C<3>}	C[6](N[6]C[6,6a]Ni)(C[6]N[6]H)(CHN){2|C<3>}	H(C[6]C[6]N[6])	118.2730	0.082	2	118.2730	0.007	2	118.2357	0.062	6	118.1079	0.382	9	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	2:3:1:	3:3:3:	3:	N[6]-2:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6,6a])(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Pt)(C[6]N[6]H)(CNO)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a])(C[6]N[6]C)(H){1|Pt<4>,2|C<3>}	C[6](N[6]C[6,6a]Pt)(C[6]N[6]H)(CNO){2|C<3>}	H(C[6]C[6]N[6])	118.0490	0.000	1	118.0490	0.000	1	118.2357	0.062	6	118.1079	0.382	9	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	2:3:1:	3:3:3:	3:	N[6]-2:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6,6a])(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Re)(C[6]N[6]H)(COO)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a])(C[6]N[6]C)(H){1|Re<6>,2|C<3>}	C[6](N[6]C[6,6a]Re)(C[6]N[6]H)(COO){2|C<3>}	H(C[6]C[6]N[6])	118.4280	0.000	1	118.4280	0.000	1	118.2357	0.062	6	118.1079	0.382	9	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	2:3:1:	3:3:4:	3:	C[6]-2:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a])(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Cd)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6,6a])(C[6]N[6]C)(H){1|Cd<6>,2|C<3>}	C[6](N[6]C[6,6a]Cd)(C[6]C[6]H)(CHHN){2|C<3>}	H(C[6]C[6]2)	118.1770	0.000	1	118.1770	0.000	1	118.1770	0.000	1	115.7210	12.064	2	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	2:3:1:	3:3:4:	3:	P[6]-2:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](P[6]C[5,6])(C[6]C[6]C)(H)	C[6](C[6]C[5,6]C)(C[6]P[6]H)(CH3)	H(C[6]C[6]P[6])	C[6](P[6]C[5,6])(C[6]C[6]C)(H){1|C<4>,2|C<3>}	C[6](C[6]C[5,6]C)(C[6]P[6]H)(CH3){1|C<3>,1|P<4>}	H(C[6]C[6]P[6])	113.2650	0.000	1	113.2650	0.000	1	113.2650	0.000	1	115.7210	12.064	2	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	2:3:1:	4:3:1:	3:	O[6]-2:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](O[6]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]C[5]H)(C[6]O[6]H)(H)	H(C[6]C[6]O[6])	C[6](O[6]C[5,6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,2|C<3>}	C[6](C[6]C[5,6]C[5]H)(C[6]O[6]H)(H){1|C<2>,1|S<2>,2|C<3>}	H(C[6]C[6]O[6])	123.3120	0.000	1	123.3120	0.000	1	119.9391	12.006	8	119.8344	10.604	9	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	2:3:1:	4:3:1:	3:	O[6]-2:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](O[6]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]HH)(C[6]O[6]H)(H)	H(C[6]C[6]O[6])	C[6](O[6]C[5,6])(C[6]C[6]H)(H){2|C<4>,3|H<1>}	C[6](C[6]C[5,6]HH)(C[6]O[6]H)(H){1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[6]O[6])	117.0170	0.000	1	117.0170	0.000	1	119.9391	12.006	8	119.8344	10.604	9	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	2:3:1:	4:3:1:	3:	O[6]-2:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](O[6]C[5a,6])(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]C[6a]H)(C[6]O[6]H)(H)	H(C[6]C[6]O[6])	C[6](O[6]C[5a,6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[5a,6]C[6a]H)(C[6]O[6]H)(H){4|C<3>}	H(C[6]C[6]O[6])	117.2180	0.000	1	117.2180	0.000	1	119.9391	12.006	8	119.8344	10.604	9	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	2:3:1:	4:3:1:	3:	O[6]-2:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](O[6]C[6,6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]HO)(C[6]O[6]H)(H)	H(C[6]C[6]O[6])	C[6](O[6]C[6,6])(C[6]C[6]H)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[6]C[6,6]HO)(C[6]O[6]H)(H){1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[6]O[6])	117.2200	0.000	1	117.2200	0.000	1	119.9391	12.006	8	119.8344	10.604	9	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	2:3:1:	4:3:1:	3:	O[6]-2:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](O[6]C[6,6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]C[6a]H)(C[6]O[6]H)(H)	H(C[6]C[6]O[6])	C[6](O[6]C[6,6a])(C[6]C[6]H)(H){1|H<1>,3|C<3>}	C[6](C[6]C[6,6a]C[6a]H)(C[6]O[6]H)(H){4|C<3>}	H(C[6]C[6]O[6])	121.1865	3.790	4	121.1865	14.368	4	119.9391	12.006	8	119.8344	10.604	9	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	2:3:1:	4:3:1:	3:	S[6]-2:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](S[6]C[5a,6])(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]CC)(C[6]S[6]H)(H)	H(C[6]C[6]S[6])	C[6](S[6]C[5a,6])(C[6]C[6]H)(H){1|C<4>,1|N<3>,2|C<3>}	C[6](C[6]C[5a,6]CC)(C[6]S[6]H)(H){2|C<3>}	H(C[6]C[6]S[6])	118.9970	0.000	1	118.9970	0.000	1	118.9970	0.000	1	119.8344	10.604	9	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	2:3:1:	4:3:2:	3:	O[6]-2:C[6]-3:H-1:	C[6]-4:C[6]-3:O-2:	C[6]-3:	C[6](O[6]C[6,6a])(C[6]C[6]O)(H)	C[6](C[6]C[6,6a]CC)(C[6]O[6]H)(OC)	H(C[6]C[6]O[6])	C[6](O[6]C[6,6a])(C[6]C[6]O)(H){2|C<3>,2|C<4>}	C[6](C[6]C[6,6a]CC)(C[6]O[6]H)(OC){2|C<3>}	H(C[6]C[6]O[6])	118.1150	0.000	1	118.1150	0.000	1	118.1150	0.000	1	118.1150	0.000	1	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	2:3:1:	4:3:3:	3:	O[6]-2:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](O[6]C[6,6a])(C[6]C[6]C)(H)	C[6](C[6]C[6,6a]CH)(C[6]O[6]H)(CCO)	H(C[6]C[6]O[6])	C[6](O[6]C[6,6a])(C[6]C[6]C)(H){1|C<4>,1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]CH)(C[6]O[6]H)(CCO){2|C<3>}	H(C[6]C[6]O[6])	118.2030	0.000	1	118.2030	0.000	1	117.5000	0.229	4	117.5312	0.177	5	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	2:3:1:	4:3:3:	3:	O[6]-2:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](O[6]C[6,6a])(C[6]C[6]C)(H)	C[6](C[6]C[6,6a]CH)(C[6]O[6]H)(CC[6a]O)	H(C[6]C[6]O[6])	C[6](O[6]C[6,6a])(C[6]C[6]C)(H){1|C<4>,1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]CH)(C[6]O[6]H)(CC[6a]O){2|C<3>}	H(C[6]C[6]O[6])	117.2460	0.000	1	117.2460	0.000	1	117.5000	0.229	4	117.5312	0.177	5	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	2:3:1:	4:3:3:	3:	O[6]-2:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](O[6]C[6,6a])(C[6]C[6]C)(H)	C[6](C[6]C[6,6a]CH)(C[6]O[6]H)(COO)	H(C[6]C[6]O[6])	C[6](O[6]C[6,6a])(C[6]C[6]C)(H){1|C<4>,1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]CH)(C[6]O[6]H)(COO){2|C<3>}	H(C[6]C[6]O[6])	117.3950	0.000	1	117.3950	0.000	1	117.5000	0.229	4	117.5312	0.177	5	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	2:3:1:	4:3:3:	3:	O[6]-2:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](O[6]C[6,6a])(C[6]C[6]C)(H)	C[6](C[6]C[6,6a]C[6a]H)(C[6]O[6]H)(CC[6a]O)	H(C[6]C[6]O[6])	C[6](O[6]C[6,6a])(C[6]C[6]C)(H){1|H<1>,3|C<3>}	C[6](C[6]C[6,6a]C[6a]H)(C[6]O[6]H)(CC[6a]O){4|C<3>}	H(C[6]C[6]O[6])	117.1560	0.000	1	117.1560	0.000	1	117.5000	0.229	4	117.5312	0.177	5	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	2:3:1:	4:3:3:	3:	O[6]-2:C[6]-3:H-1:	C[6]-4:C[6]-3:N-3:	C[6]-3:	C[6](O[6]C[6,6])(C[6]C[6]N)(H)	C[6](C[6]C[6,6]C[5a]H)(C[6]O[6]H)(NOO)	H(C[6]C[6]O[6])	C[6](O[6]C[6,6])(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|N<3>,2|C<4>}	C[6](C[6]C[6,6]C[5a]H)(C[6]O[6]H)(NOO){1|C<3>,1|C<4>,1|H<1>,2|O<2>}	H(C[6]C[6]O[6])	117.6560	0.000	1	117.6560	0.000	1	117.6560	0.000	1	117.5312	0.177	5	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	2:3:1:	4:3:4:	3:	N[6]-2:C[6]-3:H-1:	S[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[5,6])(C[6]S[6]C)(H)	C[6](S[6]N[5,6]OO)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[5,6])(C[6]S[6]C)(H){1|N<3>,1|S<2>,2|O<1>}	C[6](S[6]N[5,6]OO)(C[6]N[6]H)(CH3){1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	113.6890	0.000	1	113.6890	0.000	1	113.6890	0.000	1	113.6890	0.000	1	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	2:3:2:	3:	C[6]-3:N[6]-2:H-1:	O[6]-2:C[6]-3:O-2:	C[6]-3:	C[6](C[6]O[6]O)(N[6]N[6])(H)	C[6](O[6]B[5,6])(C[6]N[6]H)(OC)	H(C[6]C[6]N[6])	C[6](C[6]O[6]O)(N[6]N[6])(H){1|B<4>,1|P<3>}	C[6](O[6]B[5,6])(C[6]N[6]H)(OC){1|N<3>,2|O<2>}	H(C[6]C[6]N[6])	118.9190	0.014	2	118.9190	0.000	2	118.9190	0.000	2	118.9190	0.000	2	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:2:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|C<4>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	123.3440	0.000	1	120.4667	29.299	32	120.5797	25.550	38	119.8878	20.544	62	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:2:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|C<4>}	H(C[6]C[6]2)	115.1880	0.000	1	120.4667	29.299	32	120.5797	25.550	38	119.8878	20.544	62	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:2:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	116.7529	5.310	10	120.4667	29.299	32	120.5797	25.550	38	119.8878	20.544	62	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:2:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|N<2>}	H(C[6]C[6]2)	116.9860	0.000	1	120.4667	29.299	32	120.5797	25.550	38	119.8878	20.544	62	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:2:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|P<4>}	H(C[6]C[6]2)	121.4475	4.166	2	120.4667	29.299	32	120.5797	25.550	38	119.8878	20.544	62	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:2:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|Sn<5>,1|C<3>}	H(C[6]C[6]2)	122.4410	0.000	1	120.4667	29.299	32	120.5797	25.550	38	119.8878	20.544	62	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:2:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6])(H){2|C<3>}	H(C[6]C[6]2)	126.0440	0.000	1	120.4667	29.299	32	120.5797	25.550	38	119.8878	20.544	62	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:2:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|N<2>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	125.7690	0.000	1	120.4667	29.299	32	120.5797	25.550	38	119.8878	20.544	62	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:2:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6])(H){2|C<3>}	H(C[6]C[6]2)	109.8600	0.000	1	120.4667	29.299	32	120.5797	25.550	38	119.8878	20.544	62	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:2:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|P<4>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.5720	2.021	2	120.4667	29.299	32	120.5797	25.550	38	119.8878	20.544	62	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:2:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|Cu<5>,1|C<3>,1|C<4>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|Cu<5>,1|C<4>}	H(C[6]C[6]2)	125.8120	0.000	2	120.4667	29.299	32	120.5797	25.550	38	119.8878	20.544	62	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:2:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|Cu<5>,1|C<4>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|Cu<5>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	120.1130	0.000	2	120.4667	29.299	32	120.5797	25.550	38	119.8878	20.544	62	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:2:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|Sn<5>,1|C<3>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5480	0.000	1	120.4667	29.299	32	120.5797	25.550	38	119.8878	20.544	62	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:2:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|Te<5>,1|C<3>}	C[6](C[6]C[6]H)(C[6]C[6])(H){2|C<3>}	H(C[6]C[6]2)	119.5260	0.000	1	120.4667	29.299	32	120.5797	25.550	38	119.8878	20.544	62	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:2:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){2|C<3>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	128.1490	0.000	1	120.4667	29.299	32	120.5797	25.550	38	119.8878	20.544	62	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:2:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){2|C<3>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|O<1>}	H(C[6]C[6]2)	122.1240	0.000	1	120.4667	29.299	32	120.5797	25.550	38	119.8878	20.544	62	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:2:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){2|C<3>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|Te<5>,1|C<3>}	H(C[6]C[6]2)	129.6450	0.000	1	120.4667	29.299	32	120.5797	25.550	38	119.8878	20.544	62	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:2:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){2|C<3>}	C[6](C[6]C[6]H)(C[6]C[6])(H){2|C<3>}	H(C[6]C[6]2)	124.9455	4.745	2	120.4667	29.299	32	120.5797	25.550	38	119.8878	20.544	62	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:2:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]N[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6])(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	117.4450	0.000	1	119.5600	3.698	3	120.5797	25.550	38	119.8878	20.544	62	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:2:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]N[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6])(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0320	0.000	1	119.5600	3.698	3	120.5797	25.550	38	119.8878	20.544	62	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:2:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]N[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6])(H){1|C<2>,1|H<1>}	H(C[6]C[6]2)	121.2030	0.000	1	119.5600	3.698	3	120.5797	25.550	38	119.8878	20.544	62	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:2:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6])(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6])(H){1|C<2>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|N<3>}	H(C[6]C[6]2)	124.2870	0.000	1	122.8047	5.658	3	120.5797	25.550	38	119.8878	20.544	62	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:2:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6])(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6])(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|N<3>}	H(C[6]C[6]2)	124.0660	0.000	1	122.8047	5.658	3	120.5797	25.550	38	119.8878	20.544	62	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:2:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6])(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6])(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0610	0.000	1	122.8047	5.658	3	120.5797	25.550	38	119.8878	20.544	62	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:2:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-2:O-1:	C[6]-3:	C[6](C[6]C[6]O)(C[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]C[6])(O)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]C[6])(H){1|C<3>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6])(O){1|C<3>,1|H<1>}	H(C[6]C[6]2)	114.5330	0.000	2	114.5330	0.000	2	114.5330	0.000	2	119.8878	20.544	62	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:2:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]N[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)(C[6]C[6])(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|C<4>}	H(C[6]C[6]2)	119.4227	1.497	3	119.8893	21.606	8	119.8893	21.606	8	119.8878	20.544	62	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:2:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]N[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)(C[6]C[6])(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5145	0.176	2	119.8893	21.606	8	119.8893	21.606	8	119.8878	20.544	62	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:2:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]N[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)(C[6]C[6])(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6])(H){2|C<3>}	H(C[6]C[6]2)	111.4740	0.000	1	119.8893	21.606	8	119.8893	21.606	8	119.8878	20.544	62	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:2:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]N[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)(C[6]C[6])(H){1|C<3>,1|S<2>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|S<2>}	H(C[6]C[6]2)	128.5190	0.000	1	119.8893	21.606	8	119.8893	21.606	8	119.8878	20.544	62	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:2:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]N[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)(C[6]C[6])(H){2|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8240	0.000	1	119.8893	21.606	8	119.8893	21.606	8	119.8878	20.544	62	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:2:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)(C[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|C<4>}	C[6](C[6]N[6]H)(C[6]C[6])(H){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.2507	1.457	3	117.9111	3.309	8	117.9111	3.309	8	119.8878	20.544	62	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:2:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)(C[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(C[6]C[6])(H){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.8900	0.291	2	117.9111	3.309	8	117.9111	3.309	8	119.8878	20.544	62	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:2:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)(C[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(C[6]C[6])(H){2|C<3>}	H(C[6]C[6]N[6])	118.4950	0.000	1	117.9111	3.309	8	117.9111	3.309	8	119.8878	20.544	62	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:2:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)(C[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|S<2>}	C[6](C[6]N[6]H)(C[6]C[6])(H){1|C<3>,1|S<2>}	H(C[6]C[6]N[6])	114.4670	0.000	1	117.9111	3.309	8	117.9111	3.309	8	119.8878	20.544	62	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:2:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)(C[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){2|C<3>}	C[6](C[6]N[6]H)(C[6]C[6])(H){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	116.7950	0.000	1	117.9111	3.309	8	117.9111	3.309	8	119.8878	20.544	62	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:2:1:	3:	C[6]-3:O[6]-2:H-1:	C[6]-3:O[6]-2:H-1:	C[6]-3:	C[6](C[6]O[6]H)(O[6]C[6])(H)	C[6](C[6]O[6]H)(O[6]C[6])(H)	H(C[6]C[6]O[6])	C[6](C[6]O[6]H)(O[6]C[6])(H){1|C<3>,1|H<1>}	C[6](C[6]O[6]H)(O[6]C[6])(H){1|C<3>,1|H<1>}	H(C[6]C[6]O[6])	120.0478	2.940	4	120.0478	8.641	4	120.0478	8.641	4	119.8878	20.544	62	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:2:1:	3:	C[6]-3:S[6]-2:H-1:	C[6]-3:S[6]-2:H-1:	C[6]-3:	C[6](C[6]S[6]H)(S[6]C[6])(H)	C[6](C[6]S[6]H)(S[6]S[6])(H)	H(C[6]C[6]S[6])	C[6](C[6]S[6]H)(S[6]C[6])(H){1|C<4>,1|H<1>,1|S<2>}	C[6](C[6]S[6]H)(S[6]S[6])(H){1|C<4>}	H(C[6]C[6]S[6])	119.1650	0.000	1	119.1650	0.000	1	119.6795	0.529	2	119.8878	20.544	62	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:2:1:	3:	C[6]-3:S[6]-2:H-1:	C[6]-3:S[6]-2:H-1:	C[6]-3:	C[6](C[6]S[6]H)(S[6]S[6])(H)	C[6](C[6]S[6]H)(S[6]C[6])(H)	H(C[6]C[6]S[6])	C[6](C[6]S[6]H)(S[6]S[6])(H){1|C<4>}	C[6](C[6]S[6]H)(S[6]C[6])(H){1|C<4>,1|H<1>,1|S<2>}	H(C[6]C[6]S[6])	120.1940	0.000	1	120.1940	0.000	1	119.6795	0.529	2	119.8878	20.544	62	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:2:2:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-2:N-2:	C[6]-3:	C[6](C[6]C[6]N)(C[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]C[6])(NP[5])	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]C[6])(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6])(NP[5]){1|C<3>,1|H<1>}	H(C[6]C[6]2)	118.1700	0.000	1	118.1700	0.000	1	118.1700	0.000	1	118.1700	0.000	1	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:2:3:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-2:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]C[6])(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6])(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6])(CCN){1|C<3>,1|H<1>}	H(C[6]C[6]2)	102.9380	0.000	1	102.9380	0.000	1	102.9380	0.000	1	117.1512	72.265	5	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:2:3:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-2:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6])(H)	C[6](C[6]C[6]H)(C[6]C[6])(NCO)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6])(H){1|Ni<6>,1|C<3>}	C[6](C[6]C[6]H)(C[6]C[6])(NCO){1|C<4>,1|N<3>}	H(C[6]C[6]2)	125.0640	0.000	1	125.0640	0.000	1	125.0640	0.000	1	117.1512	72.265	5	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:2:3:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-2:Se-3:	C[6]-3:	C[6](C[6]C[6]Se)(C[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]C[6])(SeRe2)	H(C[6]C[6]2)	C[6](C[6]C[6]Se)(C[6]C[6])(H){1|C<2>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6])(SeRe2){1|C<3>}	H(C[6]C[6]2)	121.9720	0.000	1	121.9720	0.000	1	121.9720	0.000	1	117.1512	72.265	5	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:2:3:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-2:C-3:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6])(H)	C[6](C[6]N[6]H)(C[6]C[6])(CNO)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6])(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(C[6]C[6])(CNO){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.6690	0.000	1	117.6690	0.000	1	117.6690	0.000	1	117.1512	72.265	5	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:2:3:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:O[6]-2:N-3:	C[6]-3:	C[6](C[6]O[6]N)(N[6]O[6])(H)	C[6](C[6]N[6]H)(O[6]B[6])(NCC)	H(C[6]C[6]N[6])	C[6](C[6]O[6]N)(N[6]O[6])(H){1|B<4>}	C[6](C[6]N[6]H)(O[6]B[6])(NCC){1|O<2>,2|F<1>}	H(C[6]C[6]N[6])	118.1130	0.000	1	118.1130	0.000	1	118.1130	0.000	1	117.1512	72.265	5	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:2:4:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-2:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]C[6])(CCHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6])(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6])(CCHN){1|C<3>,1|H<1>}	H(C[6]C[6]2)	116.7120	0.000	1	116.7120	0.000	1	116.9977	2.142	3	118.3139	4.357	7	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:2:4:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-2:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]C[6])(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6])(H){1|C<2>,1|S<2>}	C[6](C[6]C[6]H)(C[6]C[6])(CH3){1|C<3>}	H(C[6]C[6]2)	118.5830	0.000	1	118.5830	0.000	1	116.9977	2.142	3	118.3139	4.357	7	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:2:4:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-2:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]C[6])(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6])(H){1|C<2>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6])(CHHP){1|C<3>}	H(C[6]C[6]2)	115.6980	0.000	1	115.6980	0.000	1	116.9977	2.142	3	118.3139	4.357	7	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:2:4:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-2:N-4:	C[6]-3:	C[6](C[6]C[6]N)(C[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]C[6])(NH3)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]C[6])(H){1|C<3>,1|N<4>}	C[6](C[6]C[6]H)(C[6]C[6])(NH3){1|C<3>,1|H<1>}	H(C[6]C[6]2)	122.1470	0.000	1	122.1470	0.000	1	122.1470	0.000	1	118.3139	4.357	7	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:2:4:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:N[6]-2:C-4:	C[6]-3:	C[6](C[6]N[6]C)(C[6]C[6])(H)	C[6](C[6]C[6]H)(N[6]C[6])(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)(C[6]C[6])(H){1|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(CH3){2|C<2>}	H(C[6]C[6]2)	119.4950	0.000	1	119.4950	0.000	1	118.3523	0.981	3	118.3139	4.357	7	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:2:4:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:N[6]-2:C-4:	C[6]-3:	C[6](C[6]N[6]C)(C[6]C[6])(H)	C[6](C[6]C[6]H)(N[6]C[6])(CHHN)	H(C[6]C[6]2)	C[6](C[6]N[6]C)(C[6]C[6])(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6])(CHHN){1|C<3>,1|H<1>}	H(C[6]C[6]2)	117.7810	0.061	2	117.7810	0.004	2	118.3523	0.981	3	118.3139	4.357	7	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6,6a])(H)	C[6](C[5,6]C[5,6,6a]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6,6a])(H){1|C<4>,2|C<3>}	C[6](C[5,6]C[5,6,6a]C[5])(C[6]C[6]H)(H){1|C<4>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.1690	0.000	1	119.1690	0.000	1	119.6242	5.394	6	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6])(H)	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6])(H){1|H<1>,2|C<3>}	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	116.2740	0.000	1	116.2740	0.000	1	119.6242	5.394	6	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6])(H)	C[6](C[5,6]C[5,6]N[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6])(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[5,6]C[5,6]N[5])(C[6]C[6]H)(H){1|N<2>,2|C<3>}	H(C[6]C[6]2)	118.1860	0.000	1	120.2500	5.324	3	119.6242	5.394	6	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6])(H)	C[6](C[5,6]C[5,6]N[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[5,6]C[5,6]N[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	121.2820	2.063	2	120.2500	5.324	3	119.6242	5.394	6	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6])(H)	C[6](C[5,6]C[5,6]S[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6])(H){1|C<3>,1|H<1>,1|S<2>}	C[6](C[5,6]C[5,6]S[5])(C[6]C[6]H)(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	121.5520	0.000	1	121.5520	0.000	1	119.6242	5.394	6	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(C[6]C[6,6])(H)	C[6](C[5a,6]C[5a,6,6]C[5a,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)(C[6]C[6,6])(H){3|C<3>}	C[6](C[5a,6]C[5a,6,6]C[5a,6a])(C[6]C[6]H)(H){1|N<3>,3|C<3>}	H(C[6]C[6]2)	118.9060	0.000	1	118.9060	0.000	1	119.2632	4.238	5	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(C[6]C[6])(H)	C[6](C[5a,6]C[5a,6]2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)(C[6]C[6])(H){1|H<1>,2|C<3>}	C[6](C[5a,6]C[5a,6]2)(C[6]C[6]H)(H){1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	118.4810	0.000	1	118.4810	0.000	1	119.2632	4.238	5	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(C[6]C[6])(H)	C[6](C[5a,6]C[5a,6]N[5a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)(C[6]C[6])(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[5a,6]C[5a,6]N[5a])(C[6]C[6]H)(H){1|O<2>,2|C<3>}	H(C[6]C[6]2)	120.3380	0.000	1	119.6430	7.889	3	119.2632	4.238	5	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(C[6]C[6])(H)	C[6](C[5a,6]C[5a,6]N[5a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)(C[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[5a,6]C[5a,6]N[5a])(C[6]C[6]H)(H){1|C<2>,3|C<3>}	H(C[6]C[6]2)	122.0390	0.000	1	119.6430	7.889	3	119.2632	4.238	5	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(C[6]C[6])(H)	C[6](C[5a,6]C[5a,6]N[5a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)(C[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[5a,6]C[5a,6]N[5a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,2|C<3>}	H(C[6]C[6]2)	116.5520	0.000	1	119.6430	7.889	3	119.2632	4.238	5	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6])(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6])(H){1|C<2>,1|C<3>,1|H<1>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){3|C<3>}	H(C[6]C[6]2)	120.4450	0.000	1	124.8345	38.535	2	123.2038	14.786	6	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6])(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6])(H){1|N<3>,2|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	129.2240	0.000	1	124.8345	38.535	2	123.2038	14.786	6	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6])(H)	C[6](C[6,6]C[6,6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6,6]C[6,6]N[6])(C[6]C[6]H)(H){2|C<3>,2|C<4>}	H(C[6]C[6]2)	119.3910	0.000	1	119.3910	0.000	1	123.2038	14.786	6	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6])(H)	C[6](C[6,6]C[6,6a]C[6,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6])(H){1|H<1>,2|C<3>}	C[6](C[6,6]C[6,6a]C[6,6])(C[6]C[6]H)(H){1|C<4>,3|C<3>}	H(C[6]C[6]2)	120.1920	0.000	1	120.1920	0.000	1	123.2038	14.786	6	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6])(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6])(H){1|Cd<6>,1|C<2>,1|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|N<3>}	H(C[6]C[6]2)	124.9855	0.346	2	124.9855	0.120	2	123.2038	14.786	6	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6,6])(H)	C[6](C[6,6a]C[6,6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6,6])(H){1|P<4>,2|C<3>}	C[6](C[6,6a]C[6,6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.9910	0.000	1	119.9910	0.000	1	120.9352	9.956	9	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6])(H)	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6])(H){1|H<1>,2|C<3>}	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H){1|S<2>,3|C<3>}	H(C[6]C[6]2)	117.0850	0.000	1	117.0850	0.000	1	120.9352	9.956	9	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6])(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6])(H){1|H<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,3|C<3>}	H(C[6]C[6]2)	122.9220	0.000	1	121.9737	19.134	3	120.9352	9.956	9	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6])(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6])(H){1|P<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,3|C<3>}	H(C[6]C[6]2)	125.7960	0.000	1	121.9737	19.134	3	120.9352	9.956	9	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6])(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6])(H){2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|C<4>,1|N<2>}	H(C[6]C[6]2)	117.2030	0.000	1	121.9737	19.134	3	120.9352	9.956	9	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6])(H)	C[6](C[6,6a]C[6,6a]N[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6])(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6,6a]C[6,6a]N[6a])(C[6]C[6]H)(H){3|C<3>}	H(C[6]C[6]2)	119.3000	0.000	1	119.3000	0.000	1	120.9352	9.956	9	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6])(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6])(H){1|Cu<5>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	121.3970	3.690	2	122.0400	8.047	3	120.9352	9.956	9	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6])(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6])(H){1|Pt<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	123.3260	0.000	1	122.0400	8.047	3	120.9352	9.956	9	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(Br)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6])(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(Br){1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0690	0.000	1	120.0690	0.000	1	120.0690	0.000	1	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6])(H){1|C<2>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(Cl){1|C<3>,1|H<1>}	H(C[6]C[6]2)	116.3320	0.000	1	120.0257	13.016	3	120.0257	13.016	3	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6])(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(Cl){1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2040	0.000	1	120.0257	13.016	3	120.0257	13.016	3	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6])(H){1|C<3>,1|H<1>,1|P<4>}	C[6](C[6]C[6]H)2(Cl){1|C<3>,1|H<1>}	H(C[6]C[6]2)	123.5410	0.000	1	120.0257	13.016	3	120.0257	13.016	3	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[3,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[3,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,3|C<4>}	H(C[6]C[6]2)	119.3750	0.252	2	119.3750	0.063	2	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|H<1>,2|C<3>}	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.5060	0.042	2	120.5060	0.002	2	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Zn<6>,1|C<2>,1|C<3>,1|N<3>}	H(C[6]C[6]2)	120.4170	0.000	1	120.4170	0.000	1	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|H<1>,2|C<3>}	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.4795	3.152	2	118.9377	5.847	3	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){2|C<3>}	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H){1|C<2>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	117.8540	0.000	1	118.9377	5.847	3	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]2)(C[6]C[6]H)(H){1|C<2>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	113.4295	13.318	2	116.8120	74.985	4	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]2)(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.1945	1.346	2	116.8120	74.985	4	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]As)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|As<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]As)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	117.6380	4.327	2	117.6380	18.727	2	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]Br)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|Br<1>,1|C<3>,1|H<1>}	C[6](C[6]C[6]Br)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0240	0.544	2	120.0240	0.296	2	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.0907	3.953	37	119.3984	16.072	61	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|S<2>}	H(C[6]C[6]2)	118.0860	0.000	1	119.3984	16.072	61	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|C<5>,1|H<1>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	118.3150	1.216	2	119.3984	16.072	61	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|C<5>,1|H<1>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){2|C<3>}	H(C[6]C[6]2)	126.2850	0.000	1	119.3984	16.072	61	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,2|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|N<3>}	H(C[6]C[6]2)	117.9885	1.241	2	119.3984	16.072	61	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,2|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|O<2>}	H(C[6]C[6]2)	120.3350	0.000	1	119.3984	16.072	61	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,2|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){2|C<3>}	H(C[6]C[6]2)	128.5870	0.000	1	119.3984	16.072	61	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|C<4>}	H(C[6]C[6]2)	119.8310	0.000	1	119.3984	16.072	61	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0999	3.461	14	119.3984	16.072	61	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|N<3>}	H(C[6]C[6]2)	109.8160	0.000	1	119.3984	16.072	61	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|Cl<1>,1|C<3>,1|H<1>}	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|C<3>,1|N<3>}	H(C[6]C[6]2)	122.3110	0.000	1	122.3110	0.000	1	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]F)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,2|F<1>}	C[6](C[6]C[6]F)(C[6]C[6]H)(H){1|C<3>,1|C<4>}	H(C[6]C[6]2)	118.1090	0.000	1	118.1090	0.000	1	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]Ge)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|Ge<4>,1|C<2>,1|H<1>}	C[6](C[6]C[6]Ge)(C[6]C[6]H)(H){1|C<3>}	H(C[6]C[6]2)	118.1940	0.000	1	118.1940	0.000	1	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|Pd<4>,1|C<3>}	H(C[6]C[6]2)	119.5830	0.000	1	116.6740	28.331	20	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|C<4>}	H(C[6]C[6]2)	117.1200	0.000	1	116.6740	28.331	20	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	116.3317	5.112	12	116.6740	28.331	20	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|N<3>}	H(C[6]C[6]2)	111.9225	10.624	2	116.6740	28.331	20	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){2|C<3>}	H(C[6]C[6]2)	117.1835	5.864	2	116.6740	28.331	20	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|N<4>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.6870	0.000	1	116.6740	28.331	20	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,2|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	122.8970	0.000	1	116.6740	28.331	20	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.1725	0.267	2	118.7530	29.206	8	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|N<4>}	H(C[6]C[6]2)	116.2290	0.000	1	118.7530	29.206	8	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){2|C<3>}	H(C[6]C[6]2)	120.8407	7.396	3	118.7530	29.206	8	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){2|C<2>}	H(C[6]C[6]2)	110.7760	0.000	1	118.7530	29.206	8	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,2|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){2|C<3>}	H(C[6]C[6]2)	122.1520	0.000	1	118.7530	29.206	8	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<2>,1|H<1>,1|P<4>}	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<3>}	H(C[6]C[6]2)	120.2375	3.142	2	119.0426	13.615	36	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<2>,1|P<3>}	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<2>}	H(C[6]C[6]2)	118.8700	0.000	1	119.0426	13.615	36	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|H<1>,1|P<3>}	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	118.6890	1.625	2	119.0426	13.615	36	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|H<1>,1|P<4>}	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	118.9878	4.028	28	119.0426	13.615	36	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|H<1>,1|P<4>}	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<3>,1|O<2>}	H(C[6]C[6]2)	122.1510	0.000	1	119.0426	13.615	36	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|P<4>}	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<2>,1|H<1>}	H(C[6]C[6]2)	117.5005	2.864	2	119.0426	13.615	36	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]C[6]S)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|H<1>,1|S<2>}	C[6](C[6]C[6]H)(C[6]C[6]S)(H){1|C<3>,1|S<2>}	H(C[6]C[6]2)	125.3210	0.000	1	121.5473	10.681	3	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]C[6]S)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|H<1>,1|S<4>}	C[6](C[6]C[6]H)(C[6]C[6]S)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.6605	0.029	2	121.5473	10.681	3	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<6>,1|C<3>}	H(C[6]C[6]2)	119.9960	0.000	1	119.9100	0.435	3	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<5>,1|C<3>}	H(C[6]C[6]2)	119.2120	0.000	1	119.9100	0.435	3	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<6>,1|C<3>}	H(C[6]C[6]2)	120.5220	0.000	1	119.9100	0.435	3	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<2>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>}	H(C[6]C[6]2)	121.0270	0.000	1	120.2602	9.856	24	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<6>,1|C<3>}	H(C[6]C[6]2)	126.5550	0.000	1	120.2602	9.856	24	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>}	H(C[6]C[6]2)	118.6965	0.216	2	120.2602	9.856	24	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<6>,1|C<3>}	H(C[6]C[6]2)	120.3520	0.000	1	120.2602	9.856	24	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>}	H(C[6]C[6]2)	115.6950	8.528	2	120.2602	9.856	24	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.3060	0.000	1	120.2602	9.856	24	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>}	H(C[6]C[6]2)	118.6067	1.139	3	120.2602	9.856	24	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>}	H(C[6]C[6]2)	118.7150	0.000	1	120.2602	9.856	24	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>}	H(C[6]C[6]2)	118.1710	0.000	1	120.2602	9.856	24	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<4>,1|C<2>}	H(C[6]C[6]2)	123.1140	0.000	1	120.2602	9.856	24	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|H<1>,2|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>}	H(C[6]C[6]2)	118.4750	0.000	1	120.2602	9.856	24	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>}	H(C[6]C[6]2)	120.1410	0.000	1	120.2602	9.856	24	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<9>,1|C<3>}	H(C[6]C[6]2)	120.2070	0.000	2	120.2602	9.856	24	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>}	H(C[6]C[6]2)	122.6345	0.370	4	120.2602	9.856	24	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){2|C<3>}	H(C[6]C[6]2)	119.0200	0.000	1	120.2602	9.856	24	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|Si<5>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<6>,1|C<3>}	H(C[6]C[6]2)	123.8130	0.000	1	120.2602	9.856	24	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<6>,1|C<3>}	H(C[6]C[6]2)	121.3920	0.000	1	120.8780	0.528	2	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Pd<4>,1|C<3>}	H(C[6]C[6]2)	120.3640	0.000	1	120.8780	0.528	2	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|As<3>,1|C<2>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>}	H(C[6]C[6]2)	125.1310	0.593	2	119.9891	27.856	271	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|As<3>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	141.3400	0.000	1	119.9891	27.856	271	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|As<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8285	2.691	2	119.9891	27.856	271	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|Au<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){2|C<3>}	H(C[6]C[6]2)	119.6950	0.000	1	119.9891	27.856	271	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	122.8130	0.000	1	119.9891	27.856	271	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<2>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9450	0.000	1	119.9891	27.856	271	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<2>,1|H<1>,1|P<4>}	C[6](C[6]C[6]H)2(H){1|C<3>}	H(C[6]C[6]2)	120.9855	7.145	2	119.9891	27.856	271	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5009	4.494	14	119.9891	27.856	271	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	115.5750	0.000	1	119.9891	27.856	271	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.5590	4.059	3	119.9891	27.856	271	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>}	H(C[6]C[6]2)	120.7430	0.000	1	119.9891	27.856	271	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	116.3580	0.000	1	119.9891	27.856	271	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|H<1>,1|P<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.7810	0.000	1	119.9891	27.856	271	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|H<1>,1|P<4>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.2364	2.769	26	119.9891	27.856	271	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|H<1>,1|S<2>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|S<2>}	H(C[6]C[6]2)	119.0940	9.390	4	119.9891	27.856	271	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|H<1>,1|S<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	113.9530	0.000	1	119.9891	27.856	271	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|H<1>,1|S<4>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	118.3790	0.000	1	119.9891	27.856	271	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|As<3>,1|C<2>}	H(C[6]C[6]2)	105.3950	0.000	1	119.9891	27.856	271	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<2>,1|C<3>}	H(C[6]C[6]2)	114.8045	14.703	2	119.9891	27.856	271	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<2>,1|C<4>}	H(C[6]C[6]2)	121.1250	1.871	2	119.9891	27.856	271	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<2>,1|H<1>}	H(C[6]C[6]2)	115.6250	10.658	4	119.9891	27.856	271	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<2>,1|N<3>}	H(C[6]C[6]2)	115.6530	0.000	1	119.9891	27.856	271	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<2>,1|P<4>}	H(C[6]C[6]2)	120.7180	0.000	1	119.9891	27.856	271	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|P<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.6596	0.128	5	119.9891	27.856	271	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|As<4>,1|C<3>}	H(C[6]C[6]2)	117.1840	2.070	2	119.9891	27.856	271	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|B<4>,1|C<3>}	H(C[6]C[6]2)	114.6558	4.663	5	119.9891	27.856	271	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Be<3>,1|C<3>}	H(C[6]C[6]2)	113.8990	0.000	1	119.9891	27.856	271	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>}	H(C[6]C[6]2)	121.9547	7.340	18	119.9891	27.856	271	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.4659	3.454	56	119.9891	27.856	271	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>}	H(C[6]C[6]2)	122.2106	8.107	5	119.9891	27.856	271	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|O<2>}	H(C[6]C[6]2)	122.3350	15.927	3	119.9891	27.856	271	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|P<3>}	H(C[6]C[6]2)	109.9540	0.000	1	119.9891	27.856	271	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|P<4>}	H(C[6]C[6]2)	119.1284	4.837	35	119.9891	27.856	271	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|S<2>}	H(C[6]C[6]2)	119.5730	9.924	2	119.9891	27.856	271	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|S<4>}	H(C[6]C[6]2)	114.8940	0.000	1	119.9891	27.856	271	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Ga<3>,1|C<3>}	H(C[6]C[6]2)	115.2560	0.000	1	119.9891	27.856	271	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Ge<4>,1|C<3>}	H(C[6]C[6]2)	119.8410	0.000	1	119.9891	27.856	271	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Sb<5>,1|C<3>}	H(C[6]C[6]2)	115.1320	0.157	2	119.9891	27.856	271	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Se<2>,1|C<3>}	H(C[6]C[6]2)	113.8400	3.926	2	119.9891	27.856	271	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Si<4>,1|C<3>}	H(C[6]C[6]2)	120.1211	4.369	9	119.9891	27.856	271	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Sn<4>,1|C<3>}	H(C[6]C[6]2)	118.8250	1.926	2	119.9891	27.856	271	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Sn<5>,1|C<3>}	H(C[6]C[6]2)	114.5580	0.000	1	119.9891	27.856	271	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){2|C<3>}	H(C[6]C[6]2)	120.4399	3.899	16	119.9891	27.856	271	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<2>,1|H<1>,1|P<4>}	H(C[6]C[6]2)	119.9040	0.000	1	119.9891	27.856	271	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Al<7>,1|C<3>,1|H<2>}	H(C[6]C[6]2)	119.7430	0.000	1	119.9891	27.856	271	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|Cu<5>,1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(H){1|Cu<5>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	118.7570	0.000	2	119.9891	27.856	271	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|Ge<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	129.5570	0.000	1	119.9891	27.856	271	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	122.3751	5.059	14	119.9891	27.856	271	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|O<2>}	H(C[6]C[6]2)	124.0960	5.630	5	119.9891	27.856	271	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|O<3>}	H(C[6]C[6]2)	124.0440	0.000	1	119.9891	27.856	271	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|Pd<4>,1|C<3>}	H(C[6]C[6]2)	123.0350	0.000	1	119.9891	27.856	271	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|Se<3>,1|C<2>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>}	H(C[6]C[6]2)	121.7020	0.124	2	119.9891	27.856	271	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|Sn<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	123.2530	0.000	1	119.9891	27.856	271	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|Ir<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]Ir)(C[6]C[6]H)(H){2|C<3>}	H(C[6]C[6]2)	118.4320	0.000	1	118.4320	0.000	1	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]N[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[5])(C[6]C[6]H)(H){1|H<1>,3|C<3>}	H(C[6]C[6]2)	118.3150	0.865	2	119.0650	2.062	3	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]N[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[5])(C[6]C[6]H)(H){2|C<3>,2|C<4>}	H(C[6]C[6]2)	120.5650	0.000	1	119.0650	2.062	3	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.1530	0.000	1	120.1530	0.000	1	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]Si)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|Si<4>,1|C<2>,1|H<1>}	C[6](C[6]C[6]Si)(C[6]C[6]H)(H){1|C<3>}	H(C[6]C[6]2)	116.1000	0.000	1	116.1000	0.000	1	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]Sn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|Sn<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]Sn)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3595	1.698	2	119.4630	108.571	4	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]Sn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|Sn<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]Sn)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	118.5665	17.878	2	119.4630	108.571	4	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]Te)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|Te<2>,1|C<3>,1|H<1>}	C[6](C[6]C[6]Te)(C[6]C[6]H)(H){2|C<3>}	H(C[6]C[6]2)	117.9830	0.000	1	117.9830	0.000	1	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pd<4>,3|C<3>}	H(C[6]C[6]2)	115.2520	0.000	1	115.2520	0.000	1	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6])(H)	C[6](C[6]N[5a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[5a]C[6])(C[6]C[6]H)(H){1|O<2>,3|C<3>}	H(C[6]C[6]2)	119.3440	0.000	1	119.3440	0.000	1	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6])(H)	C[6](C[6]C[5,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6])(H){1|C<3>,1|C<4>}	C[6](C[6]C[5,6]C[6])(C[6]C[6]H)(H){1|N<2>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	121.5420	0.000	1	121.5420	0.000	1	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6])(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6])(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>}	H(C[6]C[6]2)	122.9180	0.000	1	122.0938	9.942	18	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6])(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6])(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<2>,1|N<2>}	H(C[6]C[6]2)	120.1520	0.000	1	122.0938	9.942	18	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6])(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6])(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<2>}	H(C[6]C[6]2)	121.4297	1.597	3	122.0938	9.942	18	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6])(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6])(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<2>}	H(C[6]C[6]2)	120.6810	0.462	2	122.0938	9.942	18	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6])(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6])(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>}	H(C[6]C[6]2)	121.2580	0.000	1	122.0938	9.942	18	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6])(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6])(H){1|Cu<5>,1|C<2>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>}	H(C[6]C[6]2)	124.8765	6.575	2	122.0938	9.942	18	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6])(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6])(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>}	H(C[6]C[6]2)	125.8763	1.655	3	122.0938	9.942	18	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6])(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6])(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.8100	0.000	1	122.0938	9.942	18	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6])(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6])(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>}	H(C[6]C[6]2)	115.6370	0.000	1	122.0938	9.942	18	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6])(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6])(H){1|Pt<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>}	H(C[6]C[6]2)	120.3920	0.000	1	122.0938	9.942	18	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6])(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6])(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<2>,1|N<3>}	H(C[6]C[6]2)	121.2750	0.000	1	122.0938	9.942	18	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6])(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6])(H){1|Zn<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.2130	0.000	1	122.0938	9.942	18	119.7108	23.361	479	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:N[6]-3:Br-1:	C[6]-3:	C[6](C[6]N[6]Br)(C[6]C[6])(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(Br)	H(C[6]C[6]2)	C[6](C[6]N[6]Br)(C[6]C[6])(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(Br){1|C<3>,1|H<1>}	H(C[6]C[6]2)	122.8670	0.000	1	122.8670	0.000	1	122.8670	0.000	1	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)(C[6]C[6])(H){1|C<3>,2|C<4>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	116.9270	0.000	1	116.9270	0.000	1	120.2728	6.248	5	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)(C[6]C[6])(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|Br<1>,1|C<3>}	H(C[6]C[6]2)	118.7450	0.000	1	121.1093	3.666	4	120.2728	6.248	5	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(C[6]C[6])(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)(C[6]C[6])(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|C<4>}	H(C[6]C[6]2)	121.8973	1.331	3	121.1093	3.666	4	120.2728	6.248	5	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(C[6]C[6])(H)	C[6](N[6]C[6]Al)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)(C[6]C[6])(H){1|Al<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Al)(C[6]C[6]H)(H){2|C<3>}	H(C[6]C[6]2)	120.3860	0.000	1	120.3860	0.000	1	119.0082	19.874	13	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(C[6]C[6])(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)(C[6]C[6])(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){2|C<3>}	H(C[6]C[6]2)	125.6430	0.000	1	125.6430	0.000	1	119.0082	19.874	13	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(C[6]C[6])(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)(C[6]C[6])(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.8730	2.669	2	116.4593	62.002	3	119.0082	19.874	13	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(C[6]C[6])(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)(C[6]C[6])(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){2|C<3>}	H(C[6]C[6]2)	107.6320	0.000	1	116.4593	62.002	3	119.0082	19.874	13	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(C[6]C[6])(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)(C[6]C[6])(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){2|C<3>}	H(C[6]C[6]2)	117.4490	0.000	1	117.4490	0.000	1	119.0082	19.874	13	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(C[6]C[6])(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)(C[6]C[6])(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|C<3>,1|C<4>}	H(C[6]C[6]2)	115.2050	0.000	1	117.5180	10.700	2	119.0082	19.874	13	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(C[6]C[6])(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)(C[6]C[6])(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){2|C<3>}	H(C[6]C[6]2)	119.8310	0.000	1	117.5180	10.700	2	119.0082	19.874	13	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(C[6]C[6])(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)(C[6]C[6])(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){2|C<3>}	H(C[6]C[6]2)	120.7840	1.525	2	120.7840	2.324	2	119.0082	19.874	13	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(C[6]C[6])(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)(C[6]C[6])(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){2|C<3>}	H(C[6]C[6]2)	120.6865	3.123	2	120.6865	9.755	2	119.0082	19.874	13	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:C[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(C[6]C[6])(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)(C[6]C[6])(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){2|C<3>}	H(C[6]C[6]2)	116.2730	0.000	1	116.2730	0.000	1	119.0082	19.874	13	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(N[6]C[6])(H)	C[6](C[6,6]N[6,6]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6,6]H)(N[6]C[6])(H){1|C<3>,1|N<3>,1|O<2>}	C[6](C[6,6]N[6,6]C[6])(C[6]N[6]H)(H){1|B<4>,1|C<2>,2|C<3>}	H(C[6]C[6]N[6])	118.1310	0.000	1	118.2050	0.011	2	118.2050	0.011	2	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(N[6]C[6])(H)	C[6](C[6,6]N[6,6]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6,6]H)(N[6]C[6])(H){1|C<3>,2|N<3>}	C[6](C[6,6]N[6,6]C[6])(C[6]N[6]H)(H){1|B<4>,1|C<2>,2|C<3>}	H(C[6]C[6]N[6])	118.2790	0.000	1	118.2050	0.011	2	118.2050	0.011	2	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(Br)	H(C[6]C[6]N[6])	C[6](C[6]C[6]Br)(N[6]C[6])(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]N[6]H)2(Br){1|Ru<5>,1|C<3>}	H(C[6]C[6]N[6])	119.3655	0.295	2	119.1953	0.130	3	119.1953	0.130	3	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(Br)	H(C[6]C[6]N[6])	C[6](C[6]C[6]Br)(N[6]C[6])(H){1|N<3>,2|H<1>}	C[6](C[6]N[6]H)2(Br){1|Co<6>,1|C<3>}	H(C[6]C[6]N[6])	118.8550	0.000	1	119.1953	0.130	3	119.1953	0.130	3	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(Cl)	H(C[6]C[6]N[6])	C[6](C[6]C[6]Cl)(N[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6]H)2(Cl){1|Ru<6>,1|C<3>}	H(C[6]C[6]N[6])	119.3905	0.063	2	119.1040	0.248	3	119.1040	0.248	3	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(Cl)	H(C[6]C[6]N[6])	C[6](C[6]C[6]Cl)(N[6]C[6])(H){1|H<1>,2|N<3>}	C[6](C[6]N[6]H)2(Cl){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5310	0.000	1	119.1040	0.248	3	119.1040	0.248	3	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:F-1:	C[6]-3:	C[6](C[6]C[6]F)(N[6]C[6])(H)	C[6](C[6]N[6]H)(C[6]N[6]O)(F)	H(C[6]C[6]N[6])	C[6](C[6]C[6]F)(N[6]C[6])(H){1|N<3>,2|O<1>}	C[6](C[6]N[6]H)(C[6]N[6]O)(F){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	120.0660	0.000	1	120.0660	0.000	1	119.5053	0.271	3	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:F-1:	C[6]-3:	C[6](C[6]C[6]F)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(F)	H(C[6]C[6]N[6])	C[6](C[6]C[6]F)(N[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6]H)2(F){1|Ir<6>,1|C<3>}	H(C[6]C[6]N[6])	119.2250	0.266	2	119.2250	0.071	2	119.5053	0.271	3	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<2>,1|C<3>,1|H<1>}	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|C<2>,2|C<3>}	H(C[6]C[6]N[6])	118.7670	0.000	1	120.9365	9.413	2	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){2|C<3>}	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|C<2>,1|H<1>,2|C<3>}	H(C[6]C[6]N[6])	123.1060	0.000	1	120.9365	9.413	2	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<2>,1|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<2>,1|H<1>}	H(C[6]C[6]N[6])	111.8590	0.000	1	118.0993	30.694	3	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<2>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>}	H(C[6]C[6]N[6])	122.4390	0.000	1	118.0993	30.694	3	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<2>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>}	H(C[6]C[6]N[6])	120.0000	0.000	1	118.0993	30.694	3	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|Br<1>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|O<1>}	H(C[6]C[6]N[6])	118.9330	0.000	1	118.2819	14.407	8	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<2>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>}	H(C[6]C[6]N[6])	117.6680	0.000	1	118.2819	14.407	8	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<2>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>}	H(C[6]C[6]N[6])	118.3130	0.000	1	118.2819	14.407	8	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<2>,1|H<1>}	H(C[6]C[6]N[6])	118.8980	0.000	1	118.2819	14.407	8	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<4>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	121.9850	0.000	1	118.2819	14.407	8	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,2|C<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>}	H(C[6]C[6]N[6])	109.5540	0.000	1	118.2819	14.407	8	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,2|C<4>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	120.0290	0.000	1	118.2819	14.407	8	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|Rh<8>,1|H<1>,2|C<4>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<8>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	120.8750	0.000	1	118.2819	14.407	8	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H){1|Ni<5>,1|N<3>,2|C<3>}	H(C[6]C[6]N[6])	119.0615	3.495	2	118.4626	0.949	16	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H){1|Zn<5>,1|N<3>,2|C<3>}	H(C[6]C[6]N[6])	118.4670	0.313	2	118.4626	0.949	16	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H){1|Ir<8>,1|N<3>,2|C<3>}	H(C[6]C[6]N[6])	118.6210	0.000	1	118.4626	0.949	16	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H){1|N<3>,1|V<7>,2|C<3>}	H(C[6]C[6]N[6])	118.5400	0.000	1	118.4626	0.949	16	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|N<3>,1|S<2>}	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H){1|Co<6>,1|N<3>,2|C<3>}	H(C[6]C[6]N[6])	118.5513	0.089	3	118.4626	0.949	16	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|N<3>,1|S<2>}	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H){1|Cu<5>,1|N<3>,2|C<3>}	H(C[6]C[6]N[6])	118.3350	0.505	2	118.4626	0.949	16	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,2|N<3>}	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H){1|Co<8>,1|N<3>,2|C<3>}	H(C[6]C[6]N[6])	118.0310	0.000	1	118.4626	0.949	16	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,2|N<3>}	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H){1|Ir<8>,1|N<3>,2|C<3>}	H(C[6]C[6]N[6])	117.8450	0.000	1	118.4626	0.949	16	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,2|N<3>}	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H){1|N<3>,1|V<7>,2|C<3>}	H(C[6]C[6]N[6])	118.0130	0.000	1	118.4626	0.949	16	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,2|N<3>}	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H){1|Rh<8>,1|N<3>,2|C<3>}	H(C[6]C[6]N[6])	118.2900	0.000	1	118.4626	0.949	16	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,2|N<3>}	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H){1|Ru<9>,1|N<3>,2|C<3>}	H(C[6]C[6]N[6])	118.6810	0.000	1	118.4626	0.949	16	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|Ru<10>,1|O<2>,2|C<4>}	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|Ru<10>,1|Ru<8>,1|C<4>}	H(C[6]C[6]N[6])	117.4740	0.000	1	117.4740	0.000	1	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|S<2>}	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|C<2>,1|H<1>}	H(C[6]C[6]N[6])	120.8370	0.000	1	120.8370	0.000	1	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<2>,1|C<3>,1|H<1>}	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){3|C<3>}	H(C[6]C[6]N[6])	115.0160	4.681	2	115.0160	21.912	2	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]N[6]C)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>}	H(C[6]C[6]N[6])	118.2900	0.409	2	118.5380	0.176	10	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6]C)(C[6]N[6]H)(H){1|Co<6>,1|C<3>}	H(C[6]C[6]N[6])	118.9110	0.000	1	118.5380	0.176	10	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6]C)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>}	H(C[6]C[6]N[6])	118.7630	0.168	2	118.5380	0.176	10	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6]C)(C[6]N[6]H)(H){1|Li<5>,1|C<3>}	H(C[6]C[6]N[6])	118.5915	0.081	2	118.5380	0.176	10	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<4>,2|N<3>}	C[6](C[6]N[6]C)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3933	0.688	3	118.5380	0.176	10	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|S<1>,2|N<3>}	C[6](C[6]N[6]H)(C[6]N[6]N)(H){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	123.3580	0.000	1	120.9660	11.443	2	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){3|N<3>}	C[6](C[6]N[6]H)(C[6]N[6]N)(H){1|Co<6>,1|C<3>}	H(C[6]C[6]N[6])	118.5740	0.000	1	120.9660	11.443	2	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)(C[6]N[6]O)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|N<3>,2|O<1>}	C[6](C[6]N[6]H)(C[6]N[6]O)(H){1|Zn<4>,1|C<3>}	H(C[6]C[6]N[6])	122.2840	0.000	1	122.2840	0.000	1	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)(C[6]N[6]S)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|N<3>,2|S<2>}	C[6](C[6]N[6]H)(C[6]N[6]S)(H){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	116.8910	0.000	1	116.8910	0.000	1	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<2>,1|H<1>,1|N<3>}	C[6](C[6]N[6]H)2(H){1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	118.4940	0.000	1	118.5631	0.851	354	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6]H)2(H){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2735	0.468	6	118.5631	0.851	354	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6]H)2(H){1|Cd<6>,1|C<3>}	H(C[6]C[6]N[6])	118.6750	0.145	4	118.5631	0.851	354	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6]H)2(H){1|Co<6>,1|C<3>}	H(C[6]C[6]N[6])	119.1437	1.164	10	118.5631	0.851	354	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6]H)2(H){1|Cr<6>,1|C<3>}	H(C[6]C[6]N[6])	118.8200	0.000	1	118.5631	0.851	354	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6]H)2(H){1|Cu<4>,1|C<3>}	H(C[6]C[6]N[6])	119.0605	0.534	4	118.5631	0.851	354	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6]H)2(H){1|Cu<5>,1|C<3>}	H(C[6]C[6]N[6])	121.4980	0.000	1	118.5631	0.851	354	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6]H)2(H){1|Eu<9>,1|C<3>}	H(C[6]C[6]N[6])	118.7782	0.255	4	118.5631	0.851	354	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6]H)2(H){1|Fe<6>,1|C<3>}	H(C[6]C[6]N[6])	118.6874	0.436	19	118.5631	0.851	354	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6]H)2(H){1|Ir<6>,1|C<3>}	H(C[6]C[6]N[6])	118.2963	0.593	14	118.5631	0.851	354	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6]H)2(H){1|Mn<6>,1|C<3>}	H(C[6]C[6]N[6])	118.6898	0.446	27	118.5631	0.851	354	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6]H)2(H){1|Ni<4>,1|C<3>}	H(C[6]C[6]N[6])	118.7817	0.167	3	118.5631	0.851	354	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6]H)2(H){1|Ni<6>,1|C<3>}	H(C[6]C[6]N[6])	118.6872	0.394	20	118.5631	0.851	354	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6]H)2(H){1|Pd<4>,1|C<3>}	H(C[6]C[6]N[6])	118.6733	0.169	15	118.5631	0.851	354	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6]H)2(H){1|Pd<6>,1|C<3>}	H(C[6]C[6]N[6])	118.8760	0.190	2	118.5631	0.851	354	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6]H)2(H){1|Pt<4>,1|C<3>}	H(C[6]C[6]N[6])	118.8588	0.530	20	118.5631	0.851	354	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6]H)2(H){1|Pt<6>,1|C<3>}	H(C[6]C[6]N[6])	118.3395	0.133	4	118.5631	0.851	354	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6]H)2(H){1|Re<6>,1|C<3>}	H(C[6]C[6]N[6])	118.6185	0.335	17	118.5631	0.851	354	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6]H)2(H){1|Ru<6>,1|C<3>}	H(C[6]C[6]N[6])	118.7673	0.273	4	118.5631	0.851	354	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6]H)2(H){1|Zn<5>,1|C<3>}	H(C[6]C[6]N[6])	118.0935	0.337	2	118.5631	0.851	354	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6]H)2(H){1|Zn<6>,1|C<3>}	H(C[6]C[6]N[6])	118.3873	0.049	3	118.5631	0.851	354	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|Ca<11>,1|H<1>,2|N<3>}	C[6](C[6]N[6]H)2(H){1|Ca<11>,1|C<4>}	H(C[6]C[6]N[6])	118.0560	0.000	1	118.5631	0.851	354	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|Ca<8>,1|H<1>,2|N<3>}	C[6](C[6]N[6]H)2(H){1|Ca<8>,1|C<4>}	H(C[6]C[6]N[6])	118.2860	0.000	1	118.5631	0.851	354	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|Ce<17>,1|N<3>,2|H<1>}	C[6](C[6]N[6]H)2(H){1|Ce<17>,1|C<4>}	H(C[6]C[6]N[6])	118.5490	0.000	1	118.5631	0.851	354	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]N[6]H)2(H){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.8745	0.589	12	118.5631	0.851	354	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]N[6]H)2(H){1|Cu<6>,1|C<3>}	H(C[6]C[6]N[6])	118.8220	0.000	1	118.5631	0.851	354	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]N[6]H)2(H){1|Zn<4>,1|C<3>}	H(C[6]C[6]N[6])	118.0490	0.017	2	118.5631	0.851	354	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]N[6]H)2(H){1|Cu<5>,1|C<3>}	H(C[6]C[6]N[6])	118.2930	0.000	1	118.5631	0.851	354	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,1|N<3>,1|S<1>}	C[6](C[6]N[6]H)2(H){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	120.3877	1.762	3	118.5631	0.851	354	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]N[6]H)2(H){1|Ag<4>,1|C<3>}	H(C[6]C[6]N[6])	118.0600	0.000	1	118.5631	0.851	354	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]N[6]H)2(H){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.7485	0.247	2	118.5631	0.851	354	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]N[6]H)2(H){1|Ni<6>,1|C<3>}	H(C[6]C[6]N[6])	118.0307	0.047	4	118.5631	0.851	354	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]N[6]H)2(H){1|Pd<4>,1|C<3>}	H(C[6]C[6]N[6])	117.9685	0.305	2	118.5631	0.851	354	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]N[6]H)2(H){1|Pt<5>,1|C<3>}	H(C[6]C[6]N[6])	118.5310	0.096	2	118.5631	0.851	354	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]N[6]H)2(H){1|Sn<7>,1|C<3>}	H(C[6]C[6]N[6])	118.0407	0.377	3	118.5631	0.851	354	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,1|N<3>,1|S<3>}	C[6](C[6]N[6]H)2(H){1|Re<6>,1|C<3>}	H(C[6]C[6]N[6])	119.8840	0.000	1	118.5631	0.851	354	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,2|N<3>}	C[6](C[6]N[6]H)2(H){1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	118.3215	0.053	2	118.5631	0.851	354	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,2|N<3>}	C[6](C[6]N[6]H)2(H){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7123	1.993	32	118.5631	0.851	354	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,2|N<3>}	C[6](C[6]N[6]H)2(H){1|C<3>,1|O<1>}	H(C[6]C[6]N[6])	118.7440	0.000	1	118.5631	0.851	354	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,2|N<3>}	C[6](C[6]N[6]H)2(H){1|Cd<6>,1|C<3>}	H(C[6]C[6]N[6])	118.3840	0.000	1	118.5631	0.851	354	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,2|N<3>}	C[6](C[6]N[6]H)2(H){1|Cu<4>,1|C<3>}	H(C[6]C[6]N[6])	118.5258	0.216	6	118.5631	0.851	354	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,2|N<3>}	C[6](C[6]N[6]H)2(H){1|Cu<5>,1|C<3>}	H(C[6]C[6]N[6])	118.4305	0.419	11	118.5631	0.851	354	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,2|N<3>}	C[6](C[6]N[6]H)2(H){1|Cu<6>,1|C<3>}	H(C[6]C[6]N[6])	118.8710	0.000	1	118.5631	0.851	354	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,2|N<3>}	C[6](C[6]N[6]H)2(H){1|Fe<6>,1|C<3>}	H(C[6]C[6]N[6])	118.4645	0.165	4	118.5631	0.851	354	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,2|N<3>}	C[6](C[6]N[6]H)2(H){1|Ir<8>,1|C<3>}	H(C[6]C[6]N[6])	118.0217	0.527	8	118.5631	0.851	354	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,2|N<3>}	C[6](C[6]N[6]H)2(H){1|Mn<6>,1|C<3>}	H(C[6]C[6]N[6])	118.4730	0.433	2	118.5631	0.851	354	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,2|N<3>}	C[6](C[6]N[6]H)2(H){1|Ni<4>,1|C<3>}	H(C[6]C[6]N[6])	118.2793	0.424	3	118.5631	0.851	354	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,2|N<3>}	C[6](C[6]N[6]H)2(H){1|Ni<6>,1|C<3>}	H(C[6]C[6]N[6])	116.3603	3.816	4	118.5631	0.851	354	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,2|N<3>}	C[6](C[6]N[6]H)2(H){1|Pd<4>,1|C<3>}	H(C[6]C[6]N[6])	118.5443	0.284	19	118.5631	0.851	354	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,2|N<3>}	C[6](C[6]N[6]H)2(H){1|Re<6>,1|C<3>}	H(C[6]C[6]N[6])	119.1820	0.517	4	118.5631	0.851	354	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,2|N<3>}	C[6](C[6]N[6]H)2(H){1|Rh<6>,1|C<3>}	H(C[6]C[6]N[6])	118.4245	1.042	2	118.5631	0.851	354	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,2|N<3>}	C[6](C[6]N[6]H)2(H){1|Rh<8>,1|C<3>}	H(C[6]C[6]N[6])	118.3998	0.994	5	118.5631	0.851	354	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,2|N<3>}	C[6](C[6]N[6]H)2(H){1|Ru<6>,1|C<3>}	H(C[6]C[6]N[6])	118.4961	0.359	8	118.5631	0.851	354	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,2|N<3>}	C[6](C[6]N[6]H)2(H){1|Ru<9>,1|C<3>}	H(C[6]C[6]N[6])	118.4480	0.000	1	118.5631	0.851	354	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,2|N<3>}	C[6](C[6]N[6]H)2(H){1|Zn<4>,1|C<3>}	H(C[6]C[6]N[6])	118.2190	0.000	1	118.5631	0.851	354	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|Mn<7>,1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]N[6]H)2(H){1|Mn<7>,1|C<4>}	H(C[6]C[6]N[6])	118.1990	0.000	1	118.5631	0.851	354	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|N<3>,2|H<1>}	C[6](C[6]N[6]H)2(H){1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	118.6920	0.000	1	118.5631	0.851	354	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|N<3>,2|H<1>}	C[6](C[6]N[6]H)2(H){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7960	0.154	3	118.5631	0.851	354	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|N<3>,2|H<1>}	C[6](C[6]N[6]H)2(H){1|C<3>,1|W<7>}	H(C[6]C[6]N[6])	118.7410	0.000	1	118.5631	0.851	354	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|N<3>,2|H<1>}	C[6](C[6]N[6]H)2(H){1|Cu<4>,1|C<3>}	H(C[6]C[6]N[6])	118.3310	0.000	1	118.5631	0.851	354	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|N<3>,2|H<1>}	C[6](C[6]N[6]H)2(H){1|Mn<6>,1|C<3>}	H(C[6]C[6]N[6])	119.1870	0.000	1	118.5631	0.851	354	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|N<3>,2|H<1>}	C[6](C[6]N[6]H)2(H){1|Pd<4>,1|C<3>}	H(C[6]C[6]N[6])	118.5083	0.296	4	118.5631	0.851	354	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|N<3>,2|H<1>}	C[6](C[6]N[6]H)2(H){1|Re<6>,1|C<3>}	H(C[6]C[6]N[6])	118.5990	0.000	1	118.5631	0.851	354	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|N<3>,2|H<1>}	C[6](C[6]N[6]H)2(H){1|U<16>,1|C<3>}	H(C[6]C[6]N[6])	119.2770	0.000	1	118.5631	0.851	354	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6])(H){1|Ru<8>,1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]N[6]H)2(H){1|Ru<8>,1|C<4>}	H(C[6]C[6]N[6])	118.1576	0.593	7	118.5631	0.851	354	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]N[6])(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]N[6])(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,1|N<3>}	H(C[6]C[6]N[6])	118.1458	0.235	6	118.5517	1.960	32	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]N[6])(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]N[6])(H){1|Ca<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|N<3>}	H(C[6]C[6]N[6])	122.8870	0.177	2	118.5517	1.960	32	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]N[6])(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]N[6])(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|N<3>}	H(C[6]C[6]N[6])	118.3110	0.000	1	118.5517	1.960	32	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]N[6])(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]N[6])(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,1|N<3>}	H(C[6]C[6]N[6])	118.0805	0.101	2	118.5517	1.960	32	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]N[6])(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]N[6])(H){1|Li<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|N<3>}	H(C[6]C[6]N[6])	122.1040	0.000	1	118.5517	1.960	32	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]N[6])(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]N[6])(H){1|Mg<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|N<3>}	H(C[6]C[6]N[6])	119.8920	0.000	1	118.5517	1.960	32	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]N[6])(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]N[6])(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,1|N<3>}	H(C[6]C[6]N[6])	118.0021	0.241	9	118.5517	1.960	32	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]N[6])(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]N[6])(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,1|N<3>}	H(C[6]C[6]N[6])	118.2480	0.529	4	118.5517	1.960	32	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]N[6])(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]N[6])(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,1|N<3>}	H(C[6]C[6]N[6])	118.0880	0.000	1	118.5517	1.960	32	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]N[6])(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]N[6])(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,1|N<3>}	H(C[6]C[6]N[6])	117.7340	0.000	1	118.5517	1.960	32	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]N[6])(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]N[6])(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,1|N<3>}	H(C[6]C[6]N[6])	117.9260	0.181	4	118.5517	1.960	32	118.5627	1.515	433	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)(N[6]C[6]B)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6]B)(H){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.4245	0.192	2	119.4245	0.037	2	118.9120	0.755	88	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6]C)(H){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4916	0.464	14	118.4511	0.157	25	118.9120	0.755	88	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6]C)(H){1|C<3>,1|S<1>}	H(C[6]C[6]N[6])	118.7570	0.000	1	118.4511	0.157	25	118.9120	0.755	88	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]N[6]H)(N[6]C[6]C)(H){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.0893	0.274	3	118.4511	0.157	25	118.9120	0.755	88	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|C<3>,1|C<5>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6]C)(H){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5080	0.051	2	118.4511	0.157	25	118.9120	0.755	88	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|C<3>,2|C<4>}	C[6](C[6]N[6]H)(N[6]C[6]C)(H){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4257	0.284	4	118.4511	0.157	25	118.9120	0.755	88	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|C<4>,2|C<3>}	C[6](C[6]N[6]H)(N[6]C[6]C)(H){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6520	0.000	1	118.4511	0.157	25	118.9120	0.755	88	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6]H)(H){1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	120.1965	0.117	2	119.4065	0.670	44	118.9120	0.755	88	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6]H)(N[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3570	0.038	2	119.4065	0.670	44	118.9120	0.755	88	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6]H)(N[6]C[6]H)(H){1|C<3>,1|S<1>}	H(C[6]C[6]N[6])	119.0070	0.000	1	119.4065	0.670	44	118.9120	0.755	88	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|S<2>}	C[6](C[6]N[6]H)(N[6]C[6]H)(H){1|C<3>,1|S<2>}	H(C[6]C[6]N[6])	119.0150	0.576	6	119.4065	0.670	44	118.9120	0.755	88	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|S<3>}	C[6](C[6]N[6]H)(N[6]C[6]H)(H){1|C<3>,1|S<3>}	H(C[6]C[6]N[6])	118.4780	0.065	2	119.4065	0.670	44	118.9120	0.755	88	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|C<3>,2|H<1>}	C[6](C[6]N[6]H)(N[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.6934	0.940	14	119.4065	0.670	44	118.9120	0.755	88	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|C<3>,2|H<1>}	C[6](C[6]N[6]H)(N[6]C[6]H)(H){1|C<3>,1|N<3>}	H(C[6]C[6]N[6])	119.3517	0.345	6	119.4065	0.670	44	118.9120	0.755	88	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Cl<1>,1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6]H)(H){2|C<3>}	H(C[6]C[6]N[6])	119.2540	0.000	1	119.4065	0.670	44	118.9120	0.755	88	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|H<1>,2|C<3>}	C[6](C[6]N[6]H)(N[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	120.1965	2.457	2	119.4065	0.670	44	118.9120	0.755	88	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|H<1>,2|C<3>}	C[6](C[6]N[6]H)(N[6]C[6]H)(H){1|C<3>,1|N<3>}	H(C[6]C[6]N[6])	119.4080	0.212	8	119.4065	0.670	44	118.9120	0.755	88	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)(N[6]C[6]O)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]N[6]H)(N[6]C[6]O)(H){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2559	0.215	10	118.3878	0.453	13	118.9120	0.755	88	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)(N[6]C[6]O)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]N[6]H)(N[6]C[6]O)(H){2|C<3>}	H(C[6]C[6]N[6])	117.7410	0.000	1	118.3878	0.453	13	118.9120	0.755	88	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)(N[6]C[6]O)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|C<3>,1|O<1>,1|S<4>}	C[6](C[6]N[6]H)(N[6]C[6]O)(H){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2550	0.000	1	118.3878	0.453	13	118.9120	0.755	88	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)(N[6]C[6]O)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Cl<1>,1|C<3>,1|O<1>}	C[6](C[6]N[6]H)(N[6]C[6]O)(H){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	120.4870	0.000	1	118.3878	0.453	13	118.9120	0.755	88	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)(N[6]C[6]V)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|V<11>,1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6]V)(H){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.0070	0.243	2	117.0070	0.059	2	118.9120	0.755	88	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](C[6]N[6]H)(N[6]C[6]W)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|W<6>}	C[6](C[6]N[6]H)(N[6]C[6]W)(H){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5905	0.103	2	118.5905	0.011	2	118.9120	0.755	88	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:N[6]-3:S-1:	C[6]-3:	C[6](C[6]N[6]S)(N[6]C[6])(H)	C[6](C[6]N[6]H)(N[6]C[6]C)(S)	H(C[6]C[6]N[6])	C[6](C[6]N[6]S)(N[6]C[6])(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6]C)(S){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	116.7310	0.000	1	116.9423	0.086	3	116.9423	0.086	3	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:N[6]-3:S-1:	C[6]-3:	C[6](C[6]N[6]S)(N[6]C[6])(H)	C[6](C[6]N[6]H)(N[6]C[6]C)(S)	H(C[6]C[6]N[6])	C[6](C[6]N[6]S)(N[6]C[6])(H){1|C<4>,2|C<3>}	C[6](C[6]N[6]H)(N[6]C[6]C)(S){2|C<3>}	H(C[6]C[6]N[6])	117.0480	0.325	2	116.9423	0.086	3	116.9423	0.086	3	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(N[6]C[6])(H)	C[6](N[5,6]Ga[3x5]C[5,6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[5,6]H)(N[6]C[6])(H){1|Ga<5>,1|C<3>,1|H<1>}	C[6](N[5,6]Ga[3x5]C[5,6])(C[6]N[6]H)(H){2|C<3>,2|N<3>,2|S<2>}	H(C[6]C[6]N[6])	118.4400	0.000	1	118.4400	0.000	1	118.4400	0.000	1	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Ag)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Ag<5>,2|C<3>}	C[6](N[6]C[6]Ag)(C[6]N[6]H)(H){2|C<3>}	H(C[6]C[6]N[6])	119.1170	0.544	2	119.1170	0.296	2	118.6753	0.944	281	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Al)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Al<4>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Al)(C[6]N[6]H)(H){2|C<3>}	H(C[6]C[6]N[6])	118.9491	0.130	8	118.9863	0.020	10	118.6753	0.944	281	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Al)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Al<5>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Al)(C[6]N[6]H)(H){2|C<3>}	H(C[6]C[6]N[6])	119.1350	0.105	2	118.9863	0.020	10	118.6753	0.944	281	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Au)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Au<2>,2|C<3>}	C[6](N[6]C[6]Au)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5570	0.000	1	118.5570	0.000	1	118.6753	0.944	281	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Bi)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Bi<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Bi)(C[6]N[6]H)(H){2|C<3>}	H(C[6]C[6]N[6])	118.4405	0.025	2	118.4405	0.001	2	118.6753	0.944	281	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Cd)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Cd<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cd)(C[6]N[6]H)(H){2|C<3>}	H(C[6]C[6]N[6])	118.9655	0.077	2	118.8830	0.023	3	118.6753	0.944	281	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Cd)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Cd<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cd)(C[6]N[6]H)(H){2|C<3>}	H(C[6]C[6]N[6])	118.7180	0.000	1	118.8830	0.023	3	118.6753	0.944	281	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Co)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Br<1>,1|Co<6>,1|C<3>}	C[6](N[6]C[6]Co)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7520	0.000	1	118.6547	0.311	48	118.6753	0.944	281	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Co)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Cl<1>,1|Co<6>,1|C<3>}	C[6](N[6]C[6]Co)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5420	0.000	1	118.6547	0.311	48	118.6753	0.944	281	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Co)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Co<6>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Co)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.9070	0.000	1	118.6547	0.311	48	118.6753	0.944	281	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Co)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]N[6]H)(H){1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	119.2673	0.320	4	118.6547	0.311	48	118.6753	0.944	281	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Co)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5955	0.153	2	118.6547	0.311	48	118.6753	0.944	281	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Co)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]N[6]H)(H){2|C<3>}	H(C[6]C[6]N[6])	118.7044	0.442	26	118.6547	0.311	48	118.6753	0.944	281	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Co)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Co<6>,1|C<3>,1|I<1>}	C[6](N[6]C[6]Co)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5880	0.000	1	118.6547	0.311	48	118.6753	0.944	281	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Co)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Co<6>,1|C<3>,1|N<3>}	C[6](N[6]C[6]Co)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.7014	0.781	5	118.6547	0.311	48	118.6753	0.944	281	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Co)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Co<6>,1|C<3>,1|N<3>}	C[6](N[6]C[6]Co)(C[6]N[6]H)(H){2|C<3>}	H(C[6]C[6]N[6])	118.6010	0.000	1	118.6547	0.311	48	118.6753	0.944	281	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Co)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Co<6>,1|C<3>,1|O<2>}	C[6](N[6]C[6]Co)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5180	0.000	1	118.6547	0.311	48	118.6753	0.944	281	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Co)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Co<6>,1|C<3>,1|S<2>}	C[6](N[6]C[6]Co)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3410	0.000	1	118.6547	0.311	48	118.6753	0.944	281	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Co)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Co<6>,2|C<3>}	C[6](N[6]C[6]Co)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8160	0.000	1	118.6547	0.311	48	118.6753	0.944	281	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Co)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Co<6>,2|C<3>}	C[6](N[6]C[6]Co)(C[6]N[6]H)(H){2|C<3>}	H(C[6]C[6]N[6])	119.0930	0.087	3	118.6547	0.311	48	118.6753	0.944	281	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Cu<3>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H){2|C<3>}	H(C[6]C[6]N[6])	118.9040	0.000	1	118.7429	0.250	41	118.6753	0.944	281	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Cu<4>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4530	0.075	2	118.7429	0.250	41	118.6753	0.944	281	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	120.3930	1.198	2	118.7429	0.250	41	118.6753	0.944	281	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H){2|C<3>}	H(C[6]C[6]N[6])	118.8310	0.074	3	118.7429	0.250	41	118.6753	0.944	281	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Cu<4>,2|C<3>}	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H){2|C<3>}	H(C[6]C[6]N[6])	119.0790	0.249	2	118.7429	0.250	41	118.6753	0.944	281	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Cu<5>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6172	0.205	4	118.7429	0.250	41	118.6753	0.944	281	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.9110	0.000	1	118.7429	0.250	41	118.6753	0.944	281	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H){2|C<3>}	H(C[6]C[6]N[6])	118.5880	0.249	11	118.7429	0.250	41	118.6753	0.944	281	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Cu<5>,1|C<3>,1|N<3>}	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3430	0.184	2	118.7429	0.250	41	118.6753	0.944	281	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Cu<5>,2|C<3>}	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6440	0.286	2	118.7429	0.250	41	118.6753	0.944	281	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Cu<5>,2|C<3>}	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H){2|C<3>}	H(C[6]C[6]N[6])	118.8323	0.136	3	118.7429	0.250	41	118.6753	0.944	281	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Cu<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H){1|C<3>,1|N<3>}	H(C[6]C[6]N[6])	119.1060	0.000	1	118.7429	0.250	41	118.6753	0.944	281	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Cu<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H){2|C<3>}	H(C[6]C[6]N[6])	118.4980	0.301	5	118.7429	0.250	41	118.6753	0.944	281	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Cu<6>,1|C<3>,1|N<2>}	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3740	0.000	1	118.7429	0.250	41	118.6753	0.944	281	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Cu<6>,2|C<3>}	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H){2|C<3>}	H(C[6]C[6]N[6])	118.9230	0.000	1	118.7429	0.250	41	118.6753	0.944	281	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Fe)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Cl<1>,1|Fe<6>,1|C<3>}	C[6](N[6]C[6]Fe)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7240	0.000	1	118.3544	0.651	16	118.6753	0.944	281	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Fe)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Fe<6>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Fe)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8850	0.000	1	118.3544	0.651	16	118.6753	0.944	281	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Fe)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.1315	0.254	2	118.3544	0.651	16	118.6753	0.944	281	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Fe)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]N[6]H)(H){2|C<3>}	H(C[6]C[6]N[6])	118.2490	0.925	11	118.3544	0.651	16	118.6753	0.944	281	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Fe)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Fe<6>,1|C<3>,1|S<2>}	C[6](N[6]C[6]Fe)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.0600	0.000	1	118.3544	0.651	16	118.6753	0.944	281	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Ga)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Ga<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ga)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.1260	0.492	2	118.1260	0.242	2	118.6753	0.944	281	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Hg)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Hg<4>,2|C<3>}	C[6](N[6]C[6]Hg)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.9105	0.332	4	118.9105	0.110	4	118.6753	0.944	281	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Ir)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Ir<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]N[6]H)(H){1|C<3>,1|N<3>}	H(C[6]C[6]N[6])	118.7440	0.000	1	118.8003	0.034	3	118.6753	0.944	281	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Ir)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Ir<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]N[6]H)(H){2|C<3>}	H(C[6]C[6]N[6])	118.6520	0.000	1	118.8003	0.034	3	118.6753	0.944	281	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Ir)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Ir<6>,2|C<3>}	C[6](N[6]C[6]Ir)(C[6]N[6]H)(H){2|C<3>}	H(C[6]C[6]N[6])	119.0050	0.000	1	118.8003	0.034	3	118.6753	0.944	281	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Mn)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Mn<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]N[6]H)(H){2|C<3>}	H(C[6]C[6]N[6])	118.7760	0.000	1	119.0484	0.355	23	118.6753	0.944	281	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Mn)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]N[6]H)(H){2|C<3>}	H(C[6]C[6]N[6])	119.3865	0.581	13	119.0484	0.355	23	118.6753	0.944	281	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Mn)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Mn<6>,1|C<3>,1|N<2>}	C[6](N[6]C[6]Mn)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7950	0.000	1	119.0484	0.355	23	118.6753	0.944	281	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Mn)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Mn<6>,1|C<3>,1|N<3>}	C[6](N[6]C[6]Mn)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4270	0.091	2	119.0484	0.355	23	118.6753	0.944	281	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Mn)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Mn<6>,1|C<3>,1|N<3>}	C[6](N[6]C[6]Mn)(C[6]N[6]H)(H){2|C<3>}	H(C[6]C[6]N[6])	118.4410	0.116	2	119.0484	0.355	23	118.6753	0.944	281	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Mn)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Mn<6>,1|C<3>,1|O<2>}	C[6](N[6]C[6]Mn)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4630	0.000	1	119.0484	0.355	23	118.6753	0.944	281	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Mn)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Mn<6>,2|C<3>}	C[6](N[6]C[6]Mn)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6910	0.006	2	119.0484	0.355	23	118.6753	0.944	281	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Mn)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Mn<6>,2|C<3>}	C[6](N[6]C[6]Mn)(C[6]N[6]H)(H){2|C<3>}	H(C[6]C[6]N[6])	118.9360	0.000	1	119.0484	0.355	23	118.6753	0.944	281	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Ni)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Br<1>,1|Ni<6>,1|C<3>}	C[6](N[6]C[6]Ni)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6920	0.000	1	118.7010	0.131	23	118.6753	0.944	281	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Ni)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Cl<1>,1|Ni<6>,1|C<3>}	C[6](N[6]C[6]Ni)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4550	0.000	1	118.7010	0.131	23	118.6753	0.944	281	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Ni)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Ni<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]N[6]H)(H){2|C<3>}	H(C[6]C[6]N[6])	118.8485	0.575	2	118.7010	0.131	23	118.6753	0.944	281	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Ni)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Ni<6>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Ni)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8700	0.000	1	118.7010	0.131	23	118.6753	0.944	281	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Ni)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]N[6]H)(H){2|C<3>}	H(C[6]C[6]N[6])	118.7828	0.379	13	118.7010	0.131	23	118.6753	0.944	281	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Ni)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Ni<6>,1|C<3>,1|I<1>}	C[6](N[6]C[6]Ni)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7790	0.000	1	118.7010	0.131	23	118.6753	0.944	281	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Ni)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Ni<6>,1|C<3>,1|N<3>}	C[6](N[6]C[6]Ni)(C[6]N[6]H)(H){2|C<3>}	H(C[6]C[6]N[6])	118.3637	0.213	4	118.7010	0.131	23	118.6753	0.944	281	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Pd)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]N[6]H)(H){1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	118.1117	0.602	3	118.4425	0.234	11	118.6753	0.944	281	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Pd)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6550	0.537	4	118.4425	0.234	11	118.6753	0.944	281	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Pd)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]N[6]H)(H){2|C<3>}	H(C[6]C[6]N[6])	118.3415	0.373	2	118.4425	0.234	11	118.6753	0.944	281	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Pd)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Pd<4>,2|C<3>}	C[6](N[6]C[6]Pd)(C[6]N[6]H)(H){2|C<3>}	H(C[6]C[6]N[6])	118.6145	0.144	2	118.4425	0.234	11	118.6753	0.944	281	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Pt)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3789	0.272	10	118.5516	0.109	17	118.6753	0.944	281	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Pt)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Pt<4>,2|C<3>}	C[6](N[6]C[6]Pt)(C[6]N[6]H)(H){2|C<3>}	H(C[6]C[6]N[6])	118.9433	0.094	3	118.5516	0.109	17	118.6753	0.944	281	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Pt)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Pt<5>,2|C<3>}	C[6](N[6]C[6]Pt)(C[6]N[6]H)(H){2|C<3>}	H(C[6]C[6]N[6])	118.5330	0.000	1	118.5516	0.109	17	118.6753	0.944	281	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Pt)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Pt<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6625	0.385	2	118.5516	0.109	17	118.6753	0.944	281	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Pt)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Pt<6>,2|C<3>}	C[6](N[6]C[6]Pt)(C[6]N[6]H)(H){2|C<3>}	H(C[6]C[6]N[6])	118.9010	0.000	1	118.5516	0.109	17	118.6753	0.944	281	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Re)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Re<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Re)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	111.9110	4.916	2	118.0275	4.699	24	118.6753	0.944	281	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Re)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Re)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6039	0.267	14	118.0275	4.699	24	118.6753	0.944	281	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Re)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Re)(C[6]N[6]H)(H){2|C<3>}	H(C[6]C[6]N[6])	118.5480	0.440	8	118.0275	4.699	24	118.6753	0.944	281	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Rh)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Rh<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6545	0.084	2	118.6545	0.007	2	118.6753	0.944	281	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Ru)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Ru<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]N[6]H)(H){2|C<3>}	H(C[6]C[6]N[6])	118.9480	0.345	2	118.5465	0.077	13	118.6753	0.944	281	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Ru)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]N[6]H)(H){1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	118.6590	0.000	1	118.5465	0.077	13	118.6753	0.944	281	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Ru)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4800	0.007	2	118.5465	0.077	13	118.6753	0.944	281	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Ru)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]N[6]H)(H){2|C<3>}	H(C[6]C[6]N[6])	118.4488	0.234	8	118.5465	0.077	13	118.6753	0.944	281	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Sn)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Sn<4>,1|C<3>,1|N<3>}	C[6](N[6]C[6]Sn)(C[6]N[6]H)(H){2|C<3>}	H(C[6]C[6]N[6])	118.4657	0.203	3	118.6505	0.045	11	118.6753	0.944	281	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Sn)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Sn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Sn)(C[6]N[6]H)(H){2|C<3>}	H(C[6]C[6]N[6])	118.8268	0.201	4	118.6505	0.045	11	118.6753	0.944	281	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Sn)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Sn<6>,2|C<3>}	C[6](N[6]C[6]Sn)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6470	0.000	1	118.6505	0.045	11	118.6753	0.944	281	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Sn)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Sn<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Sn)(C[6]N[6]H)(H){2|C<3>}	H(C[6]C[6]N[6])	118.6013	0.081	3	118.6505	0.045	11	118.6753	0.944	281	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Zn)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6510	0.008	2	119.1608	3.336	25	118.6753	0.944	281	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Zn)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Zn<4>,1|C<3>,1|N<3>}	C[6](N[6]C[6]Zn)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4150	0.000	1	119.1608	3.336	25	118.6753	0.944	281	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Zn)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Zn<4>,2|C<3>}	C[6](N[6]C[6]Zn)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4030	1.515	6	119.1608	3.336	25	118.6753	0.944	281	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Zn)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Zn<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	122.8615	5.761	2	119.1608	3.336	25	118.6753	0.944	281	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Zn)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Zn<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]N[6]H)(H){2|C<3>}	H(C[6]C[6]N[6])	118.6120	0.000	1	119.1608	3.336	25	118.6753	0.944	281	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Zn)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Zn<6>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Zn)(C[6]N[6]H)(H){2|C<3>}	H(C[6]C[6]N[6])	119.0840	0.199	2	119.1608	3.336	25	118.6753	0.944	281	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Zn)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Zn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]N[6]H)(H){2|C<3>}	H(C[6]C[6]N[6])	119.1669	0.570	10	119.1608	3.336	25	118.6753	0.944	281	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6])(H)	C[6](N[6]C[6]Zn)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Zn<6>,1|C<3>,1|N<2>}	C[6](N[6]C[6]Zn)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7130	0.000	1	119.1608	3.336	25	118.6753	0.944	281	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:O[6]-2:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(O[6]C[6])(H)	C[6](C[5,6]C[5,6]S[5])(C[6]O[6]H)(H)	H(C[6]C[6]O[6])	C[6](C[6]C[5,6]H)(O[6]C[6])(H){1|C<3>,1|C<4>,1|S<2>}	C[6](C[5,6]C[5,6]S[5])(C[6]O[6]H)(H){1|Ga<5>,1|C<3>,1|O<2>}	H(C[6]C[6]O[6])	118.5375	0.301	2	118.6380	0.047	5	118.6380	0.047	5	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:O[6]-2:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(O[6]C[6])(H)	C[6](C[5,6]C[5,6]S[5])(C[6]O[6]H)(H)	H(C[6]C[6]O[6])	C[6](C[6]C[5,6]H)(O[6]C[6])(H){1|C<3>,1|C<4>,1|S<2>}	C[6](C[5,6]C[5,6]S[5])(C[6]O[6]H)(H){1|Ga<6>,1|C<3>,1|O<2>}	H(C[6]C[6]O[6])	118.7050	0.181	3	118.6380	0.047	5	118.6380	0.047	5	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:O[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(O[6]C[6])(H)	C[6](C[6]C[5]C[6])(C[6]O[6]H)(H)	H(C[6]C[6]O[6])	C[6](C[6]C[6]H)(O[6]C[6])(H){1|H<1>,2|C<3>}	C[6](C[6]C[5]C[6])(C[6]O[6]H)(H){1|C<3>,1|H<1>,2|S<2>}	H(C[6]C[6]O[6])	117.7195	0.569	2	117.7195	0.324	2	118.6212	1.466	58	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:O[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(O[6]C[6])(H)	C[6](C[6]C[6]O)(C[6]O[6]H)(H)	H(C[6]C[6]O[6])	C[6](C[6]C[6]H)(O[6]C[6])(H){1|C<3>,1|C<4>,1|H<1>,1|O<1>}	C[6](C[6]C[6]O)(C[6]O[6]H)(H){1|C<4>,2|H<1>}	H(C[6]C[6]O[6])	117.2635	0.197	2	118.4818	3.187	25	118.6212	1.466	58	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:O[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(O[6]C[6])(H)	C[6](C[6]C[6]O)(C[6]O[6]H)(H)	H(C[6]C[6]O[6])	C[6](C[6]C[6]H)(O[6]C[6])(H){1|C<3>,1|C<4>,1|O<2>}	C[6](C[6]C[6]O)(C[6]O[6]H)(H){1|C<3>,1|O<2>}	H(C[6]C[6]O[6])	118.7822	1.793	18	118.4818	3.187	25	118.6212	1.466	58	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:O[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(O[6]C[6])(H)	C[6](C[6]C[6]O)(C[6]O[6]H)(H)	H(C[6]C[6]O[6])	C[6](C[6]C[6]H)(O[6]C[6])(H){1|C<3>,1|O<1>,2|C<4>}	C[6](C[6]C[6]O)(C[6]O[6]H)(H){1|C<4>,2|H<1>}	H(C[6]C[6]O[6])	117.3420	0.000	1	118.4818	3.187	25	118.6212	1.466	58	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:O[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(O[6]C[6])(H)	C[6](C[6]C[6]O)(C[6]O[6]H)(H)	H(C[6]C[6]O[6])	C[6](C[6]C[6]H)(O[6]C[6])(H){1|H<1>,1|O<1>,2|C<4>}	C[6](C[6]C[6]O)(C[6]O[6]H)(H){1|C<4>,2|H<1>}	H(C[6]C[6]O[6])	118.0238	2.240	4	118.4818	3.187	25	118.6212	1.466	58	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:O[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(O[6]C[6])(H)	C[6](C[6]C[6]S)(C[6]O[6]H)(H)	H(C[6]C[6]O[6])	C[6](C[6]C[6]H)(O[6]C[6])(H){1|C<3>,1|C<4>,1|S<1>}	C[6](C[6]C[6]S)(C[6]O[6]H)(H){1|C<3>,1|O<2>}	H(C[6]C[6]O[6])	118.5255	0.109	4	118.6976	0.098	25	118.6212	1.466	58	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:O[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(O[6]C[6])(H)	C[6](C[6]C[6]S)(C[6]O[6]H)(H)	H(C[6]C[6]O[6])	C[6](C[6]C[6]H)(O[6]C[6])(H){1|C<3>,1|C<4>,1|S<2>}	C[6](C[6]C[6]S)(C[6]O[6]H)(H){1|C<3>,1|O<2>}	H(C[6]C[6]O[6])	118.7668	0.326	19	118.6976	0.098	25	118.6212	1.466	58	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:O[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(O[6]C[6])(H)	C[6](C[6]C[6]S)(C[6]O[6]H)(H)	H(C[6]C[6]O[6])	C[6](C[6]C[6]H)(O[6]C[6])(H){1|S<1>,2|C<3>}	C[6](C[6]C[6]S)(C[6]O[6]H)(H){1|C<3>,1|O<2>}	H(C[6]C[6]O[6])	118.3840	0.011	2	118.6976	0.098	25	118.6212	1.466	58	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:O[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(O[6]C[6])(H)	C[6](C[6]C[6]Se)(C[6]O[6]H)(H)	H(C[6]C[6]O[6])	C[6](C[6]C[6]H)(O[6]C[6])(H){1|Se<2>,1|C<3>,1|C<4>}	C[6](C[6]C[6]Se)(C[6]O[6]H)(H){1|C<3>,1|O<2>}	H(C[6]C[6]O[6])	119.1847	0.199	6	119.1847	0.040	6	118.6212	1.466	58	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:O[6]-2:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(O[6]C[6])(H)	C[6](C[6]O[6]H)(N[6]C[6]2)(H)	H(C[6]C[6]O[6])	C[6](C[6]N[6]H)(O[6]C[6])(H){1|C<3>,1|C<4>,2|H<1>}	C[6](C[6]O[6]H)(N[6]C[6]2)(H){1|C<4>,2|H<1>,2|N<2>}	H(C[6]C[6]O[6])	98.7914	0.000	1	98.7914	0.000	1	114.9278	129.051	4	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:O[6]-2:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(O[6]C[6])(H)	C[6](C[6]O[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]O[6])	C[6](C[6]N[6]H)(O[6]C[6])(H){1|H<1>,2|C<3>}	C[6](C[6]O[6]H)(N[6]C[6]C)(H){1|C<3>,1|H<1>}	H(C[6]C[6]O[6])	117.7270	0.209	2	120.3067	19.986	3	114.9278	129.051	4	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:O[6]-2:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(O[6]C[6])(H)	C[6](C[6]O[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]O[6])	C[6](C[6]N[6]H)(O[6]C[6])(H){1|H<1>,2|C<3>}	C[6](C[6]O[6]H)(N[6]C[6]C)(H){2|C<3>}	H(C[6]C[6]O[6])	125.4660	0.000	1	120.3067	19.986	3	114.9278	129.051	4	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:O[6]-2:H-1:	C[6]-3:O[6]-3:H-1:	C[6]-3:	C[6](C[6]O[6]H)(O[6]C[6])(H)	C[6](C[6]O[6]H)(O[6]C[6]W)(H)	H(C[6]C[6]O[6])	C[6](C[6]O[6]H)(O[6]C[6])(H){1|C<4>,1|W<6>,2|H<1>}	C[6](C[6]O[6]H)(O[6]C[6]W)(H){1|C<4>,2|H<1>}	H(C[6]C[6]O[6])	110.5220	0.000	1	110.5220	0.000	1	110.5220	0.000	1	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:S[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(S[6]C[6])(H)	C[6](C[6]C[5]C[6])(C[6]S[6]H)(H)	H(C[6]C[6]S[6])	C[6](C[6]C[6]H)(S[6]C[6])(H){1|H<1>,2|C<3>}	C[6](C[6]C[5]C[6])(C[6]S[6]H)(H){1|C<3>,1|H<1>,2|S<2>}	H(C[6]C[6]S[6])	117.9850	2.530	2	117.9850	6.401	2	117.9983	1.403	6	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:S[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(S[6]C[6])(H)	C[6](C[6]C[6]S)(C[6]S[6]H)(H)	H(C[6]C[6]S[6])	C[6](C[6]C[6]H)(S[6]C[6])(H){1|C<3>,1|C<4>,1|S<2>}	C[6](C[6]C[6]S)(C[6]S[6]H)(H){1|C<3>,1|O<2>}	H(C[6]C[6]S[6])	118.2170	0.195	3	118.0050	0.205	4	117.9983	1.403	6	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:1:	3:	C[6]-3:S[6]-2:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(S[6]C[6])(H)	C[6](C[6]C[6]S)(C[6]S[6]H)(H)	H(C[6]C[6]S[6])	C[6](C[6]C[6]H)(S[6]C[6])(H){1|S<2>,2|C<3>}	C[6](C[6]C[6]S)(C[6]S[6]H)(H){1|C<3>,1|O<2>}	H(C[6]C[6]S[6])	117.3690	0.000	1	118.0050	0.205	4	117.9983	1.403	6	119.0379	9.738	1419	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:2:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CC)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6])(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CC){1|Co<6>,1|C<3>}	H(C[6]C[6]2)	124.0070	0.000	1	124.0070	0.000	1	121.6158	11.608	5	118.8291	8.177	39	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:2:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(CC)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(CC){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.0160	0.000	1	119.0160	0.000	1	121.6158	11.608	5	118.8291	8.177	39	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:2:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6])(H)	C[6](C[6]C[6]Te)(C[6]C[6]H)(CN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6])(H){1|Te<5>,1|C<3>}	C[6](C[6]C[6]Te)(C[6]C[6]H)(CN){1|C<2>,1|H<1>}	H(C[6]C[6]2)	125.8060	0.000	1	125.8060	0.000	1	121.6158	11.608	5	118.8291	8.177	39	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:2:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6])(H)	C[6](C[6]C[6]H)2(CC)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6])(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CC){1|H<1>,1|N<2>}	H(C[6]C[6]2)	121.6830	0.000	1	119.6250	8.471	2	121.6158	11.608	5	118.8291	8.177	39	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:2:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6])(H)	C[6](C[6]C[6]H)2(CC)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6])(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(CC){1|H<1>,1|N<3>}	H(C[6]C[6]2)	117.5670	0.000	1	119.6250	8.471	2	121.6158	11.608	5	118.8291	8.177	39	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:2:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:C[6]-2:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6])(H)	C[6](C[6]C[6]2)(C[6]C[6]H)(C[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6])(H){1|C<2>,2|C<3>}	C[6](C[6]C[6]2)(C[6]C[6]H)(C[6]C[6]){1|N<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	122.8850	0.000	1	122.8850	0.000	1	122.8850	0.000	1	118.8291	8.177	39	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:2:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]C[6])(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]C[6])(H){1|Br<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(OH){1|C<3>,1|H<1>}	H(C[6]C[6]2)	118.5280	0.000	1	118.5280	0.000	1	118.6632	5.030	12	118.8291	8.177	39	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:2:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]C[6])(H){1|C<3>,1|C<4>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(OC){1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0000	0.000	1	120.0000	0.000	1	118.6632	5.030	12	118.8291	8.177	39	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:2:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]C[6]P)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]C[6])(H){1|C<3>,1|H<1>,1|P<4>}	C[6](C[6]C[6]H)(C[6]C[6]P)(OC){1|C<3>,1|H<1>}	H(C[6]C[6]2)	117.6290	0.000	1	117.6290	0.000	1	118.6632	5.030	12	118.8291	8.177	39	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:2:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]C[6]S)(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]C[6])(H){1|C<3>,1|O<2>,1|S<3>}	C[6](C[6]C[6]H)(C[6]C[6]S)(OH){1|C<3>,1|S<3>}	H(C[6]C[6]2)	118.8710	0.000	1	118.8710	0.000	1	118.6632	5.030	12	118.8291	8.177	39	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:2:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(OC){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.2170	0.000	1	119.8756	5.501	5	118.6632	5.030	12	118.8291	8.177	39	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:2:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]C[6])(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(OC){2|C<3>}	H(C[6]C[6]2)	120.0440	0.000	1	119.8756	5.501	5	118.6632	5.030	12	118.8291	8.177	39	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:2:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]C[6])(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(OC){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9225	4.624	2	119.8756	5.501	5	118.6632	5.030	12	118.8291	8.177	39	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:2:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]C[6])(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(OC){1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2720	0.000	1	119.8756	5.501	5	118.6632	5.030	12	118.8291	8.177	39	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:2:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(OP)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]C[6])(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(OP){1|C<3>,1|H<1>}	H(C[6]C[6]2)	114.0960	0.000	1	114.0960	0.000	1	118.6632	5.030	12	118.8291	8.177	39	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:2:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(OP[6])	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]C[6])(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(OP[6]){1|C<3>,1|H<1>}	H(C[6]C[6]2)	118.2040	0.000	1	118.2040	0.000	1	118.6632	5.030	12	118.8291	8.177	39	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:2:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]C[6])(H)	C[6](C[6]N[5a]C[6])(C[6]C[6]H)(OC[6a])	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[5a]C[6])(C[6]C[6]H)(OC[6a]){1|H<1>,3|C<3>}	H(C[6]C[6]2)	117.2520	0.000	1	117.2520	0.000	1	118.6632	5.030	12	118.8291	8.177	39	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:2:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]S)(C[6]C[6])(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(SMo)	H(C[6]C[6]2)	C[6](C[6]C[6]S)(C[6]C[6])(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]C[6]H)(SMo){1|C<3>,1|H<1>}	H(C[6]C[6]2)	113.6190	0.000	1	113.6190	0.000	1	116.7272	7.403	9	118.8291	8.177	39	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:2:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]S)(C[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]C[6]S)(SRu)	H(C[6]C[6]2)	C[6](C[6]C[6]S)(C[6]C[6])(H){1|C<2>,1|H<1>,1|S<2>}	C[6](C[6]C[6]H)(C[6]C[6]S)(SRu){1|C<3>}	H(C[6]C[6]2)	114.7380	0.000	1	116.1350	5.491	4	116.7272	7.403	9	118.8291	8.177	39	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:2:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]S)(C[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]C[6]S)(SRu)	H(C[6]C[6]2)	C[6](C[6]C[6]S)(C[6]C[6])(H){1|C<3>,1|H<1>,1|S<2>}	C[6](C[6]C[6]H)(C[6]C[6]S)(SRu){1|C<3>,1|H<1>}	H(C[6]C[6]2)	118.4070	0.000	1	116.1350	5.491	4	116.7272	7.403	9	118.8291	8.177	39	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:2:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]S)(C[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]C[6]S)(SRu)	H(C[6]C[6]2)	C[6](C[6]C[6]S)(C[6]C[6])(H){1|C<3>,1|S<2>}	C[6](C[6]C[6]H)(C[6]C[6]S)(SRu){1|C<2>,1|H<1>}	H(C[6]C[6]2)	115.6975	2.996	2	116.1350	5.491	4	116.7272	7.403	9	118.8291	8.177	39	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:2:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]S)(C[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]N[6]S)(SNi)	H(C[6]C[6]2)	C[6](C[6]C[6]S)(C[6]C[6])(H){1|H<1>,1|N<2>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]S)(SNi){1|C<3>}	H(C[6]C[6]2)	115.0790	0.000	1	115.0790	0.000	1	116.7272	7.403	9	118.8291	8.177	39	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:2:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]S)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(SC[6,6])	H(C[6]C[6]2)	C[6](C[6]C[6]S)(C[6]C[6])(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(SC[6,6]){1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7820	0.000	1	120.7820	0.000	1	116.7272	7.403	9	118.8291	8.177	39	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:2:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]S)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(SPd)	H(C[6]C[6]2)	C[6](C[6]C[6]S)(C[6]C[6])(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(SPd){1|C<3>,1|H<1>}	H(C[6]C[6]2)	116.2860	0.000	1	116.2860	0.000	1	116.7272	7.403	9	118.8291	8.177	39	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:2:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]S)(C[6]N[6])(H)	C[6](C[6]C[6]H)2(SC)	H(C[6]C[6]2)	C[6](C[6]C[6]S)(C[6]N[6])(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(SC){1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.2390	0.000	1	120.2390	0.000	1	116.7272	7.403	9	118.8291	8.177	39	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:2:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:Se-2:	C[6]-3:	C[6](C[6]C[6]Se)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(SeC[6a])	H(C[6]C[6]2)	C[6](C[6]C[6]Se)(C[6]C[6])(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(SeC[6a]){1|C<3>,1|H<1>}	H(C[6]C[6]2)	118.1120	4.521	2	118.1120	20.442	2	118.1120	20.442	2	118.8291	8.177	39	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:2:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:N-3:C[6]-2:	C[6]-3:	C[6](C[6]C[6]N)(C[6]C[6])(H)	C[6](C[6]C[6]H)(NC[6a]Si)(C[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]C[6])(H){1|C<3>}	C[6](C[6]C[6]H)(NC[6a]Si)(C[6]C[6]){1|C<2>,1|H<1>}	H(C[6]C[6]2)	120.6530	0.000	1	120.6530	0.000	1	120.6530	0.000	1	118.8291	8.177	39	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:2:	3:	C[6]-3:C[6]-2:H-1:	C[6a]-3:C[6]-3:C[6]-2:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6])(H){1|C<2>,1|H<1>,2|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]C[6]){1|Te<2>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.5830	0.000	1	119.5830	0.000	1	121.2250	5.392	2	118.8291	8.177	39	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:2:	3:	C[6]-3:C[6]-2:H-1:	C[6a]-3:C[6]-3:C[6]-2:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6])(H)	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)(C[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6])(H){1|Mn<6>,1|N<2>,2|C<3>}	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)(C[6]C[6]){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	122.8670	0.000	1	122.8670	0.000	1	121.2250	5.392	2	118.8291	8.177	39	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:2:	3:	C[6]-3:C[6]-2:H-1:	C[6a]-3:C[6]-3:N[6]-2:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6])(H)	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)(N[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6])(H){1|H<1>,1|N<2>,2|C<3>}	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)(N[6]C[6]){1|H<1>,1|N<2>,3|C<3>}	H(C[6]C[6]2)	120.4820	0.000	1	120.4820	0.000	1	120.4820	0.000	1	118.8291	8.177	39	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:2:	3:	C[6]-3:C[6]-2:H-1:	N[5a]-3:C[6]-3:C[6]-2:	C[6]-3:	C[6](C[6]N[5a]C[6])(C[6]C[6])(H)	C[6](N[5a]C[5a]2)(C[6]C[6]H)(C[6]C[6])	H(C[6]C[6]2)	C[6](C[6]N[5a]C[6])(C[6]C[6])(H){1|N<3>,3|C<3>}	C[6](N[5a]C[5a]2)(C[6]C[6]H)(C[6]C[6]){1|N<2>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	120.5270	0.000	1	120.5270	0.000	1	120.5270	0.000	1	118.8291	8.177	39	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:2:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(N[6]N[6])(H)	C[6](C[6]C[6]Br)(C[6]N[6]H)(OH)	H(C[6]C[6]N[6])	C[6](C[6]C[6]O)(N[6]N[6])(H){1|Br<1>,1|C<3>,1|H<1>}	C[6](C[6]C[6]Br)(C[6]N[6]H)(OH){1|H<1>,1|N<3>}	H(C[6]C[6]N[6])	117.9030	0.000	1	117.9030	0.000	1	117.9030	0.000	1	118.8291	8.177	39	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:2:	3:	C[6]-3:N[6]-2:H-1:	C[6a]-3:C[6]-3:N[6]-2:	C[6]-3:	C[6](C[6]C[6a]N[6])(N[6]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]N[6]H)(N[6]C[6])	H(C[6]C[6]N[6])	C[6](C[6]C[6a]N[6])(N[6]N[6])(H){1|Pt<4>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]N[6]H)(N[6]C[6]){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]N[6])	117.1710	0.000	1	117.1710	0.000	1	117.1710	0.000	1	118.8291	8.177	39	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:2:	3:	C[6]-3:O[6]-2:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(O[6]C[6])(H)	C[6](C[6]C[6]S)(C[6]O[6]H)(OZn)	H(C[6]C[6]O[6])	C[6](C[6]C[6]O)(O[6]C[6])(H){1|C<3>,1|C<4>,1|S<2>}	C[6](C[6]C[6]S)(C[6]O[6]H)(OZn){1|C<3>,1|H<1>}	H(C[6]C[6]O[6])	118.1890	0.000	1	118.1890	0.000	1	118.1890	0.000	1	118.8291	8.177	39	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:2:	3:	C[6]-3:O[6]-2:H-1:	C[6]-3:C[6]-3:O[6]-2:	C[6]-3:	C[6](C[6]C[6]O[6])(O[6]C[6])(H)	C[6](C[6]C[6]2)(C[6]O[6]H)(O[6]C[6])	H(C[6]C[6]O[6])	C[6](C[6]C[6]O[6])(O[6]C[6])(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[6]2)(C[6]O[6]H)(O[6]C[6]){1|C<3>,3|H<1>,4|C<4>}	H(C[6]C[6]O[6])	117.3130	0.000	1	117.3130	0.000	1	117.3130	0.000	1	118.8291	8.177	39	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:2:	3:	C[6]-3:S[6]-2:H-1:	C[6a]-3:C[6]-3:S[6]-2:	C[6]-3:	C[6](C[6]C[6a]S[6])(S[6]C[6])(H)	C[6](C[6a]C[6a]2)(C[6]S[6]H)(S[6]C[6])	H(C[6]C[6]S[6])	C[6](C[6]C[6a]S[6])(S[6]C[6])(H){1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]S[6]H)(S[6]C[6]){2|H<1>,4|C<3>}	H(C[6]C[6]S[6])	117.9540	0.000	1	117.9540	0.000	1	117.9540	0.000	1	118.8291	8.177	39	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:C[6]-2:H-1:	C-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6])(H)	C[6](CC[5a]C[5])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6])(H){1|C<3>,1|H<1>,1|O<2>}	C[6](CC[5a]C[5])(C[6]C[6]H)2{1|C<3>,1|H<1>}	H(C[6]C[6]2)	118.3320	0.000	1	118.3320	0.000	1	117.5875	1.109	2	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:C[6]-2:H-1:	C-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6])(H)	C[6](CC[6a]C[5])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6])(H){1|C<3>,2|H<1>}	C[6](CC[6a]C[5])(C[6]C[6]H)2{1|C<3>,1|H<1>}	H(C[6]C[6]2)	116.8430	0.000	1	116.8430	0.000	1	117.5875	1.109	2	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:C[6]-2:H-1:	C[5]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6])(H)	C[6](C[5]C[5]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6])(H){2|H<1>,3|C<3>}	C[6](C[5]C[5]2)(C[6]C[6]H)2{2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.5280	0.225	2	120.5280	0.051	2	118.9068	9.648	4	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:C[6]-2:H-1:	C[5]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6])(H)	C[6](C[5]N[5]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6])(H){1|C<3>,1|N<2>,1|N<3>,2|H<1>}	C[6](C[5]N[5]2)(C[6]C[6]H)2{1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	114.2540	0.000	1	114.2540	0.000	1	118.9068	9.648	4	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:C[6]-2:H-1:	C[5]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6])(H)	C[6](C[5]N[5]S[5])(C[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6])(H){1|Ir<6>,1|C<3>,1|H<1>,1|N<3>,1|S<2>}	C[6](C[5]N[5]S[5])(C[6]C[6]Ir)(C[6]C[6]H){1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.3170	0.000	1	120.3170	0.000	1	118.9068	9.648	4	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:C[6]-2:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6])(H)	C[6](C[5a]C[5a,6]C[5a])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6])(H){1|H<1>,3|C<3>}	C[6](C[5a]C[5a,6]C[5a])(C[6]C[6]H)2{1|Br<1>,1|C<2>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	117.4030	0.000	1	118.8785	4.354	2	118.5217	4.177	4	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:C[6]-2:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6])(H)	C[6](C[5a]C[5a,6]C[5a])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6])(H){2|H<1>,3|C<3>}	C[6](C[5a]C[5a,6]C[5a])(C[6]C[6]H)2{1|Br<1>,1|H<1>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.3540	0.000	1	118.8785	4.354	2	118.5217	4.177	4	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:C[6]-2:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6])(H)	C[6](C[5a]C[5a]N[5a])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6])(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[5a]C[5a]N[5a])(C[6]C[6]H)2{1|C<4>,1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	116.2070	0.000	1	116.2070	0.000	1	118.5217	4.177	4	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:C[6]-2:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6])(H)	C[6](C[5a]N[5a]O[5a])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6])(H){1|C<3>,1|N<2>,1|O<2>,2|H<1>}	C[6](C[5a]N[5a]O[5a])(C[6]C[6]H)2{1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.1230	0.000	1	120.1230	0.000	1	118.5217	4.177	4	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:C[6]-2:H-1:	C[6,6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]C[6])(C[6]C[6])(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]C[6])(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C[6])(C[6]C[6])(H){1|H<1>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]C[6])(C[6]C[6]H){2|H<1>,6|C<3>}	H(C[6]C[6]2)	118.1590	0.000	1	118.1590	0.000	1	118.1590	0.000	1	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:C[6]-2:H-1:	C[6,6a]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6,6a]N)(C[6]C[6])(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(NRh2)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]N)(C[6]C[6])(H){1|H<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(NRh2){1|N<3>,3|C<3>}	H(C[6]C[6]2)	119.9360	0.000	1	119.9360	0.000	1	119.9360	0.000	1	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(CHN){1|C<3>,1|H<1>}	H(C[6]C[6]2)	114.4990	0.000	1	114.4990	0.000	1	119.0131	6.219	25	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(COO){1|C<3>,1|H<1>}	H(C[6]C[6]2)	116.2440	0.000	1	116.2440	0.000	1	119.0131	6.219	25	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6])(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CHN){1|C<3>,1|H<1>}	H(C[6]C[6]2)	117.6830	0.485	2	117.6830	0.235	2	119.0131	6.219	25	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6])(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(COO){1|C<3>,1|H<1>}	H(C[6]C[6]2)	116.8370	0.000	1	116.8370	0.000	1	119.0131	6.219	25	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6])(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|Cd<6>,1|C<3>}	H(C[6]C[6]2)	121.1840	0.000	1	121.1845	0.000	2	119.0131	6.219	25	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6])(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|Pd<4>,1|C<3>}	H(C[6]C[6]2)	121.1850	0.000	1	121.1845	0.000	2	119.0131	6.219	25	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(CCC)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6])(H){1|C<2>,2|H<1>}	C[6](C[6]C[6]H)2(CCC){1|C<3>}	H(C[6]C[6]2)	121.1380	0.000	1	119.2356	3.248	5	119.0131	6.219	25	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(CCC)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6])(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(CCC){1|C<3>,1|C<4>}	H(C[6]C[6]2)	119.9620	0.429	2	119.2356	3.248	5	119.0131	6.219	25	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(CCC)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6])(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(CCC){1|C<3>,1|H<1>}	H(C[6]C[6]2)	117.5580	1.583	2	119.2356	3.248	5	119.0131	6.219	25	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6])(H){1|Br<1>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CCH){1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0840	0.000	1	119.2297	2.719	3	119.0131	6.219	25	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6])(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(CCH){1|C<3>,1|H<1>}	H(C[6]C[6]2)	118.8025	2.084	2	119.2297	2.719	3	119.0131	6.219	25	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6])(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(CCN){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.6740	2.172	2	119.6740	4.719	2	119.0131	6.219	25	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(CCO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6])(H){1|Br<1>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CCO){1|C<3>,1|H<1>}	H(C[6]C[6]2)	122.2990	0.000	1	122.2990	0.000	1	119.0131	6.219	25	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(CC[3]H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6])(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(CC[3]H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	115.5100	0.000	1	115.5100	0.000	1	119.0131	6.219	25	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(CC[6a]C)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6])(H){1|C<2>,2|H<1>}	C[6](C[6]C[6]H)2(CC[6a]C){1|C<3>}	H(C[6]C[6]2)	118.3800	6.545	2	119.5347	25.418	3	119.0131	6.219	25	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(CC[6a]C)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6])(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(CC[6a]C){1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.8440	0.000	1	119.5347	25.418	3	119.0131	6.219	25	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6])(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(CHN){1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0050	0.000	1	119.8745	0.034	2	119.0131	6.219	25	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6])(H){1|Cl<1>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CHN){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.7440	0.000	1	119.8745	0.034	2	119.0131	6.219	25	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6])(H)	C[6](C[6]C[6]H)2(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6])(H){1|Pt<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(COO){1|C<3>,1|N<3>}	H(C[6]C[6]2)	120.6360	0.000	1	120.6360	0.000	1	119.0131	6.219	25	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6])(H)	C[6](C[6]C[5a,6]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6])(H){2|H<1>,3|C<3>}	C[6](C[6]C[5a,6]2)(C[6]C[6]H)2{1|H<1>,2|N<3>,3|C<3>}	H(C[6]C[6]2)	116.5890	0.000	1	116.5890	0.000	1	118.5323	38.167	6	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6])(H)	C[6](C[6]C[6]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6])(H){1|C<2>,1|C<3>,1|C<4>,2|H<1>}	C[6](C[6]C[6]2)(C[6]C[6]H)2{1|C<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.2650	0.361	2	118.4020	2.299	3	118.5323	38.167	6	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6])(H)	C[6](C[6]C[6]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6])(H){2|H<1>,3|C<3>}	C[6](C[6]C[6]2)(C[6]C[6]H)2{1|Te<2>,1|C<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	116.6760	0.000	1	118.4020	2.299	3	118.5323	38.167	6	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6])(H)	C[6](C[6]C[6]Te)(C[6]C[6]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6])(H){1|Te<2>,1|H<1>,3|C<3>}	C[6](C[6]C[6]Te)(C[6]C[6]2)(C[6]C[6]H){1|C<2>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	110.2210	0.000	1	110.2210	0.000	1	118.5323	38.167	6	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6])(H)	C[6](C[6]C[6]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6])(H){1|H<1>,3|C<3>}	C[6](C[6]C[6]2)(C[6]C[6]H)2{1|C<2>,1|C<3>,1|N<2>,3|H<1>}	H(C[6]C[6]2)	129.1780	0.000	1	129.1780	0.000	1	118.5323	38.167	6	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]C[6])(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]C[6])(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(NCH){1|C<3>,1|H<1>}	H(C[6]C[6]2)	116.4770	0.000	1	116.4770	0.000	1	121.1364	22.398	13	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]C[6])(H)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]C[6])(H){1|Cl<1>,1|C<2>,1|H<1>}	C[6](C[6]C[6]Cl)(C[6]C[6]H)(NCH){1|C<3>}	H(C[6]C[6]2)	121.0200	0.000	1	121.0200	0.000	1	121.1364	22.398	13	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(NCuC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]C[6])(H){1|C<3>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(NCuC){1|C<2>,1|H<1>}	H(C[6]C[6]2)	119.8160	0.000	1	119.8160	0.000	1	121.1364	22.398	13	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(NMoC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(NMoC){1|C<3>,1|H<1>}	H(C[6]C[6]2)	112.4420	0.000	1	112.4420	0.000	1	121.1364	22.398	13	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(NZnC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(NZnC){1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.9630	0.000	1	121.9630	0.000	1	121.1364	22.398	13	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]C[6])(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NHH){1|C<3>,1|H<1>}	H(C[6]C[6]2)	122.3870	0.000	1	122.3870	0.000	1	121.1364	22.398	13	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]C[6])(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(NCH){1|C<3>,1|H<1>}	H(C[6]C[6]2)	123.1040	0.000	1	122.2020	1.627	2	121.1364	22.398	13	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]C[6])(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(NCH){1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.3000	0.000	1	122.2020	1.627	2	121.1364	22.398	13	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(NC[6]2)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]C[6])(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(NC[6]2){1|C<3>,1|H<1>}	H(C[6]C[6]2)	129.0880	0.000	2	129.0880	0.000	2	121.1364	22.398	13	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(NC[6]Cu)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]C[6])(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(NC[6]Cu){1|C<3>,1|H<1>}	H(C[6]C[6]2)	115.5090	0.000	1	115.5090	0.000	1	121.1364	22.398	13	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(NOO)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(NOO){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.6460	0.000	1	121.2895	5.402	2	121.1364	22.398	13	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(NOO)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]C[6])(H){1|C<3>,1|H<1>,1|N<4>}	C[6](C[6]C[6]H)2(NOO){1|C<3>,1|H<1>}	H(C[6]C[6]2)	122.9330	0.000	1	121.2895	5.402	2	121.1364	22.398	13	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:N[5]-3:	C[6]-3:	C[6](C[6]C[6]N[5])(C[6]C[6])(H)	C[6](C[6]C[6]H)2(N[5]C[5]2)	H(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]C[6])(H){1|H<1>,1|I<1>,3|C<3>}	C[6](C[6]C[6]H)2(N[5]C[5]2){1|C<4>,1|H<1>,1|O<1>,1|O<2>,2|C<3>}	H(C[6]C[6]2)	112.6470	0.000	1	112.6470	0.000	1	112.6470	0.000	1	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6])(H)	C[6](C[6]C[6]H)2(N[6]C[6]2)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6])(H){1|Cl<1>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(N[6]C[6]2){1|H<1>,2|O<1>,3|C<3>}	H(C[6]C[6]2)	119.4900	0.000	1	119.4900	0.000	1	119.4900	0.000	1	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:P-3:	C[6]-3:	C[6](C[6]C[6]P)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(PC[6]C)	H(C[6]C[6]2)	C[6](C[6]C[6]P)(C[6]C[6])(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(PC[6]C){1|C<3>,1|H<1>}	H(C[6]C[6]2)	114.3600	0.000	1	114.3600	0.000	1	114.3600	0.000	1	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6,6a])(H)	C[6](C[6]C[6,6a]H)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6,6a])(H){1|H<1>,4|C<3>}	C[6](C[6]C[6,6a]H)(C[6a]C[6a]2)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	118.8750	0.000	1	118.8750	0.000	1	118.8750	0.000	1	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6])(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Co)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6])(H){1|Co<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Co)(C[6]C[6]H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	121.0800	0.000	1	121.0800	0.000	1	119.4817	31.476	6	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6])(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6])(H){1|Cu<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H){2|H<1>,3|C<3>}	H(C[6]C[6]2)	110.5100	0.000	1	110.5100	0.000	1	119.4817	31.476	6	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6])(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Mn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6])(H){1|Mn<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Mn)(C[6]C[6]H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	125.0870	0.000	1	125.0870	0.000	1	119.4817	31.476	6	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6])(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6])(H){1|Pd<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Pd)(C[6]C[6]H){2|H<1>,3|C<3>}	H(C[6]C[6]2)	118.8370	0.000	1	118.8370	0.000	1	119.4817	31.476	6	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6])(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6])(H){1|Ru<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(C[6]C[6]H){2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.6880	6.292	2	120.6880	39.587	2	119.4817	31.476	6	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:N[6]-3:N-3:	C[6]-3:	C[6](C[6]N[6]N)(C[6]C[6])(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]N[6]N)(C[6]C[6])(H){1|Br<1>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(NHH){1|C<3>,1|N<3>}	H(C[6]C[6]2)	111.2500	0.000	1	111.2500	0.000	1	111.2500	0.000	1	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:C[6]-2:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]C)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6])(H){1|C<5>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]C)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	108.2590	0.000	1	108.2590	0.000	1	112.9790	44.557	2	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:C[6]-2:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6])(H){2|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|P<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	117.6990	0.000	1	117.6990	0.000	1	112.9790	44.557	2	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:C[6]-2:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6])(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6])(H){1|Pd<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Pd)(C[6]C[6]H){2|H<1>,3|C<3>}	H(C[6]C[6]2)	118.3090	0.000	1	118.3090	0.000	1	118.3090	0.000	1	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:C[6]-2:H-1:	Ga-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]Ga)(C[6]C[6])(H)	C[6](GaC[6a]N[5])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]Ga)(C[6]C[6])(H){1|C<3>,2|H<1>}	C[6](GaC[6a]N[5])(C[6]C[6]H)2{1|C<3>,1|H<1>}	H(C[6]C[6]2)	117.3100	0.000	1	117.3100	0.000	1	117.3100	0.000	1	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:C[6]-2:H-1:	N[5]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[5])(C[6]C[6])(H)	C[6](N[5]C[5]N[5])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]C[6])(H){1|H<1>,1|N<2>,1|O<2>,2|C<3>}	C[6](N[5]C[5]N[5])(C[6]C[6]H)2{1|C<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.6250	0.000	1	119.6250	0.000	1	119.6250	0.000	1	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:C[6]-2:H-1:	N[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5a]C[6])(C[6]C[6])(H)	C[6](N[5a]C[5a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]N[5a]C[6])(C[6]C[6])(H){2|H<1>,3|C<3>}	C[6](N[5a]C[5a]2)(C[6]C[6]H)2{1|H<1>,5|C<3>}	H(C[6]C[6]2)	116.9050	0.000	1	116.9050	0.000	1	118.0597	4.497	3	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:C[6]-2:H-1:	N[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5a]C[6])(C[6]N[6])(H)	C[6](N[5a]C[5a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]N[5a]C[6])(C[6]N[6])(H){1|C<2>,1|H<1>,2|C<3>}	C[6](N[5a]C[5a]2)(C[6]C[6]H)2{1|N<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	118.6370	2.645	2	118.6370	6.994	2	118.0597	4.497	3	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:C[6]-2:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]N[6]C)(C[6]C[6])(H)	C[6](N[6]C[6]Al)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]N[6]C)(C[6]C[6])(H){1|Al<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Al)(C[6]C[6]H)(CCN){1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1700	0.000	1	120.1700	0.000	1	115.8107	17.905	3	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:C[6]-2:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]N[6]C)(C[6]C[6])(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CCH)	H(C[6]C[6]2)	C[6](C[6]N[6]C)(C[6]C[6])(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CCH){1|C<3>,1|H<1>}	H(C[6]C[6]2)	111.7200	0.000	1	111.7200	0.000	1	115.8107	17.905	3	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:C[6]-2:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]N[6]C)(C[6]C[6])(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]N[6]C)(C[6]C[6])(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CHN){1|C<3>,1|H<1>}	H(C[6]C[6]2)	115.5420	0.000	1	115.5420	0.000	1	115.8107	17.905	3	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:C[6]-2:H-1:	N[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[6a]C[6])(C[6]C[6])(H)	C[6](N[6a]C[6a]2)(C[6]C[6]Cl)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[6a]C[6])(C[6]C[6])(H){1|Cl<1>,1|H<1>,3|C<3>}	C[6](N[6a]C[6a]2)(C[6]C[6]Cl)(C[6]C[6]H){1|H<1>,2|C<4>,3|C<3>}	H(C[6]C[6]2)	121.0900	0.000	1	121.0900	0.000	1	121.0900	0.000	1	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:N[6]-2:H-1:	C[5]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(N[6]C[6])(H)	C[6](C[5]N[5]2)(C[6]N[6]H)(N[6]C[6]O)	H(C[6]C[6]N[6])	C[6](C[6]C[5]N[6])(N[6]C[6])(H){1|C<3>,1|H<1>,1|O<1>,2|N<3>}	C[6](C[5]N[5]2)(C[6]N[6]H)(N[6]C[6]O){1|C<3>,1|H<1>,2|C<4>,2|O<1>}	H(C[6]C[6]N[6])	117.8660	0.000	1	117.8660	0.000	1	117.8660	0.000	1	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:N[6]-2:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(N[6]C[6])(H)	C[6](C[5]C[5]N[5])(N[6]C[6]Cd)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[5]N[6])(N[6]C[6])(H){1|Cd<7>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5]C[5]N[5])(N[6]C[6]Cd)(C[6]N[6]H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]N[6])	118.5460	0.000	1	118.5460	0.000	1	118.6073	0.003	3	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:N[6]-2:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(N[6]C[6])(H)	C[6](C[5]C[5]N[5])(N[6]C[6]Cu)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[5]N[6])(N[6]C[6])(H){1|Cu<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5]C[5]N[5])(N[6]C[6]Cu)(C[6]N[6]H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]N[6])	118.6120	0.000	1	118.6380	0.001	2	118.6073	0.003	3	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:N[6]-2:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(N[6]C[6])(H)	C[6](C[5]C[5]N[5])(N[6]C[6]Cu)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[5]N[6])(N[6]C[6])(H){1|Cu<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5]C[5]N[5])(N[6]C[6]Cu)(C[6]N[6]H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]N[6])	118.6640	0.000	1	118.6380	0.001	2	118.6073	0.003	3	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:N[6]-2:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(N[6]C[6])(H)	C[6](C[5a]N[5a]2)(N[6]C[6]Cd)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[5a]N[6])(N[6]C[6])(H){1|Cd<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[5a]N[5a]2)(N[6]C[6]Cd)(C[6]N[6]H){1|C<3>,1|H<1>,2|N<2>}	H(C[6]C[6]N[6])	118.6760	0.000	1	118.6760	0.000	1	118.7852	0.090	18	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:N[6]-2:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(N[6]C[6])(H)	C[6](C[5a]N[5a]2)(N[6]C[6]Co)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[5a]N[6])(N[6]C[6])(H){1|Co<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[5a]N[5a]2)(N[6]C[6]Co)(C[6]N[6]H){1|C<3>,1|H<1>,2|N<2>}	H(C[6]C[6]N[6])	118.7410	0.000	1	118.7590	0.008	3	118.7852	0.090	18	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:N[6]-2:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(N[6]C[6])(H)	C[6](C[5a]N[5a]2)(N[6]C[6]Co)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[5a]N[6])(N[6]C[6])(H){1|Co<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[5a]N[5a]2)(N[6]C[6]Co)(C[6]N[6]H){1|H<1>,1|N<2>,2|C<3>}	H(C[6]C[6]N[6])	118.7680	0.124	2	118.7590	0.008	3	118.7852	0.090	18	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:N[6]-2:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(N[6]C[6])(H)	C[6](C[5a]N[5a]2)(N[6]C[6]Cu)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[5a]N[6])(N[6]C[6])(H){1|Cu<5>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[5a]N[5a]2)(N[6]C[6]Cu)(C[6]N[6]H){1|H<1>,1|N<2>,2|C<3>}	H(C[6]C[6]N[6])	118.7150	0.000	1	119.0352	0.071	5	118.7852	0.090	18	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:N[6]-2:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(N[6]C[6])(H)	C[6](C[5a]N[5a]2)(N[6]C[6]Cu)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[5a]N[6])(N[6]C[6])(H){1|Cu<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[5a]N[5a]2)(N[6]C[6]Cu)(C[6]N[6]H){1|C<3>,1|H<1>,2|N<2>}	H(C[6]C[6]N[6])	119.1153	0.227	4	119.0352	0.071	5	118.7852	0.090	18	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:N[6]-2:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(N[6]C[6])(H)	C[6](C[5a]N[5a]2)(N[6]C[6]Fe)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[5a]N[6])(N[6]C[6])(H){1|Fe<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[5a]N[5a]2)(N[6]C[6]Fe)(C[6]N[6]H){1|C<3>,1|H<1>,2|N<2>}	H(C[6]C[6]N[6])	118.7970	0.000	1	118.7970	0.000	1	118.7852	0.090	18	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:N[6]-2:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(N[6]C[6])(H)	C[6](C[5a]N[5a]2)(N[6]C[6]Ir)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[5a]N[6])(N[6]C[6])(H){1|Ir<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[5a]N[5a]2)(N[6]C[6]Ir)(C[6]N[6]H){1|C<3>,1|H<1>,2|N<2>}	H(C[6]C[6]N[6])	118.5940	0.000	1	118.5940	0.000	1	118.7852	0.090	18	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:N[6]-2:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(N[6]C[6])(H)	C[6](C[5a]N[5a]2)(N[6]C[6]Mn)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[5a]N[6])(N[6]C[6])(H){1|Mn<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[5a]N[5a]2)(N[6]C[6]Mn)(C[6]N[6]H){1|C<3>,1|H<1>,2|N<2>}	H(C[6]C[6]N[6])	118.8425	0.060	2	118.8425	0.004	2	118.7852	0.090	18	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:N[6]-2:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(N[6]C[6])(H)	C[6](C[5a]N[5a]2)(N[6]C[6]Ni)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[5a]N[6])(N[6]C[6])(H){1|Ni<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[5a]N[5a]2)(N[6]C[6]Ni)(C[6]N[6]H){1|C<3>,1|H<1>,2|N<2>}	H(C[6]C[6]N[6])	118.8990	0.000	1	118.8990	0.000	1	118.7852	0.090	18	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:N[6]-2:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(N[6]C[6])(H)	C[6](C[5a]N[5a]2)(N[6]C[6]Ru)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[5a]N[6])(N[6]C[6])(H){1|Ru<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[5a]N[5a]2)(N[6]C[6]Ru)(C[6]N[6]H){1|C<3>,1|H<1>,2|N<2>}	H(C[6]C[6]N[6])	117.8920	0.000	1	118.3455	0.411	2	118.7852	0.090	18	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:N[6]-2:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(N[6]C[6])(H)	C[6](C[5a]N[5a]2)(N[6]C[6]Ru)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[5a]N[6])(N[6]C[6])(H){1|Ru<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[5a]N[5a]2)(N[6]C[6]Ru)(C[6]N[6]H){1|H<1>,1|N<2>,2|C<3>}	H(C[6]C[6]N[6])	118.7990	0.000	1	118.3455	0.411	2	118.7852	0.090	18	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:N[6]-2:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(N[6]C[6])(H)	C[6](C[5a]N[5a]2)(N[6]C[6]Zn)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[5a]N[6])(N[6]C[6])(H){1|Zn<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[5a]N[5a]2)(N[6]C[6]Zn)(C[6]N[6]H){1|C<3>,1|H<1>,2|N<2>}	H(C[6]C[6]N[6])	118.6695	0.139	2	118.6695	0.019	2	118.7852	0.090	18	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CHH)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6])(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CHH){2|C<3>}	H(C[6]C[6]N[6])	118.6040	0.000	1	118.6040	0.000	1	118.2990	0.566	7	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6])(H)	C[6](C[6]N[6]H)(C[6]N[6]O)(COO)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6])(H){1|N<3>,2|O<1>}	C[6](C[6]N[6]H)(C[6]N[6]O)(COO){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5260	0.000	1	118.5260	0.000	1	118.2990	0.566	7	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6])(H)	C[6](C[6]N[6]H)2(COO)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6])(H){1|N<3>,2|H<1>}	C[6](C[6]N[6]H)2(COO){1|Pt<4>,1|C<3>}	H(C[6]C[6]N[6])	118.6953	0.219	3	118.6953	0.048	3	118.2990	0.566	7	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(N[6]N[6])(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CCH)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]N[6])(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CCH){1|H<1>,1|N<3>}	H(C[6]C[6]N[6])	116.6630	0.000	1	116.6630	0.000	1	118.2990	0.566	7	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(N[6]N[6])(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]N[6])(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|H<1>,1|N<3>}	H(C[6]C[6]N[6])	118.2140	0.000	1	118.2140	0.000	1	118.2990	0.566	7	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(N[6]C[6])(H)	C[6](C[6]N[6]H)(C[6]N[6]O)(NOO)	H(C[6]C[6]N[6])	C[6](C[6]C[6]N)(N[6]C[6])(H){1|N<3>,2|O<1>}	C[6](C[6]N[6]H)(C[6]N[6]O)(NOO){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.1947	0.317	3	117.1947	0.101	3	117.1947	0.101	3	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(N[6]C[6,6a])(H)	C[6](C[6]N[6,6a]C[6a])(C[6a]C[6a]2)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[6a]C[6])(N[6]C[6,6a])(H){1|N<3>,4|C<3>}	C[6](C[6]N[6,6a]C[6a])(C[6a]C[6a]2)(C[6]N[6]H){2|H<1>,6|C<3>}	H(C[6]C[6]N[6])	117.0860	0.000	1	117.0860	0.000	1	117.0860	0.000	1	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(N[6]C[6])(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ag)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]N[6])(N[6]C[6])(H){1|Ag<4>,1|C<2>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ag)(C[6]N[6]H){2|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.9475	0.211	2	118.9475	0.045	2	118.7715	0.052	39	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(N[6]C[6])(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Co)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]N[6])(N[6]C[6])(H){1|Co<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Co)(C[6]N[6]H){2|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.7437	0.191	6	118.7437	0.036	6	118.7715	0.052	39	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(N[6]C[6])(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]N[6])(N[6]C[6])(H){1|Cu<3>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]N[6]H){2|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.9150	0.000	1	118.8693	0.011	6	118.7715	0.052	39	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(N[6]C[6])(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]N[6])(N[6]C[6])(H){1|Cu<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]N[6]H){2|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.7230	0.000	1	118.8693	0.011	6	118.7715	0.052	39	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(N[6]C[6])(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]N[6])(N[6]C[6])(H){1|Cu<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]N[6]H){2|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.8945	0.099	4	118.8693	0.011	6	118.7715	0.052	39	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(N[6]C[6])(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Fe)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]N[6])(N[6]C[6])(H){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Fe)(C[6]N[6]H){2|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.8900	0.238	4	118.8900	0.057	4	118.7715	0.052	39	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(N[6]C[6])(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ir)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]N[6])(N[6]C[6])(H){1|Ir<6>,1|N<3>,3|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ir)(C[6]N[6]H){2|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.4450	0.000	1	118.4450	0.000	1	118.7715	0.052	39	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(N[6]C[6])(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Mn)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]N[6])(N[6]C[6])(H){1|Mn<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Mn)(C[6]N[6]H){1|N<2>,2|C<3>,2|H<1>}	H(C[6]C[6]N[6])	118.7790	0.126	2	118.7790	0.016	2	118.7715	0.052	39	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(N[6]C[6])(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Re)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]N[6])(N[6]C[6])(H){1|Re<6>,1|C<4>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Re)(C[6]N[6]H){1|N<2>,2|C<3>,2|H<1>}	H(C[6]C[6]N[6])	118.3385	0.005	2	118.6570	0.116	8	118.7715	0.052	39	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(N[6]C[6])(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Re)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]N[6])(N[6]C[6])(H){1|Re<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Re)(C[6]N[6]H){1|N<2>,2|C<3>,2|H<1>}	H(C[6]C[6]N[6])	118.7632	0.329	6	118.6570	0.116	8	118.7715	0.052	39	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(N[6]C[6])(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]N[6])(N[6]C[6])(H){1|Ru<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(C[6]N[6]H){2|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.5910	0.049	2	118.6553	0.022	6	118.7715	0.052	39	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(N[6]C[6])(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]N[6])(N[6]C[6])(H){1|Ru<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(C[6]N[6]H){1|N<2>,2|C<3>,2|H<1>}	H(C[6]C[6]N[6])	118.6875	0.178	4	118.6553	0.022	6	118.7715	0.052	39	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(N[6]C[6])(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Zn)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]N[6])(N[6]C[6])(H){1|Zn<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Zn)(C[6]N[6]H){2|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.9410	0.072	4	118.9410	0.005	4	118.7715	0.052	39	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:N[6]-3:N-3:	C[6]-3:	C[6](C[6]N[6]N)(N[6]C[6])(H)	C[6](C[6]N[6]H)(N[6]C[6]H)(NHH)	H(C[6]C[6]N[6])	C[6](C[6]N[6]N)(N[6]C[6])(H){1|C<3>,2|H<1>}	C[6](C[6]N[6]H)(N[6]C[6]H)(NHH){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2962	0.435	6	118.2962	0.189	6	118.2962	0.189	6	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:N[6]-2:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(N[6]C[6])(H)	C[6](C[6a]C[6a]2)(C[6]N[6]H)2	H(C[6]C[6]N[6])	C[6](C[6]C[6a]C[6])(N[6]C[6])(H){1|C<4>,1|H<1>,1|N<3>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]N[6]H)2{1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]N[6])	117.0850	0.000	1	117.0850	0.000	1	117.0850	0.000	1	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:N[6]-2:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(N[6]C[6])(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Au)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[6a]N[6])(N[6]C[6])(H){1|Au<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Au)(C[6]N[6]H){1|H<1>,4|C<3>}	H(C[6]C[6]N[6])	118.7690	0.434	4	118.7690	0.188	4	118.7690	0.188	4	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:N[6]-2:H-1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(N[6]C[6])(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Re)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]N[5]N[6])(N[6]C[6])(H){1|Br<1>,1|Re<6>,1|N<3>,2|C<3>}	C[6](N[5]C[5]N[5])(N[6]C[6]Re)(C[6]N[6]H){2|H<1>,3|C<3>}	H(C[6]C[6]N[6])	119.4795	0.332	2	119.4795	0.110	2	119.4795	0.110	2	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(N[6]C[6,6a])(H)	C[6](N[6]C[6,6a]O)(C[5]N[5]2)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[5]N[6])(N[6]C[6,6a])(H){1|O<1>,2|C<3>,2|N<3>}	C[6](N[6]C[6,6a]O)(C[5]N[5]2)(C[6]N[6]H){2|C<3>,2|C<4>,2|O<1>}	H(C[6]C[6]N[6])	116.9300	1.318	2	116.9300	1.737	2	118.2717	1.463	6	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(N[6]C[6])(H)	C[6](N[6]C[6]Co)(C[5]N[5]2)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[5]N[6])(N[6]C[6])(H){1|Co<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Co)(C[5]N[5]2)(C[6]N[6]H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6]N[6])	119.1400	0.000	1	119.1400	0.000	1	118.2717	1.463	6	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(N[6]C[6])(H)	C[6](N[6]C[6]Mn)(C[5]N[5]2)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[5]N[6])(N[6]C[6])(H){1|Mn<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Mn)(C[5]N[5]2)(C[6]N[6]H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6]N[6])	119.0910	0.000	1	119.0910	0.000	1	118.2717	1.463	6	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(N[6]C[6])(H)	C[6](N[6]C[6]Ni)(C[5]N[5]2)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[5]N[6])(N[6]C[6])(H){1|Ni<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](N[6]C[6]Ni)(C[5]N[5]2)(C[6]N[6]H){1|C<3>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]N[6])	118.9390	0.000	1	118.9390	0.000	1	118.2717	1.463	6	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(N[6]C[6])(H)	C[6](N[6]C[6]Ru)(C[5]N[5]2)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[5]N[6])(N[6]C[6])(H){1|Ru<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](N[6]C[6]Ru)(C[5]N[5]2)(C[6]N[6]H){1|C<3>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]N[6])	118.6000	0.000	1	118.6000	0.000	1	118.2717	1.463	6	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(H)	C[6](N[6]C[6]Bi)(C[6]N[6]H)(COO)	H(C[6]C[6]N[6])	C[6](C[6]N[6]C)(N[6]C[6])(H){1|Bi<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Bi)(C[6]N[6]H)(COO){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.3845	0.757	2	119.3845	0.574	2	118.8802	0.578	81	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(H)	C[6](N[6]C[6]Cd)(C[6]N[6]H)(CCN)	H(C[6]C[6]N[6])	C[6](C[6]N[6]C)(N[6]C[6])(H){1|Cd<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cd)(C[6]N[6]H)(CCN){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6660	0.000	1	118.6660	0.000	1	118.8802	0.578	81	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(H)	C[6](N[6]C[6]Cd)(C[6]N[6]H)(COO)	H(C[6]C[6]N[6])	C[6](C[6]N[6]C)(N[6]C[6])(H){1|Cd<6>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Cd)(C[6]N[6]H)(COO){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7835	0.097	2	118.7835	0.009	2	118.8802	0.578	81	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(H)	C[6](N[6]C[6]Co)(C[6]N[6]H)(CCN)	H(C[6]C[6]N[6])	C[6](C[6]N[6]C)(N[6]C[6])(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]N[6]H)(CCN){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.0860	0.000	1	119.0860	0.000	1	118.8802	0.578	81	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(H)	C[6](N[6]C[6]Co)(C[6]N[6]H)(CNO)	H(C[6]C[6]N[6])	C[6](C[6]N[6]C)(N[6]C[6])(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]N[6]H)(CNO){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.9434	0.890	13	118.9441	0.594	18	118.8802	0.578	81	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(H)	C[6](N[6]C[6]Co)(C[6]N[6]H)(CNO)	H(C[6]C[6]N[6])	C[6](C[6]N[6]C)(N[6]C[6])(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]N[6]H)(CNO){2|C<3>}	H(C[6]C[6]N[6])	118.9460	0.383	5	118.9441	0.594	18	118.8802	0.578	81	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(H)	C[6](N[6]C[6]Co)(C[6]N[6]H)(COO)	H(C[6]C[6]N[6])	C[6](C[6]N[6]C)(N[6]C[6])(H){1|Co<6>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Co)(C[6]N[6]H)(COO){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.4633	1.156	3	119.4633	1.337	3	118.8802	0.578	81	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(H)	C[6](N[6]C[6]Cu)(C[6]N[6]H)(CNN)	H(C[6]C[6]N[6])	C[6](C[6]N[6]C)(N[6]C[6])(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]N[6]H)(CNN){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.0900	0.175	2	119.0900	0.031	2	118.8802	0.578	81	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(H)	C[6](N[6]C[6]Cu)(C[6]N[6]H)(COO)	H(C[6]C[6]N[6])	C[6](C[6]N[6]C)(N[6]C[6])(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]N[6]H)(COO){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.0515	0.047	2	119.0515	0.002	2	118.8802	0.578	81	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(H)	C[6](N[6]C[6]Fe)(C[6]N[6]H)(CNO)	H(C[6]C[6]N[6])	C[6](C[6]N[6]C)(N[6]C[6])(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]N[6]H)(CNO){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8616	0.867	5	118.8616	0.752	5	118.8802	0.578	81	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(H)	C[6](N[6]C[6]Fe)(C[6]N[6]H)(COO)	H(C[6]C[6]N[6])	C[6](C[6]N[6]C)(N[6]C[6])(H){1|Fe<6>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Fe)(C[6]N[6]H)(COO){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.1090	0.000	1	118.4660	0.102	3	118.8802	0.578	81	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(H)	C[6](N[6]C[6]Fe)(C[6]N[6]H)(COO)	H(C[6]C[6]N[6])	C[6](C[6]N[6]C)(N[6]C[6])(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]N[6]H)(COO){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6445	0.115	2	118.4660	0.102	3	118.8802	0.578	81	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(H)	C[6](N[6]C[6]Ir)(C[6]N[6]H)(COO)	H(C[6]C[6]N[6])	C[6](C[6]N[6]C)(N[6]C[6])(H){1|Ir<6>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Ir)(C[6]N[6]H)(COO){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.1230	0.000	1	118.1230	0.000	1	118.8802	0.578	81	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(H)	C[6](N[6]C[6]Mn)(C[6]N[6]H)(CCN)	H(C[6]C[6]N[6])	C[6](C[6]N[6]C)(N[6]C[6])(H){1|Mn<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]N[6]H)(CCN){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7490	0.000	1	118.6488	0.032	4	118.8802	0.578	81	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(H)	C[6](N[6]C[6]Mn)(C[6]N[6]H)(CCN)	H(C[6]C[6]N[6])	C[6](C[6]N[6]C)(N[6]C[6])(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]N[6]H)(CCN){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6153	0.202	3	118.6488	0.032	4	118.8802	0.578	81	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(H)	C[6](N[6]C[6]Mn)(C[6]N[6]H)(CNN)	H(C[6]C[6]N[6])	C[6](C[6]N[6]C)(N[6]C[6])(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]N[6]H)(CNN){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.0423	0.513	6	119.0423	0.263	6	118.8802	0.578	81	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(H)	C[6](N[6]C[6]Mn)(C[6]N[6]H)(COO)	H(C[6]C[6]N[6])	C[6](C[6]N[6]C)(N[6]C[6])(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]N[6]H)(COO){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8560	0.000	1	118.8560	0.000	1	118.8802	0.578	81	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(H)	C[6](N[6]C[6]Ni)(C[6]N[6]H)(CCN)	H(C[6]C[6]N[6])	C[6](C[6]N[6]C)(N[6]C[6])(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]N[6]H)(CCN){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4772	0.249	5	118.4772	0.062	5	118.8802	0.578	81	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(H)	C[6](N[6]C[6]Ni)(C[6]N[6]H)(CNN)	H(C[6]C[6]N[6])	C[6](C[6]N[6]C)(N[6]C[6])(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]N[6]H)(CNN){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8540	0.260	2	118.8540	0.068	2	118.8802	0.578	81	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(H)	C[6](N[6]C[6]Ni)(C[6]N[6]H)(CNO)	H(C[6]C[6]N[6])	C[6](C[6]N[6]C)(N[6]C[6])(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]N[6]H)(CNO){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.9440	0.180	2	118.9440	0.032	2	118.8802	0.578	81	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(H)	C[6](N[6]C[6]Ni)(C[6]N[6]H)(COO)	H(C[6]C[6]N[6])	C[6](C[6]N[6]C)(N[6]C[6])(H){1|Ni<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]N[6]H)(COO){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	120.8405	2.604	2	120.1733	4.726	3	118.8802	0.578	81	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(H)	C[6](N[6]C[6]Ni)(C[6]N[6]H)(COO)	H(C[6]C[6]N[6])	C[6](C[6]N[6]C)(N[6]C[6])(H){1|Ni<6>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Ni)(C[6]N[6]H)(COO){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8390	0.000	1	120.1733	4.726	3	118.8802	0.578	81	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(H)	C[6](N[6]C[6]Pd)(C[6]N[6]H)(CNO)	H(C[6]C[6]N[6])	C[6](C[6]N[6]C)(N[6]C[6])(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]N[6]H)(CNO){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.9650	0.314	2	118.9650	0.099	2	118.8802	0.578	81	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(H)	C[6](N[6]C[6]Re)(C[6]N[6]H)(COO)	H(C[6]C[6]N[6])	C[6](C[6]N[6]C)(N[6]C[6])(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Re)(C[6]N[6]H)(COO){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.9460	0.725	2	117.9460	0.526	2	118.8802	0.578	81	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(H)	C[6](N[6]C[6]Sn)(C[6]N[6]H)(COO)	H(C[6]C[6]N[6])	C[6](C[6]N[6]C)(N[6]C[6])(H){1|Sn<6>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Sn)(C[6]N[6]H)(COO){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.1090	0.635	2	118.9790	0.072	9	118.8802	0.578	81	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(H)	C[6](N[6]C[6]Sn)(C[6]N[6]H)(COO)	H(C[6]C[6]N[6])	C[6](C[6]N[6]C)(N[6]C[6])(H){1|Sn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Sn)(C[6]N[6]H)(COO){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.0090	0.158	4	118.9790	0.072	9	118.8802	0.578	81	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(H)	C[6](N[6]C[6]Sn)(C[6]N[6]H)(COO)	H(C[6]C[6]N[6])	C[6](C[6]N[6]C)(N[6]C[6])(H){1|Sn<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Sn)(C[6]N[6]H)(COO){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8523	0.073	3	118.9790	0.072	9	118.8802	0.578	81	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(H)	C[6](N[6]C[6]Zn)(C[6]N[6]H)(CCN)	H(C[6]C[6]N[6])	C[6](C[6]N[6]C)(N[6]C[6])(H){1|Zn<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]N[6]H)(CCN){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7410	0.000	1	118.6045	0.021	4	118.8802	0.578	81	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(H)	C[6](N[6]C[6]Zn)(C[6]N[6]H)(CCN)	H(C[6]C[6]N[6])	C[6](C[6]N[6]C)(N[6]C[6])(H){1|Zn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]N[6]H)(CCN){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5590	0.139	3	118.6045	0.021	4	118.8802	0.578	81	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(H)	C[6](N[6]C[6]Zn)(C[6]N[6]H)(COO)	H(C[6]C[6]N[6])	C[6](C[6]N[6]C)(N[6]C[6])(H){1|Zn<6>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Zn)(C[6]N[6]H)(COO){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	116.4580	0.000	1	116.4580	0.000	1	118.8802	0.578	81	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(N[6]C[6,6a])(H)	C[6](N[6]C[6,6a]Co)(C[6]C[6]N[6])(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]N[6])(N[6]C[6,6a])(H){1|Co<5>,1|N<3>,3|C<3>}	C[6](N[6]C[6,6a]Co)(C[6]C[6]N[6])(C[6]N[6]H){1|H<1>,4|C<3>}	H(C[6]C[6]N[6])	118.2890	0.000	1	118.2890	0.000	1	118.3200	0.417	14	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(N[6]C[6,6a])(H)	C[6](N[6]C[6,6a]Cu)(C[6]C[6]N[6])(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]N[6])(N[6]C[6,6a])(H){1|Cu<4>,1|N<3>,3|C<3>}	C[6](N[6]C[6,6a]Cu)(C[6]C[6]N[6])(C[6]N[6]H){1|H<1>,4|C<3>}	H(C[6]C[6]N[6])	118.1625	0.098	2	118.3783	0.070	4	118.3200	0.417	14	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(N[6]C[6,6a])(H)	C[6](N[6]C[6,6a]Cu)(C[6]C[6]N[6])(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]N[6])(N[6]C[6,6a])(H){1|Cu<5>,1|N<3>,3|C<3>}	C[6](N[6]C[6,6a]Cu)(C[6]C[6]N[6])(C[6]N[6]H){1|H<1>,4|C<3>}	H(C[6]C[6]N[6])	118.5940	0.123	2	118.3783	0.070	4	118.3200	0.417	14	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(N[6]C[6,6a])(H)	C[6](N[6]C[6,6a]Ir)(C[6]C[6]N[6])(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]N[6])(N[6]C[6,6a])(H){1|Ir<6>,1|N<3>,3|C<3>}	C[6](N[6]C[6,6a]Ir)(C[6]C[6]N[6])(C[6]N[6]H){1|H<1>,4|C<3>}	H(C[6]C[6]N[6])	117.7840	0.000	1	117.7840	0.000	1	118.3200	0.417	14	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(N[6]C[6,6a])(H)	C[6](N[6]C[6,6a]Ni)(C[6]C[6]N[6])(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]N[6])(N[6]C[6,6a])(H){1|Ni<5>,1|N<3>,3|C<3>}	C[6](N[6]C[6,6a]Ni)(C[6]C[6]N[6])(C[6]N[6]H){1|H<1>,4|C<3>}	H(C[6]C[6]N[6])	118.4660	0.000	1	118.4660	0.000	1	118.3200	0.417	14	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(N[6]C[6,6a])(H)	C[6](N[6]C[6,6a]Pt)(C[6]C[6]N[6])(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]N[6])(N[6]C[6,6a])(H){1|Pt<4>,1|N<3>,3|C<3>}	C[6](N[6]C[6,6a]Pt)(C[6]C[6]N[6])(C[6]N[6]H){1|H<1>,4|C<3>}	H(C[6]C[6]N[6])	118.2015	0.364	2	118.2015	0.133	2	118.3200	0.417	14	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(N[6]C[6])(H)	C[6](N[6]C[6]Cu)(C[6]N[6]2)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]N[6])(N[6]C[6])(H){1|Cu<5>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](N[6]C[6]Cu)(C[6]N[6]2)(C[6]N[6]H){1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	119.2490	0.280	2	119.2490	0.078	2	118.3200	0.417	14	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(N[6]C[6])(H)	C[6](N[6]C[6]Ni)(C[6]N[6]2)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]N[6])(N[6]C[6])(H){1|Ni<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](N[6]C[6]Ni)(C[6]N[6]2)(C[6]N[6]H){1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	117.4150	1.066	2	117.4150	1.137	2	118.3200	0.417	14	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(N[6]C[6])(H)	C[6](N[6]C[6]Ru)(C[6]N[6]2)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]N[6])(N[6]C[6])(H){1|Ru<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](N[6]C[6]Ru)(C[6]N[6]2)(C[6]N[6]H){1|H<1>,1|N<2>,2|C<3>}	H(C[6]C[6]N[6])	118.6970	0.000	1	118.6970	0.000	1	118.3200	0.417	14	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]N[6]N)(N[6]C[6])(H)	C[6](N[6]C[6]Cu)(C[6]N[6]H)(NCH)	H(C[6]C[6]N[6])	C[6](C[6]N[6]N)(N[6]C[6])(H){1|Cu<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]N[6]H)(NCH){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.3260	0.000	1	119.3260	0.000	1	119.3260	0.000	1	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(N[6]C[6,6a])(H)	C[6](N[6]C[6,6a]Re)(C[6]N[6]H)(N[5]C[5]2)	H(C[6]C[6]N[6])	C[6](C[6]N[5]N[6])(N[6]C[6,6a])(H){1|Re<6>,4|C<3>}	C[6](N[6]C[6,6a]Re)(C[6]N[6]H)(N[5]C[5]2){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]N[6])	119.3760	0.212	5	119.3760	0.045	5	119.3760	0.045	5	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[6]2)(N[6]C[6])(H)	C[6](N[6]C[6,6]C[6])(N[6]C[6]Ir)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]2)(N[6]C[6])(H){1|Ir<6>,1|C<4>,1|H<1>,2|C<3>}	C[6](N[6]C[6,6]C[6])(N[6]C[6]Ir)(C[6]N[6]H){1|C<3>,1|C<4>,2|N<3>,3|H<1>}	H(C[6]C[6]N[6])	119.0980	0.000	1	119.0980	0.000	1	119.1333	0.003	3	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[6]2)(N[6]C[6])(H)	C[6](N[6]C[6,6]C[6])(N[6]C[6]Re)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]2)(N[6]C[6])(H){1|Re<6>,1|C<4>,1|H<1>,2|C<3>}	C[6](N[6]C[6,6]C[6])(N[6]C[6]Re)(C[6]N[6]H){1|C<3>,1|C<4>,2|H<1>,3|N<3>}	H(C[6]C[6]N[6])	119.1510	0.059	2	119.1510	0.004	2	119.1333	0.003	3	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:O[6]-2:H-1:	C[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(O[6]C[6])(H)	C[6](C[6]C[6a]C[6])(C[6a]C[6a]2)(C[6]O[6]H)	H(C[6]C[6]O[6])	C[6](C[6]C[6a]C[6])(O[6]C[6])(H){5|C<3>}	C[6](C[6]C[6a]C[6])(C[6a]C[6a]2)(C[6]O[6]H){2|H<1>,6|C<3>}	H(C[6]C[6]O[6])	118.7750	0.000	1	118.7750	0.000	1	118.7750	0.000	1	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:O[6]-2:H-1:	C[6]-3:N[6]-3:C-3:	C[6]-3:	C[6](C[6]N[6]C)(O[6]C[6])(H)	C[6](C[6]O[6]H)(N[6]C[6]C)(COO)	H(C[6]C[6]O[6])	C[6](C[6]N[6]C)(O[6]C[6])(H){1|H<1>,2|C<3>}	C[6](C[6]O[6]H)(N[6]C[6]C)(COO){1|C<3>,1|H<1>}	H(C[6]C[6]O[6])	124.2490	0.000	1	124.2490	0.000	1	124.2490	0.000	1	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:S[6]-2:H-1:	N[5a,6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5a,6]C[6a])(S[6]C[6])(H)	C[6](N[5a,6]C[5a,6a]C[5a,6])(C[6a]C[6a]2)(C[6]S[6]H)	H(C[6]C[6]S[6])	C[6](C[6]N[5a,6]C[6a])(S[6]C[6])(H){2|H<1>,4|C<3>}	C[6](N[5a,6]C[5a,6a]C[5a,6])(C[6a]C[6a]2)(C[6]S[6]H){1|C<4>,1|N<2>,2|H<1>,4|C<3>}	H(C[6]C[6]S[6])	117.5710	0.000	1	117.5710	0.000	1	117.5710	0.000	1	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:3:	3:	C[6]-3:S[6]-2:H-1:	N[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(S[6]C[6,6a])(H)	C[6](N[6]C[6,6a]C)(C[6a]C[6a]2)(C[6]S[6]H)	H(C[6]C[6]S[6])	C[6](C[6]C[6a]N[6])(S[6]C[6,6a])(H){1|C<2>,4|C<3>}	C[6](N[6]C[6,6a]C)(C[6a]C[6a]2)(C[6]S[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]S[6])	117.5500	0.501	2	117.5500	0.251	2	117.5500	0.251	2	118.7383	4.770	279	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:4:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:As-4:	C[6]-3:	C[6](C[6]C[6]As)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(AsO3)	H(C[6]C[6]2)	C[6](C[6]C[6]As)(C[6]C[6])(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(AsO3){1|C<3>,1|H<1>}	H(C[6]C[6]2)	118.2370	0.000	1	118.2370	0.000	1	118.2370	0.000	1	117.8644	10.113	97	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:4:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:B-4:	C[6]-3:	C[6](C[6]C[6]B)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(BC[6a]3)	H(C[6]C[6]2)	C[6](C[6]C[6]B)(C[6]C[6])(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(BC[6a]3){1|C<3>,1|H<1>}	H(C[6]C[6]2)	116.2355	2.836	4	116.2355	8.043	4	116.2355	8.043	4	117.8644	10.113	97	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:4:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6])(H)	C[6](C[6]C[6]2)(C[6]C[6]H)(CCHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6])(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]2)(C[6]C[6]H)(CCHN){1|C<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	111.9190	0.000	1	111.9190	0.000	1	117.6706	12.507	39	117.8644	10.113	97	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:4:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6])(H)	C[6](C[6]C[6]2)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6])(H){2|C<3>}	C[6](C[6]C[6]2)(C[6]C[6]H)(CHHN){1|C<2>,1|C<4>,2|C<3>}	H(C[6]C[6]2)	120.6870	0.000	1	120.6870	0.000	1	117.6706	12.507	39	117.8644	10.113	97	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:4:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6])(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6])(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(CH3){1|C<3>,1|H<1>}	H(C[6]C[6]2)	118.1090	0.000	1	118.1090	0.000	1	117.6706	12.507	39	117.8644	10.113	97	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:4:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(CC3){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.7300	0.000	1	119.7300	0.000	1	117.6706	12.507	39	117.8644	10.113	97	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:4:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6])(H){1|C<3>,1|C<4>,1|N<2>}	C[6](C[6]C[6]H)(C[6]C[6]N)(CCHH){1|C<3>,1|H<1>}	H(C[6]C[6]2)	113.1250	0.000	1	113.1250	0.000	1	117.6706	12.507	39	117.8644	10.113	97	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:4:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6])(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(CCHH){1|C<3>,1|H<1>}	H(C[6]C[6]2)	115.4810	0.000	1	115.6054	2.569	5	117.6706	12.507	39	117.8644	10.113	97	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:4:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6])(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(CCHH){1|C<3>,1|H<1>}	H(C[6]C[6]2)	113.8090	0.000	1	115.6054	2.569	5	117.6706	12.507	39	117.8644	10.113	97	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:4:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6])(H){1|Cl<1>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CCHH){1|C<3>,1|H<1>}	H(C[6]C[6]2)	116.8240	1.949	2	115.6054	2.569	5	117.6706	12.507	39	117.8644	10.113	97	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:4:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6])(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(CCHH){1|C<3>,1|H<1>}	H(C[6]C[6]2)	115.0890	0.000	1	115.6054	2.569	5	117.6706	12.507	39	117.8644	10.113	97	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:4:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(CCHO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6])(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(CCHO){1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0525	1.111	4	120.0525	1.233	4	117.6706	12.507	39	117.8644	10.113	97	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:4:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(CC[5]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6])(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(CC[5]HH){1|C<3>,1|H<1>}	H(C[6]C[6]2)	113.5390	0.000	1	113.5390	0.000	1	117.6706	12.507	39	117.8644	10.113	97	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:4:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(CC[6]CO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6])(H){1|Cl<1>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CC[6]CO){1|C<3>,1|H<1>}	H(C[6]C[6]2)	116.5750	0.000	1	116.5750	0.000	1	117.6706	12.507	39	117.8644	10.113	97	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:4:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(CC[6]HO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(CC[6]HO){1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.7110	0.000	1	121.7110	0.000	1	117.6706	12.507	39	117.8644	10.113	97	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:4:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(CC[6a]2N)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6])(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(CC[6a]2N){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9410	0.000	1	119.9410	0.000	1	117.6706	12.507	39	117.8644	10.113	97	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:4:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(CCuCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6])(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(CCuCH){1|C<3>,1|H<1>}	H(C[6]C[6]2)	125.4000	0.000	1	125.4000	0.000	1	117.6706	12.507	39	117.8644	10.113	97	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:4:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6])(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|H<1>}	H(C[6]C[6]2)	115.9960	0.000	1	118.8574	6.661	8	117.6706	12.507	39	117.8644	10.113	97	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:4:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(CH3){1|Br<1>,1|C<3>}	H(C[6]C[6]2)	118.4620	0.000	1	118.8574	6.661	8	117.6706	12.507	39	117.8644	10.113	97	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:4:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|H<1>}	H(C[6]C[6]2)	117.2130	0.000	1	118.8574	6.661	8	117.6706	12.507	39	117.8644	10.113	97	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:4:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6])(H){1|C<3>,1|H<1>,1|S<4>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.4213	3.017	4	118.8574	6.661	8	117.6706	12.507	39	117.8644	10.113	97	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:4:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6])(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.5030	0.000	1	118.8574	6.661	8	117.6706	12.507	39	117.8644	10.113	97	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:4:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6])(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(CHHN){1|C<3>,1|H<1>}	H(C[6]C[6]2)	117.6540	0.000	1	117.6540	0.000	1	117.6706	12.507	39	117.8644	10.113	97	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:4:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6])(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(CHHO){1|C<3>,1|H<1>}	H(C[6]C[6]2)	112.4957	6.579	3	112.4957	43.281	3	117.6706	12.507	39	117.8644	10.113	97	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:4:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(CHHS)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6])(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(CHHS){1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.2240	0.000	1	121.2240	0.000	1	117.6706	12.507	39	117.8644	10.113	97	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:4:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(CN[5]CH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6])(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(CN[5]CH){1|C<3>,1|H<1>}	H(C[6]C[6]2)	117.6680	0.000	1	117.6680	0.000	1	117.6706	12.507	39	117.8644	10.113	97	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:4:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(CNiHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6])(H){1|C<2>,2|H<1>}	C[6](C[6]C[6]H)2(CNiHH){1|C<3>}	H(C[6]C[6]2)	116.8100	1.721	2	116.8100	2.962	2	117.6706	12.507	39	117.8644	10.113	97	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:4:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6])(H)	C[6](C[6]C[6]N[5])(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[5])(C[6]C[6]H)(CCHH){1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	117.2570	0.000	1	117.2570	0.000	1	117.6706	12.507	39	117.8644	10.113	97	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:4:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6])(H)	C[6](C[6]C[6]H)2(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6])(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(CCHH){1|H<1>,1|N<3>}	H(C[6]C[6]2)	115.8600	0.000	1	115.8600	0.000	1	117.6706	12.507	39	117.8644	10.113	97	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:4:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6])(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6])(H){1|Mg<4>,1|C<2>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|N<3>}	H(C[6]C[6]2)	119.2750	0.165	2	119.2750	0.027	2	117.6706	12.507	39	117.8644	10.113	97	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:4:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:N-4:	C[6]-3:	C[6](C[6]C[6]N)(C[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(NH3)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]C[6])(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(NH3){1|C<3>,1|H<1>}	H(C[6]C[6]2)	123.6160	0.000	1	123.6160	0.000	1	123.6160	0.000	1	117.8644	10.113	97	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:4:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:P-4:	C[6]-3:	C[6](C[6]C[6]P)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(PC[6]2Mo)	H(C[6]C[6]2)	C[6](C[6]C[6]P)(C[6]C[6])(H){1|Cl<1>,1|C<2>,1|H<1>}	C[6](C[6]C[6]H)2(PC[6]2Mo){1|C<3>}	H(C[6]C[6]2)	115.2415	3.321	2	116.2330	8.465	3	118.5733	4.344	16	117.8644	10.113	97	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:4:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:P-4:	C[6]-3:	C[6](C[6]C[6]P)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(PC[6]2Mo)	H(C[6]C[6]2)	C[6](C[6]C[6]P)(C[6]C[6])(H){1|Cl<1>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(PC[6]2Mo){1|C<3>,1|H<1>}	H(C[6]C[6]2)	118.2160	0.000	1	116.2330	8.465	3	118.5733	4.344	16	117.8644	10.113	97	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:4:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:P-4:	C[6]-3:	C[6](C[6]C[6]P)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(PC[6]FeC)	H(C[6]C[6]2)	C[6](C[6]C[6]P)(C[6]C[6])(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(PC[6]FeC){1|C<3>,1|H<1>}	H(C[6]C[6]2)	118.1435	0.145	2	118.1435	0.021	2	118.5733	4.344	16	117.8644	10.113	97	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:4:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:P-4:	C[6]-3:	C[6](C[6]C[6]P)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(PC[6]MoC)	H(C[6]C[6]2)	C[6](C[6]C[6]P)(C[6]C[6])(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(PC[6]MoC){1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0980	4.187	2	120.0980	17.535	2	118.5733	4.344	16	117.8644	10.113	97	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:4:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:P-4:	C[6]-3:	C[6](C[6]C[6]P)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(PC[6]PdO)	H(C[6]C[6]2)	C[6](C[6]C[6]P)(C[6]C[6])(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(PC[6]PdO){1|C<3>,1|H<1>}	H(C[6]C[6]2)	117.1270	0.000	1	117.1270	0.000	1	118.5733	4.344	16	117.8644	10.113	97	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:4:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:P-4:	C[6]-3:	C[6](C[6]C[6]P)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(PC[6]ReO)	H(C[6]C[6]2)	C[6](C[6]C[6]P)(C[6]C[6])(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(PC[6]ReO){1|C<3>,1|H<1>}	H(C[6]C[6]2)	118.8550	0.000	1	118.8550	0.000	1	118.5733	4.344	16	117.8644	10.113	97	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:4:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:P-4:	C[6]-3:	C[6](C[6]C[6]P)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(PC[6a]2N)	H(C[6]C[6]2)	C[6](C[6]C[6]P)(C[6]C[6])(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(PC[6a]2N){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9770	0.000	2	119.9770	0.000	2	118.5733	4.344	16	117.8644	10.113	97	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:4:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:P-4:	C[6]-3:	C[6](C[6]C[6]P)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(PC[6a]3)	H(C[6]C[6]2)	C[6](C[6]C[6]P)(C[6]C[6])(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(PC[6a]3){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.1920	0.000	1	119.1920	0.000	1	118.5733	4.344	16	117.8644	10.113	97	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:4:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:P-4:	C[6]-3:	C[6](C[6]C[6]P)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(PC[6a]CO)	H(C[6]C[6]2)	C[6](C[6]C[6]P)(C[6]C[6])(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(PC[6a]CO){1|C<3>,1|H<1>}	H(C[6]C[6]2)	118.6840	0.000	1	118.6840	0.000	1	118.5733	4.344	16	117.8644	10.113	97	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:4:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:P-4:	C[6]-3:	C[6](C[6]C[6]P)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(PC[6a]NN)	H(C[6]C[6]2)	C[6](C[6]C[6]P)(C[6]C[6])(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(PC[6a]NN){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.0920	0.000	1	119.0920	0.000	1	118.5733	4.344	16	117.8644	10.113	97	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:4:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:P-4:	C[6]-3:	C[6](C[6]C[6]P)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(PFeCC)	H(C[6]C[6]2)	C[6](C[6]C[6]P)(C[6]C[6])(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(PFeCC){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.0080	0.000	1	119.0080	0.000	1	118.5733	4.344	16	117.8644	10.113	97	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:4:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:P-4:	C[6]-3:	C[6](C[6]C[6]P)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(PMo2H)	H(C[6]C[6]2)	C[6](C[6]C[6]P)(C[6]C[6])(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(PMo2H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0790	0.000	1	120.0790	0.000	1	118.5733	4.344	16	117.8644	10.113	97	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:4:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:S-4:	C[6]-3:	C[6](C[6]C[6]S)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(SC[5]OO)	H(C[6]C[6]2)	C[6](C[6]C[6]S)(C[6]C[6])(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(SC[5]OO){1|C<3>,1|H<1>}	H(C[6]C[6]2)	114.5350	0.000	1	114.5350	0.000	1	117.7665	5.478	4	117.8644	10.113	97	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:4:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:S-4:	C[6]-3:	C[6](C[6]C[6]S)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(SMn3)	H(C[6]C[6]2)	C[6](C[6]C[6]S)(C[6]C[6])(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(SMn3){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9270	0.000	1	119.9270	0.000	1	117.7665	5.478	4	117.8644	10.113	97	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:4:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:S-4:	C[6]-3:	C[6](C[6]C[6]S)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(SN[6]OO)	H(C[6]C[6]2)	C[6](C[6]C[6]S)(C[6]C[6])(H){1|C<2>,2|H<1>}	C[6](C[6]C[6]H)2(SN[6]OO){1|C<3>}	H(C[6]C[6]2)	118.3020	0.867	2	118.3020	0.752	2	117.7665	5.478	4	117.8644	10.113	97	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:4:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C[6]-3:Si-4:	C[6]-3:	C[6](C[6]C[6]Si)(C[6]C[6])(H)	C[6](C[6]C[6]H)2(SiC[6a]3)	H(C[6]C[6]2)	C[6](C[6]C[6]Si)(C[6]C[6])(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(SiC[6a]3){1|C<3>,1|H<1>}	H(C[6]C[6]2)	118.7160	0.812	2	118.7160	0.659	2	118.7160	0.659	2	117.8644	10.113	97	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:4:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)(C[6]C[6])(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)(C[6]C[6])(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3){1|C<3>,1|H<1>}	H(C[6]C[6]2)	110.5223	3.692	3	110.5223	13.634	3	110.5223	13.634	3	117.8644	10.113	97	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:4:	3:	C[6]-3:C[6]-2:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)(C[6]C[6])(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]N[6]C)(C[6]C[6])(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CHHN){1|C<3>,1|H<1>}	H(C[6]C[6]2)	114.4670	0.000	1	114.4670	0.000	1	114.4670	0.000	1	117.8644	10.113	97	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:4:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6])(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(CHHO)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6])(H){1|C<4>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(CHHO){1|C<3>,1|O<2>}	H(C[6]C[6]N[6])	122.9690	0.000	1	122.9690	0.000	1	119.1188	3.993	6	117.8644	10.113	97	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:4:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6])(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CF3)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6])(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CF3){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.1580	0.000	1	118.1580	0.000	1	119.1188	3.993	6	117.8644	10.113	97	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:4:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6])(H)	C[6](C[6]N[6]H)(C[6]N[6]O)(CH3)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6])(H){1|N<3>,2|O<1>}	C[6](C[6]N[6]H)(C[6]N[6]O)(CH3){1|Zn<5>,1|C<3>}	H(C[6]C[6]N[6])	118.4410	0.304	2	118.4410	0.092	2	119.1188	3.993	6	117.8644	10.113	97	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:4:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6])(H)	C[6](C[6]N[6]H)(C[6]N[6]O)(CN[5]HH)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6])(H){1|C<3>,1|N<3>,1|O<1>}	C[6](C[6]N[6]H)(C[6]N[6]O)(CN[5]HH){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.3590	0.000	1	119.3590	0.000	1	119.1188	3.993	6	117.8644	10.113	97	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:4:	3:	C[6]-3:N[6]-2:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(N[6]O[6])(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]O[6])(H){1|C<4>,1|H<1>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(CH3){1|O<2>,2|C<4>}	H(C[6]C[6]N[6])	117.3450	0.000	1	117.3450	0.000	1	119.1188	3.993	6	117.8644	10.113	97	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:4:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(H)	C[6](N[6]C[6]Co)(C[6]N[6]H)(CC[6]2C)	H(C[6]C[6]N[6])	C[6](C[6]N[6]C)(N[6]C[6])(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]N[6]H)(CC[6]2C){1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	119.0250	0.205	2	118.5755	0.171	6	118.5076	0.118	12	117.8644	10.113	97	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:4:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(H)	C[6](N[6]C[6]Co)(C[6]N[6]H)(CC[6]2C)	H(C[6]C[6]N[6])	C[6](C[6]N[6]C)(N[6]C[6])(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]N[6]H)(CC[6]2C){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3508	0.264	4	118.5755	0.171	6	118.5076	0.118	12	117.8644	10.113	97	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:4:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(H)	C[6](N[6]C[6]Fe)(C[6]N[6]H)(CHHP)	H(C[6]C[6]N[6])	C[6](C[6]N[6]C)(N[6]C[6])(H){1|Fe<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]N[6]H)(CHHP){1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	118.7180	0.212	2	118.5340	0.060	4	118.5076	0.118	12	117.8644	10.113	97	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:4:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(H)	C[6](N[6]C[6]Fe)(C[6]N[6]H)(CHHP)	H(C[6]C[6]N[6])	C[6](C[6]N[6]C)(N[6]C[6])(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]N[6]H)(CHHP){1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	118.3500	0.007	2	118.5340	0.060	4	118.5076	0.118	12	117.8644	10.113	97	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:4:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(H)	C[6](N[6]C[6]Pt)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](C[6]N[6]C)(N[6]C[6])(H){1|Pt<4>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Pt)(C[6]N[6]H)(CH3){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.0350	0.000	1	118.0350	0.000	1	118.5076	0.118	12	117.8644	10.113	97	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:4:	3:	C[6]-3:N[6]-2:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6])(H)	C[6](N[6]C[6]Ru)(C[6]N[6]H)(CRuCH)	H(C[6]C[6]N[6])	C[6](C[6]N[6]C)(N[6]C[6])(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]N[6]H)(CRuCH){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4670	0.000	1	118.4670	0.000	1	118.5076	0.118	12	117.8644	10.113	97	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:4:	3:	C[6]-3:O[6]-2:H-1:	C[6,6a]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]C)(O[6]C[6])(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]O[6]H)(CCCH)	H(C[6]C[6]O[6])	C[6](C[6]C[6,6a]C)(O[6]C[6])(H){2|C<3>,2|H<1>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]O[6]H)(CCCH){1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6]O[6])	117.5760	0.000	1	117.5760	0.000	1	117.5760	0.000	1	117.8644	10.113	97	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:4:	3:	C[6]-3:O[6]-2:H-1:	C[6,6a]-3:C[6]-3:In-4:	C[6]-3:	C[6](C[6]C[6,6a]In)(O[6]C[6])(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]O[6]H)(InI3)	H(C[6]C[6]O[6])	C[6](C[6]C[6,6a]In)(O[6]C[6])(H){1|O<2>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]O[6]H)(InI3){1|H<1>,3|C<3>}	H(C[6]C[6]O[6])	118.5970	0.000	1	118.5970	0.000	1	118.5970	0.000	1	117.8644	10.113	97	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:4:	3:	C[6]-3:O[6]-2:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(O[6]C[6])(H)	C[6](C[6]C[6]O)(C[6]O[6]H)(CH3)	H(C[6]C[6]O[6])	C[6](C[6]C[6]C)(O[6]C[6])(H){1|H<1>,1|O<1>,2|C<4>}	C[6](C[6]C[6]O)(C[6]O[6]H)(CH3){1|H<1>,2|C<4>}	H(C[6]C[6]O[6])	126.0410	0.000	1	126.0410	0.000	1	126.0410	0.000	1	117.8644	10.113	97	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:4:	3:	C[6]-3:O[6]-2:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)(O[6]C[6])(H)	C[6](C[6]O[6]H)(N[6]C[6]S)(CH3)	H(C[6]C[6]O[6])	C[6](C[6]N[6]C)(O[6]C[6])(H){1|C<3>,1|C<4>,1|H<1>,1|S<4>}	C[6](C[6]O[6]H)(N[6]C[6]S)(CH3){1|C<4>,2|H<1>}	H(C[6]C[6]O[6])	116.3690	0.000	1	116.3690	0.000	1	116.3690	0.000	1	117.8644	10.113	97	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:4:	3:	C[6]-3:P[6]-2:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(P[6]C[6])(H)	C[6](C[6]C[6]C)(C[6]P[6]H)(CH3)	H(C[6]C[6]P[6])	C[6](C[6]C[6]C)(P[6]C[6])(H){1|C<4>,2|C<3>}	C[6](C[6]C[6]C)(C[6]P[6]H)(CH3){1|C<3>,1|H<1>}	H(C[6]C[6]P[6])	115.5570	0.034	2	115.5570	0.001	2	115.5570	0.001	2	117.8644	10.113	97	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:4:	3:	C[6]-3:S[6]-2:H-1:	C[6,6a]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]C)(S[6]C[6,6a])(H)	C[6](C[6,6a]C[6,6a,6a]C[6a])(C[6]S[6]H)(CH3)	H(C[6]C[6]S[6])	C[6](C[6]C[6,6a]C)(S[6]C[6,6a])(H){3|C<3>}	C[6](C[6,6a]C[6,6a,6a]C[6a])(C[6]S[6]H)(CH3){1|H<1>,3|C<3>}	H(C[6]C[6]S[6])	116.7550	0.000	1	116.7550	0.000	1	116.7550	0.000	1	117.8644	10.113	97	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:3:4:	3:	C[6]-3:S[6]-2:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)(S[6]C[6])(H)	C[6](C[6]S[6]H)(N[6]C[6]C)(CH3)	H(C[6]C[6]S[6])	C[6](C[6]N[6]C)(S[6]C[6])(H){1|C<4>,1|H<1>,2|C<3>}	C[6](C[6]S[6]H)(N[6]C[6]C)(CH3){1|C<4>,1|O<1>}	H(C[6]C[6]S[6])	121.9420	0.000	1	121.9420	0.000	1	121.9420	0.000	1	117.8644	10.113	97	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:4:2:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:C-4:N[6]-2:	C[6]-3:	C[6](C[6]N[6]C)(C[6]C[6])(H)	C[6](C[6]C[6]H)(CC[6a]CH)(N[6]C[6])	H(C[6]C[6]2)	C[6](C[6]N[6]C)(C[6]C[6])(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(CC[6a]CH)(N[6]C[6]){1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6710	0.000	1	120.6710	0.000	1	120.6710	0.000	1	119.2115	4.260	2	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:4:2:	3:	C[6]-3:C[6]-2:H-1:	C[6]-3:P-4:C[6]-2:	C[6]-3:	C[6](C[6]C[6]P)(C[6]C[6])(H)	C[6](C[6]C[6]H)(PC[6]PdO)(C[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6]P)(C[6]C[6])(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(PC[6]PdO)(C[6]C[6]){1|C<3>,1|H<1>}	H(C[6]C[6]2)	117.7520	0.000	1	117.7520	0.000	1	117.7520	0.000	1	119.2115	4.260	2	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:4:3:	3:	C[6]-3:C[6]-2:H-1:	C[6,6a]-3:C-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]N[6])(H)	C[6](C[6,6a]C[6,6a]C[6a])(CC[6,6]HO)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]N[6])(H){1|H<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(CC[6,6]HO)(C[6]C[6]H){1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	118.6400	0.000	1	119.2115	0.653	2	119.2115	0.653	2	119.2115	0.653	2	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	3:4:3:	3:	C[6]-3:C[6]-2:H-1:	C[6,6a]-3:C-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]N[6])(H)	C[6](C[6,6a]C[6,6a]C[6a])(CC[6,6]HO)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]N[6])(H){2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(CC[6,6]HO)(C[6]C[6]H){1|H<1>,1|N<2>,2|C<3>}	H(C[6]C[6]2)	119.7830	0.000	1	119.2115	0.653	2	119.2115	0.653	2	119.2115	0.653	2	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	4:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[3,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[3,6]H)(N[6]C[6])(H)	C[6](C[3,6]C[3,6]C[3]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[3,6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,2|C<4>}	C[6](C[3,6]C[3,6]C[3]H)(C[6]N[6]H)(H){1|C<4>,3|C<3>}	H(C[6]C[6]N[6])	117.9070	0.000	1	117.9070	0.000	1	117.9070	0.000	1	118.1502	4.113	31	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	4:3:1:	3:	C[6]-3:N[6]-2:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(N[6]C[6])(H)	C[6](C[6,6]C[6,6]C[6]Mo)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6,6]H)(N[6]C[6])(H){1|Mo<9>,1|H<1>,2|C<4>}	C[6](C[6,6]C[6,6]C[6]Mo)(C[6]N[6]H)(H){1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6]N[6])	118.4660	0.000	1	118.4660	0.000	1	118.4660	0.000	1	118.1502	4.113	31	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	4:3:1:	3:	C[6]-3:O[6]-2:H-1:	C[3,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[3,6]H)(O[6]C[6])(H)	C[6](C[3,6]C[3,6,6]C[3,6]C[6a])(C[6]O[6]H)(H)	H(C[6]C[6]O[6])	C[6](C[6]C[3,6]H)(O[6]C[6])(H){2|C<4>,3|C<3>}	C[6](C[3,6]C[3,6,6]C[3,6]C[6a])(C[6]O[6]H)(H){1|H<1>,1|O<2>,2|C<3>,2|C<4>}	H(C[6]C[6]O[6])	117.9930	0.000	1	117.9930	0.000	1	117.7905	0.082	2	118.1502	4.113	31	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	4:3:1:	3:	C[6]-3:O[6]-2:H-1:	C[3,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[3,6]H)(O[6]C[6])(H)	C[6](C[3,6]C[3,6]C[6a]C[3])(C[6]O[6]H)(H)	H(C[6]C[6]O[6])	C[6](C[6]C[3,6]H)(O[6]C[6])(H){1|C<3>,1|H<1>,3|C<4>}	C[6](C[3,6]C[3,6]C[6a]C[3])(C[6]O[6]H)(H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]O[6])	117.5880	0.000	1	117.5880	0.000	1	117.7905	0.082	2	118.1502	4.113	31	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	4:3:1:	3:	C[6]-3:O[6]-2:H-1:	C[5,6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6,6]H)(O[6]C[5,6])(H)	C[6](C[5,6,6]C[5,6]O[5,6]C[6])(C[6]O[6]H)(H)	H(C[6]C[6]O[6])	C[6](C[6]C[5,6,6]H)(O[6]C[5,6])(H){1|H<1>,1|O<2>,3|C<4>}	C[6](C[5,6,6]C[5,6]O[5,6]C[6])(C[6]O[6]H)(H){2|H<1>,5|C<4>}	H(C[6]C[6]O[6])	118.1495	0.086	6	118.1495	0.007	6	118.0209	0.122	7	118.1502	4.113	31	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	4:3:1:	3:	C[6]-3:O[6]-2:H-1:	C[5,6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6,6]H)(O[6]C[6,6])(H)	C[6](C[5,6,6]C[5,3x6]C[6]O[5])(C[6]O[6]H)(H)	H(C[6]C[6]O[6])	C[6](C[6]C[5,6,6]H)(O[6]C[6,6])(H){1|C<3>,1|O<2>,3|C<4>}	C[6](C[5,6,6]C[5,3x6]C[6]O[5])(C[6]O[6]H)(H){2|H<1>,5|C<4>}	H(C[6]C[6]O[6])	117.2490	0.000	1	117.2490	0.000	1	118.0209	0.122	7	118.1502	4.113	31	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	4:3:1:	3:	C[6]-3:O[6]-2:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(O[6]C[6])(H)	C[6](C[5,6]C[5,6]O[5]H)(C[6]O[6]H)(H)	H(C[6]C[6]O[6])	C[6](C[6]C[5,6]H)(O[6]C[6])(H){1|C<4>,1|O<2>,3|H<1>}	C[6](C[5,6]C[5,6]O[5]H)(C[6]O[6]H)(H){1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6]O[6])	123.6640	0.000	1	123.6640	0.000	1	123.6640	0.000	1	118.1502	4.113	31	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	4:3:1:	3:	C[6]-3:O[6]-2:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(O[6]C[6,6])(H)	C[6](C[6,6]C[6,6]2H)(C[6]O[6]H)(H)	H(C[6]C[6]O[6])	C[6](C[6]C[6,6]H)(O[6]C[6,6])(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6,6]C[6,6]2H)(C[6]O[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|O<1>,1|O<2>}	H(C[6]C[6]O[6])	123.7430	0.000	1	123.7430	0.000	1	118.1605	7.559	6	118.1502	4.113	31	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	4:3:1:	3:	C[6]-3:O[6]-2:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(O[6]C[6,6])(H)	C[6](C[6,6]C[6,6]2O)(C[6]O[6]H)(H)	H(C[6]C[6]O[6])	C[6](C[6]C[6,6]H)(O[6]C[6,6])(H){1|C<3>,1|O<2>,3|C<4>}	C[6](C[6,6]C[6,6]2O)(C[6]O[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|O<1>,1|O<2>}	H(C[6]C[6]O[6])	117.1065	0.042	2	117.1065	0.002	2	118.1605	7.559	6	118.1502	4.113	31	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	4:3:1:	3:	C[6]-3:O[6]-2:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(O[6]C[6,6a])(H)	C[6](C[6,6]C[6,6a]2C[6])(C[6]O[6]H)(H)	H(C[6]C[6]O[6])	C[6](C[6]C[6,6]H)(O[6]C[6,6a])(H){1|C<4>,3|C<3>}	C[6](C[6,6]C[6,6a]2C[6])(C[6]O[6]H)(H){1|C<4>,1|H<1>,1|O<2>,4|C<3>}	H(C[6]C[6]O[6])	117.4920	0.000	1	117.4920	0.000	1	118.1605	7.559	6	118.1502	4.113	31	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	4:3:1:	3:	C[6]-3:O[6]-2:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(O[6]C[6])(H)	C[6](C[6,6]C[6]3)(C[6]O[6]H)(H)	H(C[6]C[6]O[6])	C[6](C[6]C[6,6]H)(O[6]C[6])(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6,6]C[6]3)(C[6]O[6]H)(H){1|C<4>,1|N<3>,2|C<3>,4|H<1>}	H(C[6]C[6]O[6])	116.7575	0.159	2	116.7575	0.025	2	118.1605	7.559	6	118.1502	4.113	31	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	4:3:1:	3:	C[6]-3:O[6]-2:H-1:	C[6]-4:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(O[6]C[6])(H)	C[6](C[6]C[6]HH)(C[6]O[6]H)(Cl)	H(C[6]C[6]O[6])	C[6](C[6]C[6]Cl)(O[6]C[6])(H){1|C<3>,1|C<4>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]O[6]H)(Cl){1|C<3>,1|S<4>}	H(C[6]C[6]O[6])	118.4330	0.000	1	118.4330	0.000	1	118.4330	0.000	1	118.1502	4.113	31	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	4:3:1:	3:	C[6]-3:O[6]-2:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(O[6]C[6])(H)	C[6](C[6]C[5]C[6]H)(C[6]O[6]H)(H)	H(C[6]C[6]O[6])	C[6](C[6]C[6]H)(O[6]C[6])(H){2|H<1>,3|C<4>}	C[6](C[6]C[5]C[6]H)(C[6]O[6]H)(H){1|C<3>,1|C<4>,1|O<2>,3|H<1>}	H(C[6]C[6]O[6])	124.0630	0.000	1	124.0630	0.000	1	118.2910	5.087	9	118.1502	4.113	31	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	4:3:1:	3:	C[6]-3:O[6]-2:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(O[6]C[6])(H)	C[6](C[6]C[6]GdO)(C[6]O[6]H)(H)	H(C[6]C[6]O[6])	C[6](C[6]C[6]H)(O[6]C[6])(H){1|Gd<16>,1|O<2>,2|C<4>}	C[6](C[6]C[6]GdO)(C[6]O[6]H)(H){1|C<3>,1|O<3>}	H(C[6]C[6]O[6])	118.0872	0.449	4	118.0872	0.202	4	118.2910	5.087	9	118.1502	4.113	31	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	4:3:1:	3:	C[6]-3:O[6]-2:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(O[6]C[6])(H)	C[6](C[6]C[6]HO)(C[6]O[6]H)(H)	H(C[6]C[6]O[6])	C[6](C[6]C[6]H)(O[6]C[6])(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[6]C[6]HO)(C[6]O[6]H)(H){1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[6]O[6])	117.0950	0.619	2	117.0950	0.384	2	118.2910	5.087	9	118.1502	4.113	31	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	4:3:1:	3:	C[6]-3:O[6]-2:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(O[6]C[6])(H)	C[6](C[6]C[6]HS)(C[6]O[6]H)(H)	H(C[6]C[6]O[6])	C[6](C[6]C[6]H)(O[6]C[6])(H){1|S<2>,2|C<4>,2|H<1>}	C[6](C[6]C[6]HS)(C[6]O[6]H)(H){1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[6]O[6])	117.0085	0.276	2	117.0085	0.076	2	118.2910	5.087	9	118.1502	4.113	31	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	4:3:1:	3:	C[6]-3:O[6]-2:H-1:	C[6]-4:C[6]-3:I-1:	C[6]-3:	C[6](C[6]C[6]I)(O[6]C[6])(H)	C[6](C[6]C[6]HO)(C[6]O[6]H)(I)	H(C[6]C[6]O[6])	C[6](C[6]C[6]I)(O[6]C[6])(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[6]C[6]HO)(C[6]O[6]H)(I){1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[6]O[6])	117.5920	0.000	1	117.5920	0.000	1	117.5920	0.000	1	118.1502	4.113	31	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	4:3:1:	3:	C[6]-3:S[6]-2:H-1:	S[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]S[6]H)(S[6]C[6])(H)	C[6](S[6]C[6]OO)(C[6]S[6]H)(H)	H(C[6]C[6]S[6])	C[6](C[6]S[6]H)(S[6]C[6])(H){1|Si<4>,1|C<3>,2|O<1>}	C[6](S[6]C[6]OO)(C[6]S[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]S[6])	115.6420	0.048	2	115.6420	0.002	2	115.6420	0.002	2	118.1502	4.113	31	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	4:3:2:	3:	C[6]-3:C[6]-2:H-1:	P-4:C[6]-3:C[6]-2:	C[6]-3:	C[6](C[6]C[6]P)(C[6]C[6])(H)	C[6](PC[6a]AuC)(C[6]C[6]H)(C[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6]P)(C[6]C[6])(H){1|C<3>,1|H<1>}	C[6](PC[6a]AuC)(C[6]C[6]H)(C[6]C[6]){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9960	0.000	1	119.9960	0.000	1	119.9960	0.000	1	119.3114	6.193	5	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	4:3:2:	3:	C[6]-3:O[6]-2:H-1:	C[6,6]-4:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6,6]O)(O[6]C[6])(H)	C[6](C[6,6]C[6,6]C[6]H)(C[6]O[6]H)(OC)	H(C[6]C[6]O[6])	C[6](C[6]C[6,6]O)(O[6]C[6])(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6,6]C[6,6]C[6]H)(C[6]O[6]H)(OC){3|C<4>,3|H<1>}	H(C[6]C[6]O[6])	117.8300	0.000	1	117.8300	0.000	1	117.8300	0.000	1	119.3114	6.193	5	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	4:3:2:	3:	C[6]-3:O[6]-2:H-1:	C[6]-4:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)(O[6]C[6])(H)	C[6](C[6]C[6a]C[6]H)(C[6]O[6]H)(CC)	H(C[6]C[6]O[6])	C[6](C[6]C[6]C)(O[6]C[6])(H){1|C<4>,1|H<1>,2|C<3>}	C[6](C[6]C[6a]C[6]H)(C[6]O[6]H)(CC){2|H<1>,3|C<3>}	H(C[6]C[6]O[6])	117.4870	0.000	1	117.4870	0.000	1	117.4870	0.000	1	119.3114	6.193	5	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	4:3:2:	3:	C[6]-3:O[6]-2:H-1:	C[6]-4:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(O[6]C[6])(H)	C[6](C[6]C[6]HO)(C[6]O[6]H)(OC)	H(C[6]C[6]O[6])	C[6](C[6]C[6]O)(O[6]C[6])(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[6]C[6]HO)(C[6]O[6]H)(OC){1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[6]O[6])	117.8520	0.000	1	117.8520	0.000	1	117.8520	0.000	1	119.3114	6.193	5	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	4:3:2:	3:	C[6]-3:O[6]-2:H-1:	C[6]-4:C[6]-3:O[6]-2:	C[6]-3:	C[6](C[6]C[6]O[6])(O[6]C[6])(H)	C[6](C[6]C[6]2H)(C[6]O[6]H)(O[6]C[6])	H(C[6]C[6]O[6])	C[6](C[6]C[6]O[6])(O[6]C[6])(H){1|C<3>,2|C<4>,3|H<1>}	C[6](C[6]C[6]2H)(C[6]O[6]H)(O[6]C[6]){2|C<4>,3|C<3>,3|H<1>}	H(C[6]C[6]O[6])	123.3920	0.000	1	123.3920	0.000	1	123.3920	0.000	1	119.3114	6.193	5	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	4:3:3:	3:	C[6]-3:C[6]-2:H-1:	As-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]As)(C[6]C[6])(H)	C[6](AsC[6]2Pd)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]As)(C[6]C[6])(H){1|C<3>,2|H<1>}	C[6](AsC[6]2Pd)(C[6]C[6]H)2{1|C<3>,1|H<1>}	H(C[6]C[6]2)	116.0360	0.000	1	116.0360	0.000	1	116.0360	0.000	1	118.6049	9.159	87	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	4:3:3:	3:	C[6]-3:C[6]-2:H-1:	B-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]B)(C[6]C[6])(H)	C[6](BC[6a]2C[6])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]B)(C[6]C[6])(H){1|C<2>,1|H<1>}	C[6](BC[6a]2C[6])(C[6]C[6]H)2{1|C<2>}	H(C[6]C[6]2)	122.6140	2.249	2	122.6503	2.532	3	122.6503	2.532	3	118.6049	9.159	87	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	4:3:3:	3:	C[6]-3:C[6]-2:H-1:	B-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]B)(C[6]C[6])(H)	C[6](BC[6a]2C[6])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]B)(C[6]C[6])(H){1|C<3>,2|H<1>}	C[6](BC[6a]2C[6])(C[6]C[6]H)2{1|C<3>,1|H<1>}	H(C[6]C[6]2)	122.7230	0.000	1	122.6503	2.532	3	122.6503	2.532	3	118.6049	9.159	87	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	4:3:3:	3:	C[6]-3:C[6]-2:H-1:	C-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6])(H)	C[6](CC[6a]C[6]O)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6])(H){1|C<2>,2|H<1>}	C[6](CC[6a]C[6]O)(C[6]C[6]H)2{1|C<3>}	H(C[6]C[6]2)	120.0765	3.408	2	120.0765	11.611	2	121.4543	11.501	3	118.6049	9.159	87	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	4:3:3:	3:	C[6]-3:C[6]-2:H-1:	C-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6])(H)	C[6](CC[6a]C[6]O)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6])(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](CC[6a]C[6]O)(C[6]C[6]H)2{1|H<1>,1|N<3>}	H(C[6]C[6]2)	124.2100	0.000	1	124.2100	0.000	1	121.4543	11.501	3	118.6049	9.159	87	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	4:3:3:	3:	C[6]-3:C[6]-2:H-1:	C[3]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[3]C[6])(C[6]C[6])(H)	C[6](C[3]C[3]2H)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[3]C[6])(C[6]C[6])(H){1|C<3>,2|C<4>,3|H<1>}	C[6](C[3]C[3]2H)(C[6]C[6]H)2{3|C<3>,3|H<1>}	H(C[6]C[6]2)	122.1620	0.000	1	122.1620	0.000	1	122.1620	0.000	1	118.6049	9.159	87	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	4:3:3:	3:	C[6]-3:C[6]-2:H-1:	C[4]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[4]C[6])(C[6]C[6])(H)	C[6](C[4]C[6a]C[4]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[4]C[6])(C[6]C[6])(H){2|C<3>,2|C<4>,2|H<1>}	C[6](C[4]C[6a]C[4]2)(C[6]C[6]H)2{2|O<2>,3|H<1>,4|C<3>}	H(C[6]C[6]2)	115.1440	0.000	1	115.1440	0.000	1	115.1440	0.000	1	118.6049	9.159	87	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	4:3:3:	3:	C[6]-3:C[6]-2:H-1:	C[5]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6])(H)	C[6](C[5]C[5,6a]N[5a]C[5])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6])(H){1|F<1>,1|H<1>,1|N<3>,3|C<3>}	C[6](C[5]C[5,6a]N[5a]C[5])(C[6]C[6]H)2{1|H<1>,1|N<2>,1|N<3>,1|O<1>,4|C<3>}	H(C[6]C[6]2)	115.1020	0.000	1	115.1020	0.000	1	116.9425	6.775	2	118.6049	9.159	87	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	4:3:3:	3:	C[6]-3:C[6]-2:H-1:	C[5]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6])(H)	C[6](C[5]C[5]2Fe)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6])(H){1|Fe<10>,1|C<2>,1|C<3>,1|H<1>,2|C<4>}	C[6](C[5]C[5]2Fe)(C[6]C[6]H)2{1|C<3>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	118.7830	0.000	1	118.7830	0.000	1	116.9425	6.775	2	118.6049	9.159	87	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	4:3:3:	3:	C[6]-3:C[6]-2:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6])(H)	C[6](C[6]C[6]RhH)(C[6]C[6]H)(CHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6])(H){1|Rh<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]RhH)(C[6]C[6]H)(CHH){1|C<2>,1|H<1>}	H(C[6]C[6]2)	110.5880	0.000	1	110.5880	0.000	1	110.5880	0.000	1	118.6049	9.159	87	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	4:3:3:	3:	C[6]-3:C[6]-2:H-1:	C[6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6])(H)	C[6](C[6]C[6]2Rh)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6])(H){1|Rh<6>,1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]C[6]2Rh)(C[6]C[6]H)2{1|C<3>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	120.3160	0.000	1	120.3160	0.000	1	115.2470	53.162	4	118.6049	9.159	87	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	4:3:3:	3:	C[6]-3:C[6]-2:H-1:	C[6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6])(H)	C[6](C[6]C[6]N[6]H)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6])(H){1|C<3>,1|C<4>,1|N<3>,3|H<1>}	C[6](C[6]C[6]N[6]H)(C[6]C[6]H)2{1|S<4>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	121.3340	0.000	1	121.3340	0.000	1	115.2470	53.162	4	118.6049	9.159	87	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	4:3:3:	3:	C[6]-3:C[6]-2:H-1:	C[6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6])(H)	C[6](C[6]C[6a]C[6]H)(C[6]C[6]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6])(H){1|H<1>,4|C<3>}	C[6](C[6]C[6a]C[6]H)(C[6]C[6]2)(C[6]C[6]H){2|C<3>,3|C<2>,3|H<1>}	H(C[6]C[6]2)	113.8230	0.000	1	113.8230	0.000	1	115.2470	53.162	4	118.6049	9.159	87	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	4:3:3:	3:	C[6]-3:C[6]-2:H-1:	C[6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6])(H)	C[6](C[6]N[6]O[6]C)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6])(H){1|C<3>,1|C<4>,1|N<3>,1|O<2>,2|H<1>}	C[6](C[6]N[6]O[6]C)(C[6]C[6]H)2{1|H<1>,4|C<3>}	H(C[6]C[6]2)	105.5150	0.000	1	105.5150	0.000	1	115.2470	53.162	4	118.6049	9.159	87	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	4:3:3:	3:	C[6]-3:C[6]-2:H-1:	Ge-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]Ge)(C[6]C[6])(H)	C[6](GeC[6]2Ge)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]Ge)(C[6]C[6])(H){1|C<3>,2|H<1>}	C[6](GeC[6]2Ge)(C[6]C[6]H)2{1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.4520	0.000	1	119.4520	0.000	1	119.4520	0.000	1	118.6049	9.159	87	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	4:3:3:	3:	C[6]-3:C[6]-2:H-1:	P-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]P)(C[6]C[6])(H)	C[6](PC[5]C[6]Pd)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]P)(C[6]C[6])(H){1|C<3>,2|H<1>}	C[6](PC[5]C[6]Pd)(C[6]C[6]H)2{1|C<3>,1|H<1>}	H(C[6]C[6]2)	118.7240	0.000	1	118.7240	0.000	1	119.9141	8.716	27	118.6049	9.159	87	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	4:3:3:	3:	C[6]-3:C[6]-2:H-1:	P-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]P)(C[6]C[6])(H)	C[6](PC[6a]2Ag)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]P)(C[6]C[6])(H){1|C<3>,2|H<1>}	C[6](PC[6a]2Ag)(C[6]C[6]H)2{1|C<3>,1|H<1>}	H(C[6]C[6]2)	116.9080	0.000	1	116.9080	0.000	1	119.9141	8.716	27	118.6049	9.159	87	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	4:3:3:	3:	C[6]-3:C[6]-2:H-1:	P-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]P)(C[6]C[6])(H)	C[6](PC[6a]2C[6])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]P)(C[6]C[6])(H){1|C<3>,1|H<1>}	C[6](PC[6a]2C[6])(C[6]C[6]H)2{1|C<2>,1|H<1>}	H(C[6]C[6]2)	120.2530	0.000	1	120.2530	0.000	1	119.9141	8.716	27	118.6049	9.159	87	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	4:3:3:	3:	C[6]-3:C[6]-2:H-1:	P-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]P)(C[6]C[6])(H)	C[6](PC[6a]2Cu)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]P)(C[6]C[6])(H){1|C<3>,2|H<1>}	C[6](PC[6a]2Cu)(C[6]C[6]H)2{1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2443	1.205	3	120.2443	1.453	3	119.9141	8.716	27	118.6049	9.159	87	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	4:3:3:	3:	C[6]-3:C[6]-2:H-1:	P-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]P)(C[6]C[6])(H)	C[6](PC[6a]2Ir)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]P)(C[6]C[6])(H){1|C<3>,2|H<1>}	C[6](PC[6a]2Ir)(C[6]C[6]H)2{1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4370	0.000	1	120.4370	0.000	1	119.9141	8.716	27	118.6049	9.159	87	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	4:3:3:	3:	C[6]-3:C[6]-2:H-1:	P-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]P)(C[6]C[6])(H)	C[6](PC[6a]2Pd)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]P)(C[6]C[6])(H){1|C<3>,2|H<1>}	C[6](PC[6a]2Pd)(C[6]C[6]H)2{1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.5800	4.397	3	121.5800	19.334	3	119.9141	8.716	27	118.6049	9.159	87	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	4:3:3:	3:	C[6]-3:C[6]-2:H-1:	P-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]P)(C[6]C[6])(H)	C[6](PC[6a]2Pt)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]P)(C[6]C[6])(H){1|C<3>,1|F<1>,1|H<1>}	C[6](PC[6a]2Pt)(C[6]C[6]H)2{1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.9140	4.510	2	120.9140	20.339	2	119.9141	8.716	27	118.6049	9.159	87	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	4:3:3:	3:	C[6]-3:C[6]-2:H-1:	P-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]P)(C[6]C[6])(H)	C[6](PC[6a]2Ru)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]P)(C[6]C[6])(H){1|C<3>,1|H<1>}	C[6](PC[6a]2Ru)(C[6]C[6]H)2{1|C<2>,1|H<1>}	H(C[6]C[6]2)	115.8670	0.000	1	115.8670	0.000	1	119.9141	8.716	27	118.6049	9.159	87	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	4:3:3:	3:	C[6]-3:C[6]-2:H-1:	P-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]P)(C[6]C[6])(H)	C[6](PC[6a]C[6]Ni)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]P)(C[6]C[6])(H){1|C<2>,2|H<1>}	C[6](PC[6a]C[6]Ni)(C[6]C[6]H)2{1|C<3>}	H(C[6]C[6]2)	120.7080	1.476	2	120.7080	2.180	2	119.9141	8.716	27	118.6049	9.159	87	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	4:3:3:	3:	C[6]-3:C[6]-2:H-1:	P-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]P)(C[6]C[6])(H)	C[6](PC[6a]C[6]O)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]P)(C[6]C[6])(H){1|C<3>,2|H<1>}	C[6](PC[6a]C[6]O)(C[6]C[6]H)2{1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.2090	0.000	1	119.2090	0.000	1	119.9141	8.716	27	118.6049	9.159	87	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	4:3:3:	3:	C[6]-3:C[6]-2:H-1:	P-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]P)(C[6]C[6])(H)	C[6](PC[6a]C[6]Pd)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]P)(C[6]C[6])(H){1|C<3>,2|H<1>}	C[6](PC[6a]C[6]Pd)(C[6]C[6]H)2{1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.1680	0.000	1	119.1680	0.000	1	119.9141	8.716	27	118.6049	9.159	87	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	4:3:3:	3:	C[6]-3:C[6]-2:H-1:	P-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]P)(C[6]C[6])(H)	C[6](PC[6a]C[6]S)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]P)(C[6]C[6])(H){1|C<3>,2|H<1>}	C[6](PC[6a]C[6]S)(C[6]C[6]H)2{1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.3690	2.447	2	121.3690	5.986	2	119.9141	8.716	27	118.6049	9.159	87	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	4:3:3:	3:	C[6]-3:C[6]-2:H-1:	P-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]P)(C[6]C[6])(H)	C[6](PC[6a]C[6]Sb)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]P)(C[6]C[6])(H){1|C<3>,2|H<1>}	C[6](PC[6a]C[6]Sb)(C[6]C[6]H)2{1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.1060	0.000	1	119.1060	0.000	1	119.9141	8.716	27	118.6049	9.159	87	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	4:3:3:	3:	C[6]-3:C[6]-2:H-1:	P-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]P)(C[6]C[6])(H)	C[6](PC[6a]CrH)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]P)(C[6]C[6])(H){1|C<3>,2|H<1>}	C[6](PC[6a]CrH)(C[6]C[6]H)2{1|C<3>,1|H<1>}	H(C[6]C[6]2)	117.7080	0.000	1	117.7080	0.000	1	119.9141	8.716	27	118.6049	9.159	87	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	4:3:3:	3:	C[6]-3:C[6]-2:H-1:	P-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]P)(C[6]C[6])(H)	C[6](PC[6a]MoC)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]P)(C[6]C[6])(H){1|C<3>,2|H<1>}	C[6](PC[6a]MoC)(C[6]C[6]H)2{1|C<3>,1|H<1>}	H(C[6]C[6]2)	117.9657	2.339	3	117.9657	5.469	3	119.9141	8.716	27	118.6049	9.159	87	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	4:3:3:	3:	C[6]-3:C[6]-2:H-1:	P-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]P)(C[6]C[6])(H)	C[6](PC[6a]PdC)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]P)(C[6]C[6])(H){1|C<3>,2|H<1>}	C[6](PC[6a]PdC)(C[6]C[6]H)2{1|C<3>,1|H<1>}	H(C[6]C[6]2)	124.3845	5.510	2	124.3845	30.365	2	119.9141	8.716	27	118.6049	9.159	87	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	4:3:3:	3:	C[6]-3:C[6]-2:H-1:	P-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]P)(C[6]C[6])(H)	C[6](PC[6a]RuC)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]P)(C[6]C[6])(H){1|C<3>,2|H<1>}	C[6](PC[6a]RuC)(C[6]C[6]H)2{1|C<3>,1|H<1>}	H(C[6]C[6]2)	116.1810	0.000	1	116.1810	0.000	1	119.9141	8.716	27	118.6049	9.159	87	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	4:3:3:	3:	C[6]-3:C[6]-2:H-1:	P[6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]P[6])(C[6]C[6])(H)	C[6](P[6]C[6a]N[6]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]P[6])(C[6]C[6])(H){2|C<3>,2|H<1>,2|N<2>}	C[6](P[6]C[6a]N[6]2)(C[6]C[6]H)2{1|H<1>,2|P<4>,3|C<3>}	H(C[6]C[6]2)	121.9220	0.000	1	121.9220	0.000	1	121.9220	0.000	1	118.6049	9.159	87	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	4:3:3:	3:	C[6]-3:C[6]-2:H-1:	Si-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]Si)(C[6]C[6])(H)	C[6](SiC[6a]2C)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]Si)(C[6]C[6])(H){1|C<2>,2|H<1>}	C[6](SiC[6a]2C)(C[6]C[6]H)2{1|C<3>}	H(C[6]C[6]2)	117.2350	2.031	2	117.2350	4.124	2	118.6451	5.537	8	118.6049	9.159	87	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	4:3:3:	3:	C[6]-3:C[6]-2:H-1:	Si-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]Si)(C[6]C[6])(H)	C[6](SiC[6a]2C[5])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]Si)(C[6]C[6])(H){1|C<3>,2|H<1>}	C[6](SiC[6a]2C[5])(C[6]C[6]H)2{1|C<3>,1|H<1>}	H(C[6]C[6]2)	118.5630	0.000	1	118.5630	0.000	1	118.6451	5.537	8	118.6049	9.159	87	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	4:3:3:	3:	C[6]-3:C[6]-2:H-1:	Si-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]Si)(C[6]C[6])(H)	C[6](SiC[6a]2C[6])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]Si)(C[6]C[6])(H){1|C<3>,2|H<1>}	C[6](SiC[6a]2C[6])(C[6]C[6]H)2{1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.6890	0.000	1	121.6890	0.000	1	118.6451	5.537	8	118.6049	9.159	87	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	4:3:3:	3:	C[6]-3:C[6]-2:H-1:	Si-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]Si)(C[6]C[6])(H)	C[6](SiC[6a]2O[4])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]Si)(C[6]C[6])(H){1|C<3>,2|H<1>}	C[6](SiC[6a]2O[4])(C[6]C[6]H)2{1|C<3>,1|H<1>}	H(C[6]C[6]2)	116.9570	0.000	1	116.9570	0.000	1	118.6451	5.537	8	118.6049	9.159	87	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	4:3:3:	3:	C[6]-3:C[6]-2:H-1:	Si-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]Si)(C[6]C[6])(H)	C[6](SiC[6a]CC)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]Si)(C[6]C[6])(H){1|C<3>,2|H<1>}	C[6](SiC[6a]CC)(C[6]C[6]H)2{1|C<3>,1|H<1>}	H(C[6]C[6]2)	122.4770	0.000	1	122.4770	0.000	1	118.6451	5.537	8	118.6049	9.159	87	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	4:3:3:	3:	C[6]-3:C[6]-2:H-1:	Si-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]Si)(C[6]C[6])(H)	C[6](SiC[6a]C[6]Si)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]Si)(C[6]C[6])(H){1|C<3>,2|H<1>}	C[6](SiC[6a]C[6]Si)(C[6]C[6]H)2{1|C<3>,1|H<1>}	H(C[6]C[6]2)	117.5025	1.115	2	117.5025	1.243	2	118.6451	5.537	8	118.6049	9.159	87	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	4:3:3:	3:	C[6]-3:C[6]-2:H-1:	Si[6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]Si[6]C[6])(C[6]C[6])(H)	C[6](Si[6]C[6a]O[6]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]Si[6]C[6])(C[6]C[6])(H){2|C<3>,2|H<1>,2|O<2>}	C[6](Si[6]C[6a]O[6]2)(C[6]C[6]H)2{2|Si<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	117.4940	0.000	1	117.4940	0.000	1	117.4940	0.000	1	118.6049	9.159	87	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	4:3:3:	3:	C[6]-3:N[6]-2:H-1:	C[5,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5,6]C[6])(N[6]C[6])(H)	C[6](C[5,6]C[5,5,6]C[5,6]H)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[5,6]C[6])(N[6]C[6])(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[5,6]C[5,5,6]C[5,6]H)(C[6]C[6]H)(C[6]N[6]H){1|C<2>,1|N<3>,2|C<4>,4|H<1>}	H(C[6]C[6]N[6])	119.6050	0.000	1	119.6050	0.000	1	119.6050	0.000	1	118.6049	9.159	87	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	4:3:3:	3:	C[6]-3:N[6]-2:H-1:	C[5]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(N[6]C[6])(H)	C[6](C[5]C[5]2Fe)(C[6]N[6]H)2	H(C[6]C[6]N[6])	C[6](C[6]C[5]C[6])(N[6]C[6])(H){1|Fe<10>,1|N<3>,2|C<4>,2|H<1>}	C[6](C[5]C[5]2Fe)(C[6]N[6]H)2{1|Cu<6>,1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]N[6])	117.5710	0.000	1	118.2852	0.162	5	118.2852	0.162	5	118.6049	9.159	87	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	4:3:3:	3:	C[6]-3:N[6]-2:H-1:	C[5]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(N[6]C[6])(H)	C[6](C[5]C[5]2Fe)(C[6]N[6]H)2	H(C[6]C[6]N[6])	C[6](C[6]C[5]C[6])(N[6]C[6])(H){1|Fe<10>,1|N<3>,2|C<4>,2|H<1>}	C[6](C[5]C[5]2Fe)(C[6]N[6]H)2{1|Ni<6>,1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]N[6])	118.4760	0.066	3	118.2852	0.162	5	118.2852	0.162	5	118.6049	9.159	87	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	4:3:3:	3:	C[6]-3:N[6]-2:H-1:	C[5]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(N[6]C[6])(H)	C[6](C[5]C[5]2Fe)(C[6]N[6]H)2	H(C[6]C[6]N[6])	C[6](C[6]C[5]C[6])(N[6]C[6])(H){1|Fe<10>,1|N<3>,2|C<4>,2|H<1>}	C[6](C[5]C[5]2Fe)(C[6]N[6]H)2{1|Zn<6>,1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]N[6])	118.4270	0.000	1	118.2852	0.162	5	118.2852	0.162	5	118.6049	9.159	87	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	4:3:3:	3:	C[6]-3:N[6]-2:H-1:	C[5]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(N[6]C[6])(H)	C[6](C[5]C[5]2Fe)(N[6]C[6]Pd)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[5]N[6])(N[6]C[6])(H){1|Fe<10>,1|Pd<4>,1|C<3>,1|H<1>,2|C<4>}	C[6](C[5]C[5]2Fe)(N[6]C[6]Pd)(C[6]N[6]H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]N[6])	118.2760	0.588	3	118.2760	0.346	3	118.2760	0.346	3	118.6049	9.159	87	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	4:3:3:	3:	C[6]-3:N[6]-2:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6])(H)	C[6](C[6]C[6a]N[6]H)(C[6]N[6]H)(CC[6a]O)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6])(H){1|C<3>,1|H<1>,1|N<2>,1|S<1>}	C[6](C[6]C[6a]N[6]H)(C[6]N[6]H)(CC[6a]O){3|C<3>}	H(C[6]C[6]N[6])	118.8870	0.000	1	118.8870	0.000	1	118.6635	0.100	2	118.6049	9.159	87	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	4:3:3:	3:	C[6]-3:N[6]-2:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6])(H)	C[6](C[6]N[6]HH)(C[6]N[6]H)(COO)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6])(H){1|N<3>,1|O<2>,2|H<1>}	C[6](C[6]N[6]HH)(C[6]N[6]H)(COO){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4400	0.000	1	118.4400	0.000	1	118.6635	0.100	2	118.6049	9.159	87	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	4:3:3:	3:	C[6]-3:N[6]-2:H-1:	C[6]-4:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(N[6]C[6])(H)	C[6](C[6]C[6]NiH)(C[6a]C[6a]2)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[6a]C[6])(N[6]C[6])(H){1|Ni<5>,1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]C[6]NiH)(C[6a]C[6a]2)(C[6]N[6]H){1|H<1>,1|P<4>,4|C<3>}	H(C[6]C[6]N[6])	117.7850	0.000	1	117.7850	0.000	1	117.7850	0.000	1	118.6049	9.159	87	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	4:3:3:	3:	C[6]-3:O[6]-2:H-1:	C[5,6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[5,6]C)(O[6]C[5,6])(H)	C[6](C[5,6]C[5,5,6]C[5]H)(C[6]O[6]H)(CNO)	H(C[6]C[6]O[6])	C[6](C[6]C[5,6]C)(O[6]C[5,6])(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[5,6]C[5,5,6]C[5]H)(C[6]O[6]H)(CNO){3|C<4>,3|H<1>}	H(C[6]C[6]O[6])	117.7910	0.000	1	117.7910	0.000	1	117.4693	0.052	4	118.6049	9.159	87	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	4:3:3:	3:	C[6]-3:O[6]-2:H-1:	C[5,6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[5,6]C)(O[6]C[6])(H)	C[6](C[5,6]C[5,6]C[5]H)(C[6]O[6]H)(COO)	H(C[6]C[6]O[6])	C[6](C[6]C[5,6]C)(O[6]C[6])(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[5,6]C[5,6]C[5]H)(C[6]O[6]H)(COO){1|C<4>,2|C<3>,3|H<1>}	H(C[6]C[6]O[6])	117.3810	0.132	2	117.3620	0.010	3	117.4693	0.052	4	118.6049	9.159	87	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	4:3:3:	3:	C[6]-3:O[6]-2:H-1:	C[5,6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[5,6]C)(O[6]C[6])(H)	C[6](C[5,6]C[5,6]C[5]H)(C[6]O[6]H)(COO)	H(C[6]C[6]O[6])	C[6](C[6]C[5,6]C)(O[6]C[6])(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[5,6]C[5,6]C[5]H)(C[6]O[6]H)(COO){3|C<4>,3|H<1>}	H(C[6]C[6]O[6])	117.3240	0.000	1	117.3620	0.010	3	117.4693	0.052	4	118.6049	9.159	87	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	4:3:3:	3:	C[6]-3:O[6]-2:H-1:	C[6,6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6]C)(O[6]C[6])(H)	C[6](C[6,6]C[6,6]C[6]H)(C[6]O[6]H)(CCO)	H(C[6]C[6]O[6])	C[6](C[6]C[6,6]C)(O[6]C[6])(H){2|C<4>,3|H<1>}	C[6](C[6,6]C[6,6]C[6]H)(C[6]O[6]H)(CCO){3|C<4>,3|H<1>}	H(C[6]C[6]O[6])	116.8770	0.000	1	116.8770	0.000	1	116.9830	0.108	8	118.6049	9.159	87	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	4:3:3:	3:	C[6]-3:O[6]-2:H-1:	C[6,6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6]C)(O[6]C[6])(H)	C[6](C[6,6]C[6,6]C[6]H)(C[6]O[6]H)(COO)	H(C[6]C[6]O[6])	C[6](C[6]C[6,6]C)(O[6]C[6])(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[6,6]C[6,6]C[6]H)(C[6]O[6]H)(COO){3|C<4>,3|H<1>}	H(C[6]C[6]O[6])	117.2910	0.544	2	116.9981	0.124	7	116.9830	0.108	8	118.6049	9.159	87	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	4:3:3:	3:	C[6]-3:O[6]-2:H-1:	C[6,6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6]C)(O[6]C[6])(H)	C[6](C[6,6]C[6,6]C[6]H)(C[6]O[6]H)(COO)	H(C[6]C[6]O[6])	C[6](C[6]C[6,6]C)(O[6]C[6])(H){2|H<1>,3|C<4>}	C[6](C[6,6]C[6,6]C[6]H)(C[6]O[6]H)(COO){3|C<4>,3|H<1>}	H(C[6]C[6]O[6])	116.8810	0.227	5	116.9981	0.124	7	116.9830	0.108	8	118.6049	9.159	87	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	4:3:3:	3:	C[6]-3:O[6]-2:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(O[6]C[6])(H)	C[6](C[6]C[6]CH)(C[6]O[6]H)(COO)	H(C[6]C[6]O[6])	C[6](C[6]C[6]C)(O[6]C[6])(H){1|C<3>,1|C<4>,1|O<2>,2|H<1>}	C[6](C[6]C[6]CH)(C[6]O[6]H)(COO){1|C<3>,1|C<4>}	H(C[6]C[6]O[6])	116.7620	0.000	1	117.2650	0.205	4	117.1809	0.123	7	118.6049	9.159	87	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	4:3:3:	3:	C[6]-3:O[6]-2:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(O[6]C[6])(H)	C[6](C[6]C[6]CH)(C[6]O[6]H)(COO)	H(C[6]C[6]O[6])	C[6](C[6]C[6]C)(O[6]C[6])(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[6]C[6]CH)(C[6]O[6]H)(COO){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]O[6])	117.4327	0.372	3	117.2650	0.205	4	117.1809	0.123	7	118.6049	9.159	87	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	4:3:3:	3:	C[6]-3:O[6]-2:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(O[6]C[6])(H)	C[6](C[6]C[6]HN)(C[6]O[6]H)(COO)	H(C[6]C[6]O[6])	C[6](C[6]C[6]C)(O[6]C[6])(H){1|N<3>,2|C<4>,2|H<1>}	C[6](C[6]C[6]HN)(C[6]O[6]H)(COO){1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[6]O[6])	116.9060	0.000	1	116.9060	0.000	1	117.1809	0.123	7	118.6049	9.159	87	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	4:3:3:	3:	C[6]-3:O[6]-2:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(O[6]C[6])(H)	C[6](C[6]C[6]HO)(C[6]O[6]H)(CHO)	H(C[6]C[6]O[6])	C[6](C[6]C[6]C)(O[6]C[6])(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[6]C[6]HO)(C[6]O[6]H)(CHO){1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[6]O[6])	117.1500	0.140	2	117.1500	0.020	2	117.1809	0.123	7	118.6049	9.159	87	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	4:3:3:	3:	C[6]-3:O[6]-2:H-1:	C[6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(O[6]C[6])(H)	C[6](C[6]C[6,6]O[6]C)(C[6]C[6]O)(C[6]O[6]H)	H(C[6]C[6]O[6])	C[6](C[6]C[6]2)(O[6]C[6])(H){1|H<1>,1|O<1>,2|O<2>,3|C<4>}	C[6](C[6]C[6,6]O[6]C)(C[6]C[6]O)(C[6]O[6]H){1|H<1>,6|C<4>}	H(C[6]C[6]O[6])	117.0170	0.000	1	117.0170	0.000	1	117.0170	0.000	1	118.6049	9.159	87	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	4:3:3:	3:	C[6]-3:O[6]-2:H-1:	C[6]-4:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(O[6]C[6])(H)	C[6](C[6]C[6a]C[6]H)(C[6a]C[6a]2)(C[6]O[6]H)	H(C[6]C[6]O[6])	C[6](C[6]C[6a]C[6])(O[6]C[6])(H){1|C<4>,1|H<1>,1|O<1>,3|C<3>}	C[6](C[6]C[6a]C[6]H)(C[6a]C[6a]2)(C[6]O[6]H){4|H<1>,5|C<3>}	H(C[6]C[6]O[6])	117.8060	0.000	1	117.8060	0.000	1	117.8060	0.000	1	118.6049	9.159	87	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	4:3:4:	3:	C[6]-3:O[6]-2:H-1:	C[6,6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6]C)(O[6]C[6,6])(H)	C[6](C[6,6]C[3x6]C[6]H)(C[6]O[6]H)(CH3)	H(C[6]C[6]O[6])	C[6](C[6]C[6,6]C)(O[6]C[6,6])(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[6,6]C[3x6]C[6]H)(C[6]O[6]H)(CH3){1|O<2>,2|H<1>,3|C<4>}	H(C[6]C[6]O[6])	116.8960	0.000	1	116.8960	0.000	1	116.8960	0.000	1	116.9643	0.088	7	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	4:3:4:	3:	C[6]-3:O[6]-2:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(O[6]C[6])(H)	C[6](C[6]C[6]CH)(C[6]O[6]H)(CCHO)	H(C[6]C[6]O[6])	C[6](C[6]C[6]C)(O[6]C[6])(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[6]C[6]CH)(C[6]O[6]H)(CCHO){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]O[6])	116.5930	0.000	1	116.5930	0.000	1	116.9757	0.105	6	116.9643	0.088	7	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	4:3:4:	3:	C[6]-3:O[6]-2:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(O[6]C[6])(H)	C[6](C[6]C[6]HH)(C[6]O[6]H)(CCCO)	H(C[6]C[6]O[6])	C[6](C[6]C[6]C)(O[6]C[6])(H){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]O[6]H)(CCCO){1|C<4>,2|H<1>}	H(C[6]C[6]O[6])	116.8840	0.019	3	116.8840	0.000	3	116.9757	0.105	6	116.9643	0.088	7	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	4:3:4:	3:	C[6]-3:O[6]-2:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(O[6]C[6])(H)	C[6](C[6]C[6]HH)(C[6]O[6]H)(CH3)	H(C[6]C[6]O[6])	C[6](C[6]C[6]C)(O[6]C[6])(H){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]O[6]H)(CH3){3|C<4>}	H(C[6]C[6]O[6])	117.0450	0.000	1	117.0450	0.000	1	116.9757	0.105	6	116.9643	0.088	7	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:2:1:	4:3:4:	3:	C[6]-3:O[6]-2:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(O[6]C[6])(H)	C[6](C[6]O[6]HN)(C[6]O[6]H)(CH3)	H(C[6]C[6]O[6])	C[6](C[6]C[6]C)(O[6]C[6])(H){1|C<4>,1|N<2>,1|O<2>,2|H<1>}	C[6](C[6]O[6]HN)(C[6]O[6]H)(CH3){1|C<4>}	H(C[6]C[6]O[6])	117.5640	0.000	1	117.5640	0.000	1	116.9757	0.105	6	116.9643	0.088	7	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-2:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]Br)(H)	C[6](C[6]C[6,6a])(C[6]C[6]H)(Br)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]Br)(H){2|C<3>}	C[6](C[6]C[6,6a])(C[6]C[6]H)(Br){1|H<1>,2|C<3>}	H(C[6]C[6]2)	122.6260	0.000	1	122.6260	0.000	1	122.6260	0.000	1	119.3864	12.016	111	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-2:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[3x6]H)(C[6]C[6]H)(H)	C[6](C[6]C[3x6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[3x6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>}	C[6](C[6]C[3x6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.2150	0.000	1	120.2150	0.000	1	119.4644	37.109	31	119.3864	12.016	111	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-2:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>}	C[6](C[6]C[5,6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	116.1330	0.000	1	117.1637	71.212	14	119.4644	37.109	31	119.3864	12.016	111	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-2:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>}	C[6](C[6]C[5,6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6090	0.000	1	117.1637	71.212	14	119.4644	37.109	31	119.3864	12.016	111	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-2:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>}	C[6](C[6]C[5,6])(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	89.0647	0.000	1	117.1637	71.212	14	119.4644	37.109	31	119.3864	12.016	111	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-2:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|N<3>}	C[6](C[6]C[5,6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	118.5280	0.000	1	117.1637	71.212	14	119.4644	37.109	31	119.3864	12.016	111	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-2:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|N<3>}	C[6](C[6]C[5,6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	H(C[6]C[6]2)	121.0490	0.000	1	117.1637	71.212	14	119.4644	37.109	31	119.3864	12.016	111	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-2:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|S<2>}	C[6](C[6]C[5,6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	118.4777	3.954	3	117.1637	71.212	14	119.4644	37.109	31	119.3864	12.016	111	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-2:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ru<8>,2|C<4>}	C[6](C[6]C[5,6])(C[6]C[6]H)(H){1|Ru<8>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	118.6700	0.000	1	117.1637	71.212	14	119.4644	37.109	31	119.3864	12.016	111	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-2:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Zr<13>,2|C<4>}	C[6](C[6]C[5,6])(C[6]C[6]H)(H){1|Zr<13>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	122.1910	0.000	1	117.1637	71.212	14	119.4644	37.109	31	119.3864	12.016	111	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-2:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){2|C<3>}	C[6](C[6]C[5,6])(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9230	0.000	1	117.1637	71.212	14	119.4644	37.109	31	119.3864	12.016	111	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-2:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){2|C<3>}	C[6](C[6]C[5,6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	116.3140	0.000	1	117.1637	71.212	14	119.4644	37.109	31	119.3864	12.016	111	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-2:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){2|C<3>}	C[6](C[6]C[5,6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<4>}	H(C[6]C[6]2)	122.0820	0.000	1	117.1637	71.212	14	119.4644	37.109	31	119.3864	12.016	111	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-2:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){2|C<3>}	C[6](C[6]C[5,6])(C[6]C[6]H)(H){1|Se<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2950	0.000	1	117.1637	71.212	14	119.4644	37.109	31	119.3864	12.016	111	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-2:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5a,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H){1|C<3>,1|N<3>}	C[6](C[6]C[5a,6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	122.2840	0.000	1	120.8858	3.655	4	119.4644	37.109	31	119.3864	12.016	111	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-2:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5a,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H){1|C<3>,1|N<3>}	C[6](C[6]C[5a,6])(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	118.9710	0.000	1	120.8858	3.655	4	119.4644	37.109	31	119.3864	12.016	111	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-2:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5a,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H){2|C<3>}	C[6](C[6]C[5a,6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.5300	0.000	1	120.8858	3.655	4	119.4644	37.109	31	119.3864	12.016	111	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-2:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5a,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H){2|C<3>}	C[6](C[6]C[5a,6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	H(C[6]C[6]2)	122.7580	0.000	1	120.8858	3.655	4	119.4644	37.109	31	119.3864	12.016	111	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-2:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|N<3>}	C[6](C[6]C[6,6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	119.0730	0.000	1	121.3328	2.332	4	119.4644	37.109	31	119.3864	12.016	111	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-2:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){2|C<3>}	C[6](C[6]C[6,6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	121.7480	0.000	1	121.3328	2.332	4	119.4644	37.109	31	119.3864	12.016	111	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-2:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){2|C<3>}	C[6](C[6]C[6,6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	122.1630	0.000	1	121.3328	2.332	4	119.4644	37.109	31	119.3864	12.016	111	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-2:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){2|C<3>}	C[6](C[6]C[6,6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	122.3470	0.000	1	121.3328	2.332	4	119.4644	37.109	31	119.3864	12.016	111	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-2:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]C[6]H)(H){2|C<3>}	C[6](C[6]C[6,6a])(C[6]C[6]H)(H){1|C<4>,2|C<3>}	H(C[6]C[6]2)	118.8880	0.000	1	118.8880	0.000	1	119.4644	37.109	31	119.3864	12.016	111	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-2:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H){1|C<3>,1|N<2>}	C[6](C[6]C[6,6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	121.3580	0.000	1	122.1610	3.602	7	119.4644	37.109	31	119.3864	12.016	111	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-2:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H){2|C<3>}	C[6](C[6]C[6,6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	122.2948	2.043	6	122.1610	3.602	7	119.4644	37.109	31	119.3864	12.016	111	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-2:C[6]-3:I-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]I)(H)	C[6](C[6]C[5,6])(C[6]C[6]H)(I)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]I)(H){1|C<3>,1|N<3>}	C[6](C[6]C[5,6])(C[6]C[6]H)(I){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	121.1620	0.000	1	121.1620	0.000	1	121.1620	0.000	1	119.3864	12.016	111	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-2:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](N[6]C[5,6])(C[6]C[6]H)(H){2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.7130	0.000	1	119.8976	0.036	5	120.1499	0.491	22	119.3864	12.016	111	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-2:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Ru<10>,2|C<4>}	C[6](N[6]C[5,6])(C[6]C[6]H)(H){1|Ru<10>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.9437	0.185	4	119.8976	0.036	5	120.1499	0.491	22	119.3864	12.016	111	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-2:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]N)(C[6]N[6]H)(H)	C[6](N[6]C[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]N)(C[6]N[6]H)(H){1|Fe<10>,2|C<4>}	C[6](N[6]C[5,6])(C[6]C[6]H)(H){1|Fe<10>,1|N<3>,2|C<4>}	H(C[6]C[6]2)	117.6660	0.000	1	117.6660	0.000	1	120.1499	0.491	22	119.3864	12.016	111	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-2:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Mo<9>,2|C<4>}	C[6](N[6]C[6,6])(C[6]C[6]H)(H){1|Mo<9>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	120.4080	0.714	2	120.4080	0.510	2	120.1499	0.491	22	119.3864	12.016	111	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-2:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]C[6])(C[6]N[6]H)(H)	C[6](N[6]C[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]C[6])(C[6]N[6]H)(H){2|C<3>,2|N<3>}	C[6](N[6]C[5,6])(C[6]C[6]H)(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.4310	0.000	1	119.4310	0.000	1	120.1499	0.491	22	119.3864	12.016	111	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-2:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>}	C[6](N[6]C[5,6])(C[6]C[6]H)(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.9750	0.000	1	120.4501	0.062	10	120.1499	0.491	22	119.3864	12.016	111	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-2:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]N[6]H)(H){1|C<3>,1|N<2>}	C[6](N[6]C[5,6])(C[6]C[6]H)(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.3918	0.178	9	120.4501	0.062	10	120.1499	0.491	22	119.3864	12.016	111	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-2:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]N)(C[6]N[6]H)(H)	C[6](N[6]C[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]N)(C[6]N[6]H)(H){1|C<3>,1|N<2>}	C[6](N[6]C[5,6])(C[6]C[6]H)(H){3|N<3>}	H(C[6]C[6]2)	120.1360	0.342	2	120.1360	0.117	2	120.1499	0.491	22	119.3864	12.016	111	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-2:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>}	C[6](N[6]C[6,6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|N<4>}	H(C[6]C[6]2)	121.1230	0.000	1	121.1230	0.000	1	120.1499	0.491	22	119.3864	12.016	111	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-2:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]O)(H)	C[6](N[6]C[6,6])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]O)(H){2|C<3>}	C[6](N[6]C[6,6])(C[6]C[6]H)(O){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8710	0.155	3	119.8710	0.024	3	119.7262	0.100	4	119.3864	12.016	111	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-2:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]O)(H)	C[6](N[6]C[6,6a])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]O)(H){2|C<3>}	C[6](N[6]C[6,6a])(C[6]C[6]H)(O){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.2920	0.000	1	119.2920	0.000	1	119.7262	0.100	4	119.3864	12.016	111	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:1:	3:	C[6]-3:C[6]-3:H-1:	O[6]-2:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]O)(C[6]O[6]H)(H)	C[6](O[6]C[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]O[6]H)(H){1|C<4>,2|H<1>}	C[6](O[6]C[5,6])(C[6]C[6]H)(H){1|C<4>,1|O<1>,2|C<3>}	H(C[6]C[6]2)	119.5870	0.197	2	119.5870	0.039	2	119.5870	0.039	2	119.3864	12.016	111	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:1:	3:	C[6]-3:C[6]-3:H-1:	O[6]-2:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[4,6]O)(C[6]O[6]O)(H)	C[6](O[6]C[4,6])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[4,6]O)(C[6]O[6]O)(H){1|H<1>,2|C<4>}	C[6](O[6]C[4,6])(C[6]C[6]H)(O){1|C<3>,1|O<2>,2|C<4>}	H(C[6]C[6]2)	119.3300	0.000	1	119.3300	0.000	1	118.7108	1.397	19	119.3864	12.016	111	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:1:	3:	C[6]-3:C[6]-3:H-1:	O[6]-2:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6,6]C)(C[6]O[6]O)(H)	C[6](O[6]C[5,6,6])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6,6]C)(C[6]O[6]O)(H){1|O<2>,2|C<4>}	C[6](O[6]C[5,6,6])(C[6]C[6]H)(O){1|O<2>,3|C<4>}	H(C[6]C[6]2)	118.3050	0.000	1	118.3050	0.000	1	118.7108	1.397	19	119.3864	12.016	111	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:1:	3:	C[6]-3:C[6]-3:H-1:	O[6]-2:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]O[6]O)(H)	C[6](O[6]C[5,6])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]O[6]O)(H){1|C<3>,2|C<4>}	C[6](O[6]C[5,6])(C[6]C[6]H)(O){1|C<4>,1|O<2>,2|H<1>}	H(C[6]C[6]2)	118.6575	0.054	2	118.6916	0.307	5	118.7108	1.397	19	119.3864	12.016	111	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:1:	3:	C[6]-3:C[6]-3:H-1:	O[6]-2:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]O[6]O)(H)	C[6](O[6]C[5,6])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]O[6]O)(H){1|C<4>,1|H<1>,1|O<2>}	C[6](O[6]C[5,6])(C[6]C[6]H)(O){2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.1645	0.084	2	118.6916	0.307	5	118.7108	1.397	19	119.3864	12.016	111	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:1:	3:	C[6]-3:C[6]-3:H-1:	O[6]-2:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]O[6]O)(H)	C[6](O[6]C[5,6])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]O[6]O)(H){3|C<4>}	C[6](O[6]C[5,6])(C[6]C[6]H)(O){2|C<4>,2|H<1>}	H(C[6]C[6]2)	117.8140	0.000	1	118.6916	0.307	5	118.7108	1.397	19	119.3864	12.016	111	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:1:	3:	C[6]-3:C[6]-3:H-1:	O[6]-2:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]O[6]O)(H)	C[6](O[6]C[6,6])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]O[6]O)(H){1|C<4>,1|H<1>,1|O<2>}	C[6](O[6]C[6,6])(C[6]C[6]H)(O){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.3067	0.126	3	119.2470	0.026	5	118.7108	1.397	19	119.3864	12.016	111	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:1:	3:	C[6]-3:C[6]-3:H-1:	O[6]-2:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]O[6]O)(H)	C[6](O[6]C[6,6])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]O[6]O)(H){3|C<4>}	C[6](O[6]C[6,6])(C[6]C[6]H)(O){1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.1575	0.218	2	119.2470	0.026	5	118.7108	1.397	19	119.3864	12.016	111	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:1:	3:	C[6]-3:C[6]-3:H-1:	O[6]-2:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]O[6]O)(H)	C[6](O[6]C[6,6])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]O[6]O)(H){1|C<3>,2|C<4>}	C[6](O[6]C[6,6])(C[6]C[6]H)(O){1|C<3>,1|C<4>,1|O<2>}	H(C[6]C[6]2)	120.2910	0.000	1	120.2910	0.000	1	118.7108	1.397	19	119.3864	12.016	111	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:1:	3:	C[6]-3:C[6]-3:H-1:	O[6]-2:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]O[6]O)(H)	C[6](O[6]C[6,6a])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]O[6]O)(H){2|C<3>}	C[6](O[6]C[6,6a])(C[6]C[6]H)(O){3|C<3>}	H(C[6]C[6]2)	114.3960	0.000	1	114.3960	0.000	1	118.7108	1.397	19	119.3864	12.016	111	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:1:	3:	C[6]-3:C[6]-3:H-1:	O[6]-2:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]O)(C[6]O[6]O)(H)	C[6](O[6]C[5,6])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]O[6]O)(H){1|H<1>,2|C<4>}	C[6](O[6]C[5,6])(C[6]C[6]H)(O){1|C<4>,1|O<2>,2|C<3>}	H(C[6]C[6]2)	119.3780	0.000	1	119.3780	0.000	1	118.7108	1.397	19	119.3864	12.016	111	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:1:	3:	C[6]-3:C[6]-3:H-1:	O[6]-2:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]O[6]O)(H)	C[6](O[6]C[5,6])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]O[6]O)(H){1|C<4>,2|C<3>,2|H<1>}	C[6](O[6]C[5,6])(C[6]C[6]H)(O){1|C<4>,3|C<3>}	H(C[6]C[6]2)	118.6187	0.128	3	118.6187	0.016	3	118.7108	1.397	19	119.3864	12.016	111	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:1:	3:	C[6]-3:C[6]-3:H-1:	O[6]-2:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]O[6]O)(H)	C[6](O[6]C[6,6])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]O[6]O)(H){1|C<4>,2|C<3>,2|H<1>}	C[6](O[6]C[6,6])(C[6]C[6]H)(O){1|C<4>,3|C<3>}	H(C[6]C[6]2)	118.2560	0.000	1	118.2560	0.000	1	118.7108	1.397	19	119.3864	12.016	111	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:1:	3:	C[6]-3:C[6]-3:H-1:	O[6]-2:C[6]-3:S-1:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]O[6]S)(H)	C[6](O[6]C[6,6a])(C[6]C[6]H)(S)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]O[6]S)(H){2|C<3>}	C[6](O[6]C[6,6a])(C[6]C[6]H)(S){1|C<4>,2|C<3>}	H(C[6]C[6]2)	112.3420	0.000	1	112.3420	0.000	1	116.9373	9.856	4	119.3864	12.016	111	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:1:	3:	C[6]-3:C[6]-3:H-1:	O[6]-2:C[6]-3:S-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]O[6]S)(H)	C[6](O[6]C[6,6a])(C[6]C[6]H)(S)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]O[6]S)(H){2|C<3>}	C[6](O[6]C[6,6a])(C[6]C[6]H)(S){1|H<1>,2|C<3>}	H(C[6]C[6]2)	118.4690	0.841	3	118.4690	0.707	3	116.9373	9.856	4	119.3864	12.016	111	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:1:	3:	C[6]-3:C[6]-3:H-1:	S[6]-2:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]S[6]H)(H)	C[6](S[6]C[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]S[6]H)(H){2|C<3>}	C[6](S[6]C[5,6])(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	117.8215	0.333	2	117.8215	0.111	2	117.8215	0.111	2	119.3864	12.016	111	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:1:	3:	C[6]-3:C[6]-3:H-1:	S[6]-2:C[6]-3:S-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]S[6]S)(H)	C[6](S[6]C[6,6a])(C[6]C[6]H)(S)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]S[6]S)(H){2|C<3>}	C[6](S[6]C[6,6a])(C[6]C[6]H)(S){1|H<1>,2|C<3>}	H(C[6]C[6]2)	115.3770	0.000	1	115.3770	0.000	1	115.3770	0.000	1	119.3864	12.016	111	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:1:	3:	C[6]-3:C[6]-3:H-1:	Se[6]-2:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]Se[6]H)(H)	C[6](Se[6]C[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]Se[6]H)(H){2|C<3>}	C[6](Se[6]C[5,6])(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	117.8720	0.000	1	117.8720	0.000	1	117.4885	0.294	2	119.3864	12.016	111	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:1:	3:	C[6]-3:C[6]-3:H-1:	Se[6]-2:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(C[6]Se[6]H)(H)	C[6](Se[6]C[5a,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)(C[6]Se[6]H)(H){2|C<3>}	C[6](Se[6]C[5a,6])(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	117.1050	0.000	1	117.1050	0.000	1	117.4885	0.294	2	119.3864	12.016	111	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-2:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(H){2|C<3>}	C[6](C[6]C[6,6a])(C[6]N[6]H)(H){1|Cu<5>,2|C<3>}	H(C[6]C[6]N[6])	119.0420	0.000	1	119.0420	0.000	1	118.3487	13.335	3	119.3864	12.016	111	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-2:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Re)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Re)(C[6]C[6]H)(H){2|C<3>}	C[6](C[6]C[6,6a])(C[6]N[6]H)(H){1|Re<6>,2|C<3>}	H(C[6]C[6]N[6])	121.6040	0.000	1	121.6040	0.000	1	118.3487	13.335	3	119.3864	12.016	111	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-2:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Ru)(C[6]C[6]H)(H){2|C<3>}	C[6](C[6]C[6,6a])(C[6]N[6]H)(H){1|Ru<8>,2|C<3>}	H(C[6]C[6]N[6])	114.4000	0.000	1	114.4000	0.000	1	118.3487	13.335	3	119.3864	12.016	111	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:1:	3:	N[6]-3:C[6]-3:H-1:	N[6]-2:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[5,6]Cu)(C[6]N[6]H)(H)	C[6](N[6]C[5,6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[5,6]Cu)(C[6]N[6]H)(H){1|C<3>,1|S<2>}	C[6](N[6]C[5,6])(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|S<2>}	H(C[6]C[6]N[6])	119.9880	0.000	1	119.9880	0.000	1	119.9491	1.043	19	119.3864	12.016	111	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:1:	3:	N[6]-3:C[6]-3:H-1:	N[6]-2:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6]Cu)(C[6]N[6]H)(H)	C[6](N[6]C[6,6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6]Cu)(C[6]N[6]H)(H){2|C<3>}	C[6](N[6]C[6,6])(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|N<3>}	H(C[6]C[6]N[6])	121.1250	2.273	2	121.1250	5.165	2	119.9491	1.043	19	119.3864	12.016	111	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:1:	3:	N[6]-3:C[6]-3:H-1:	N[6]-2:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]C)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]C)(C[6]N[6]H)(H){2|C<3>}	C[6](N[6]C[6,6a])(C[6]N[6]H)(H){3|C<3>}	H(C[6]C[6]N[6])	120.1520	0.000	1	120.1520	0.000	1	119.9491	1.043	19	119.3864	12.016	111	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:1:	3:	N[6]-3:C[6]-3:H-1:	N[6]-2:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]C[6a])(C[6]N[6]H)(H)	C[6](N[6]C[6,6a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]C[6a])(C[6]N[6]H)(H){4|C<3>}	C[6](N[6]C[6,6a])(C[6]N[6]H)(H){3|C<3>}	H(C[6]C[6]N[6])	120.2957	0.108	3	120.2957	0.012	3	119.9491	1.043	19	119.3864	12.016	111	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:1:	3:	N[6]-3:C[6]-3:H-1:	N[6]-2:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Cu)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Cu)(C[6]N[6]H)(H){2|C<3>}	C[6](N[6]C[6,6a])(C[6]N[6]H)(H){1|Cu<5>,2|C<3>}	H(C[6]C[6]N[6])	120.0345	1.942	2	120.0345	3.773	2	119.9491	1.043	19	119.3864	12.016	111	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:1:	3:	N[6]-3:C[6]-3:H-1:	N[6]-2:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]H)(C[6]N[6]H)(H){2|C<3>}	C[6](N[6]C[6,6a])(C[6]N[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]N[6])	119.9800	0.000	1	119.9800	0.000	1	119.9491	1.043	19	119.3864	12.016	111	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:1:	3:	N[6]-3:C[6]-3:H-1:	N[6]-2:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Ir)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Ir)(C[6]N[6]H)(H){2|C<3>}	C[6](N[6]C[6,6a])(C[6]N[6]H)(H){1|Ir<6>,2|C<3>}	H(C[6]C[6]N[6])	119.6790	0.624	2	119.6790	0.389	2	119.9491	1.043	19	119.3864	12.016	111	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:1:	3:	N[6]-3:C[6]-3:H-1:	N[6]-2:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Ni)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Ni)(C[6]N[6]H)(H){2|C<3>}	C[6](N[6]C[6,6a])(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|N<2>}	H(C[6]C[6]N[6])	120.1430	0.000	1	120.1430	0.000	1	119.9491	1.043	19	119.3864	12.016	111	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:1:	3:	N[6]-3:C[6]-3:H-1:	N[6]-2:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]O)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]O)(C[6]N[6]H)(H){2|C<3>}	C[6](N[6]C[6,6a])(C[6]N[6]H)(H){1|O<1>,2|C<3>}	H(C[6]C[6]N[6])	120.1060	0.000	1	120.1060	0.000	1	119.9491	1.043	19	119.3864	12.016	111	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:1:	3:	N[6]-3:C[6]-3:H-1:	N[6]-2:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Os)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Os)(C[6]N[6]H)(H){2|C<3>}	C[6](N[6]C[6,6a])(C[6]N[6]H)(H){1|Os<4>,2|C<3>}	H(C[6]C[6]N[6])	117.9780	0.000	1	118.6593	0.409	3	119.9491	1.043	19	119.3864	12.016	111	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:1:	3:	N[6]-3:C[6]-3:H-1:	N[6]-2:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Os)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Os)(C[6]N[6]H)(H){2|C<3>}	C[6](N[6]C[6,6a])(C[6]N[6]H)(H){1|Os<5>,2|C<3>}	H(C[6]C[6]N[6])	118.7540	0.000	1	118.6593	0.409	3	119.9491	1.043	19	119.3864	12.016	111	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:1:	3:	N[6]-3:C[6]-3:H-1:	N[6]-2:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Os)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Os)(C[6]N[6]H)(H){2|C<3>}	C[6](N[6]C[6,6a])(C[6]N[6]H)(H){1|Os<6>,2|C<3>}	H(C[6]C[6]N[6])	119.2460	0.000	1	118.6593	0.409	3	119.9491	1.043	19	119.3864	12.016	111	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:1:	3:	N[6]-3:C[6]-3:H-1:	N[6]-2:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Pd)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Pd)(C[6]N[6]H)(H){2|C<3>}	C[6](N[6]C[6,6a])(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|N<3>}	H(C[6]C[6]N[6])	120.3690	0.000	1	120.3690	0.000	1	119.9491	1.043	19	119.3864	12.016	111	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:1:	3:	N[6]-3:C[6]-3:H-1:	N[6]-2:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Ru)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Ru)(C[6]N[6]H)(H){2|C<3>}	C[6](N[6]C[6,6a])(C[6]N[6]H)(H){1|Ru<6>,2|C<3>}	H(C[6]C[6]N[6])	119.7520	0.000	1	119.7520	0.000	1	119.9491	1.043	19	119.3864	12.016	111	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-2:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]N[6]S)(H)	C[6](N[6]C[5,6])(C[6]C[6]H)(SC)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]N[6]S)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](N[6]C[5,6])(C[6]C[6]H)(SC){2|C<4>,2|H<1>}	H(C[6]C[6]2)	120.5030	0.000	1	120.5030	0.000	1	120.1735	0.217	2	119.9757	0.226	3	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-2:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]N[6]S)(H)	C[6](N[6]C[5,6])(C[6]C[6]H)(SC[6a])	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]N[6]S)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](N[6]C[5,6])(C[6]C[6]H)(SC[6a]){2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.8440	0.000	1	119.8440	0.000	1	120.1735	0.217	2	119.9757	0.226	3	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:2:	3:	C[6]-3:C[6]-3:H-1:	O[6]-2:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]O[6]S)(H)	C[6](O[6]C[6,6a])(C[6]C[6]H)(SCr)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]O[6]S)(H){2|C<3>}	C[6](O[6]C[6,6a])(C[6]C[6]H)(SCr){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.5800	0.000	1	119.5800	0.000	1	119.5800	0.000	1	119.9757	0.226	3	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:3:	3:	C[6]-3:C[6]-3:H-1:	O[6]-2:C-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]O[6]C)(H)	C[6](O[6]C[6,6a])(CC[6a]P[6])(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]O[6]C)(H){2|C<3>}	C[6](O[6]C[6,6a])(CC[6a]P[6])(C[6]C[6]H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.2667	0.062	3	119.2667	0.004	3	119.2667	0.004	3	119.1051	3.467	24	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:3:	3:	C[6]-3:C[6]-3:H-1:	O[6]-2:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]O[6])(C[6]C[6,6]C)(H)	C[6](O[6]C[5,6,6])(C[5]C[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]O[6])(C[6]C[6,6]C)(H){1|C<4>,3|C<3>}	C[6](O[6]C[5,6,6])(C[5]C[5]2)(C[6]C[6]H){1|C<2>,1|O<2>,2|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.0120	0.000	1	118.0120	0.000	1	118.7295	1.030	2	119.1051	3.467	24	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:3:	3:	C[6]-3:C[6]-3:H-1:	O[6]-2:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]O[6])(C[6]C[6,6a]H)(H)	C[6](O[6]C[6,6a])(C[5]C[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]O[6])(C[6]C[6,6a]H)(H){4|C<3>}	C[6](O[6]C[6,6a])(C[5]C[5]2)(C[6]C[6]H){1|C<4>,1|H<1>,1|N<2>,1|N<3>,1|O<1>,2|C<3>}	H(C[6]C[6]2)	119.4470	0.000	1	119.4470	0.000	1	118.7295	1.030	2	119.1051	3.467	24	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:3:	3:	C[6]-3:C[6]-3:H-1:	O[6]-2:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]O[6]C)(H)	C[6](O[6]C[6,6a])(C[6]C[6]H)(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]O[6]C)(H){2|C<3>}	C[6](O[6]C[6,6a])(C[6]C[6]H)(CCH){3|C<3>}	H(C[6]C[6]2)	118.8480	0.000	1	118.8480	0.000	1	117.7278	5.931	5	119.1051	3.467	24	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:3:	3:	C[6]-3:C[6]-3:H-1:	O[6]-2:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]O[6]C)(H)	C[6](O[6]C[6,6a])(C[6]C[6]H)(CC[6a]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]O[6]C)(H){2|C<3>}	C[6](O[6]C[6,6a])(C[6]C[6]H)(CC[6a]H){3|C<3>}	H(C[6]C[6]2)	118.5890	0.000	1	118.5890	0.000	1	117.7278	5.931	5	119.1051	3.467	24	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:3:	3:	C[6]-3:C[6]-3:H-1:	O[6]-2:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]O[6]C)(H)	C[6](O[6]C[6,6a])(C[6]C[6]H)(CCS)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]O[6]C)(H){2|C<3>}	C[6](O[6]C[6,6a])(C[6]C[6]H)(CCS){1|H<1>,2|C<3>}	H(C[6]C[6]2)	113.3820	0.000	1	113.3820	0.000	1	117.7278	5.931	5	119.1051	3.467	24	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:3:	3:	C[6]-3:C[6]-3:H-1:	O[6]-2:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]O[6]C)(H)	C[6](O[6]C[6,6a])(C[6]C[6]H)(CC[6a]2)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]O[6]C)(H){2|C<3>}	C[6](O[6]C[6,6a])(C[6]C[6]H)(CC[6a]2){1|H<1>,2|C<3>}	H(C[6]C[6]2)	118.9100	0.212	2	118.9100	0.045	2	117.7278	5.931	5	119.1051	3.467	24	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:3:	3:	C[6]-3:C[6]-3:H-1:	O[6]-2:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]O[6])(C[6]N[5,6]C)(H)	C[6](O[6]Ga[5,6,6])(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]O[6])(C[6]N[5,6]C)(H){1|Ga<5>,1|C<4>,2|C<3>}	C[6](O[6]Ga[5,6,6])(C[6a]C[6a]2)(C[6]C[6]H){1|O<2>,2|C<3>,2|C<4>,2|H<1>,2|N<3>}	H(C[6]C[6]2)	117.4860	0.004	2	117.4860	0.000	2	118.7648	1.383	5	119.1051	3.467	24	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:3:	3:	C[6]-3:C[6]-3:H-1:	O[6]-2:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]O[6])(C[6]O[6]C)(H)	C[6](O[6]Si[5,6,6])(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]O[6])(C[6]O[6]C)(H){1|Si<6>,2|C<3>}	C[6](O[6]Si[5,6,6])(C[6a]C[6a]2)(C[6]C[6]H){1|C<4>,1|N<3>,1|S<2>,2|H<1>,2|O<2>,3|C<3>}	H(C[6]C[6]2)	119.3900	0.000	1	119.3900	0.000	1	118.7648	1.383	5	119.1051	3.467	24	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:3:	3:	C[6]-3:C[6]-3:H-1:	O[6]-2:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]O[6])2(H)	C[6](O[6]Si[5,6,6])(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]O[6])2(H){1|Si<6>,4|C<3>}	C[6](O[6]Si[5,6,6])(C[6a]C[6a]2)(C[6]C[6]H){1|N<3>,1|S<2>,2|H<1>,2|O<2>,4|C<3>}	H(C[6]C[6]2)	119.7310	0.041	2	119.7310	0.002	2	118.7648	1.383	5	119.1051	3.467	24	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:3:	3:	C[6]-3:C[6]-3:H-1:	S-2:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](SB[3x3,3x5,12x6])(C[6]C[6]H)(N[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|C<3>,2|H<1>}	C[6](SB[3x3,3x5,12x6])(C[6]C[6]H)(N[6]C[6]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9850	0.000	1	119.9850	0.000	1	120.0577	0.007	3	119.1051	3.467	24	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:3:	3:	C[6]-3:C[6]-3:H-1:	S-2:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](SC[3x3,3x5,12x6])(C[6]C[6]H)(N[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|C<3>,2|H<1>}	C[6](SC[3x3,3x5,12x6])(C[6]C[6]H)(N[6]C[6]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0940	0.075	2	120.0940	0.006	2	120.0577	0.007	3	119.1051	3.467	24	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:3:	3:	C[6]-3:C[6]-3:H-1:	S-2:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](SC[3x3,4,3x5,14x6])(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Ir<8>,1|C<3>,1|H<1>}	C[6](SC[3x3,4,3x5,14x6])(N[6]C[6]Ir)(C[6]C[6]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8780	0.000	1	119.8780	0.000	1	120.1967	0.079	3	119.1051	3.467	24	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:3:	3:	C[6]-3:C[6]-3:H-1:	S-2:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](SC[3x3,4,3x5,14x6])(N[6]C[6]Rh)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Rh<8>,1|C<3>,1|H<1>}	C[6](SC[3x3,4,3x5,14x6])(N[6]C[6]Rh)(C[6]C[6]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4070	0.000	1	120.4070	0.000	1	120.1967	0.079	3	119.1051	3.467	24	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:3:	3:	C[6]-3:C[6]-3:H-1:	S-2:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](SC[5x3,5x5,20x6])(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Ir<8>,1|C<3>,1|H<1>}	C[6](SC[5x3,5x5,20x6])(N[6]C[6]Ir)(C[6]C[6]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3050	0.000	1	120.3050	0.000	1	120.1967	0.079	3	119.1051	3.467	24	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:3:	3:	N[6]-3:C[6]-3:H-1:	N[6]-2:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a])(C[6]N[6]H)(CNO)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]H)(C[6]N[6]C)(H){2|C<3>}	C[6](N[6]C[6,6a])(C[6]N[6]H)(CNO){1|H<1>,2|C<3>}	H(C[6]C[6]N[6])	124.0850	0.000	1	124.0850	0.000	1	121.8385	10.094	2	119.1051	3.467	24	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:3:	3:	N[6]-3:C[6]-3:H-1:	N[6]-2:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6,6a]Pt)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a])(C[6]N[6]H)(CNO)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Pt)(C[6]N[6]C)(H){2|C<3>}	C[6](N[6]C[6,6a])(C[6]N[6]H)(CNO){1|Pt<4>,2|C<3>}	H(C[6]C[6]N[6])	119.5920	0.000	1	119.5920	0.000	1	121.8385	10.094	2	119.1051	3.467	24	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:3:	3:	N[6]-3:C[6]-3:H-1:	S[6]-2:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6,6a]C)(C[6]S[6]C)(H)	C[6](S[6]C[6,6a])(C[6]N[6]H)(CC[6a]O)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]C)(C[6]S[6]C)(H){2|C<3>}	C[6](S[6]C[6,6a])(C[6]N[6]H)(CC[6a]O){1|C<4>,2|C<3>}	H(C[6]C[6]N[6])	116.3610	0.000	1	116.3610	0.000	1	116.3610	0.000	1	119.1051	3.467	24	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-2:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]C)(H)	C[6](C[6]C[6,6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]C)(H){1|H<1>,2|C<4>}	C[6](C[6]C[6,6])(C[6]C[6]H)(CH3){1|H<1>,1|O<2>,2|C<4>}	H(C[6]C[6]2)	117.8620	0.000	1	117.8620	0.000	1	117.8620	0.000	1	117.9056	3.403	90	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-2:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]N[6]C)(H){2|C<3>}	C[6](N[6]C[6,6a])(C[6]C[6]H)(CH3){1|O<1>,2|C<3>}	H(C[6]C[6]2)	118.8230	0.000	1	118.8230	0.000	1	119.4107	0.321	24	117.9056	3.403	90	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-2:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[5,6]C)(C[6]N[6]C)(H)	C[6](N[6]C[5,6])(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]N[5,6]C)(C[6]N[6]C)(H){1|C<3>,1|N<2>}	C[6](N[6]C[5,6])(C[6]C[6]H)(CCHH){1|C<4>,2|N<3>}	H(C[6]C[6]2)	119.4460	0.000	1	119.4460	0.000	1	119.4107	0.321	24	117.9056	3.403	90	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-2:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[5,6]C)(C[6]N[6]C)(H)	C[6](N[6]C[5,6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[5,6]C)(C[6]N[6]C)(H){1|C<3>,1|N<2>}	C[6](N[6]C[5,6])(C[6]C[6]H)(CH3){1|C<4>,2|N<3>}	H(C[6]C[6]2)	119.5376	0.435	16	119.5376	0.189	16	119.4107	0.321	24	117.9056	3.403	90	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-2:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[5a,6]C)(C[6]N[6]C)(H)	C[6](N[6]C[5a,6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[5a,6]C)(C[6]N[6]C)(H){2|C<3>}	C[6](N[6]C[5a,6])(C[6]C[6]H)(CH3){1|C<4>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	119.8005	1.385	2	119.6137	1.064	3	119.4107	0.321	24	117.9056	3.403	90	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-2:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[5a,6]C)(C[6]N[6]C)(H)	C[6](N[6]C[5a,6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[5a,6]C)(C[6]N[6]C)(H){2|C<3>}	C[6](N[6]C[5a,6])(C[6]C[6]H)(CH3){1|C<4>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	119.2400	0.000	1	119.6137	1.064	3	119.4107	0.321	24	117.9056	3.403	90	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-2:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]Nb[3,3,6])(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Nb<6>}	C[6](N[6]Nb[3,3,6])(C[6]C[6]H)(CC3){1|C<4>,1|N<2>,4|N<3>}	H(C[6]C[6]2)	118.5205	0.035	2	118.7147	0.114	3	119.4107	0.321	24	117.9056	3.403	90	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-2:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]Nb[3,3,6])(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Nb<7>,1|H<1>}	C[6](N[6]Nb[3,3,6])(C[6]C[6]H)(CC3){1|Cl<1>,1|C<4>,5|N<3>}	H(C[6]C[6]2)	119.1030	0.000	1	118.7147	0.114	3	119.4107	0.321	24	117.9056	3.403	90	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:4:	3:	C[6]-3:C[6]-3:H-1:	O[6]-2:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[3x6]O)(C[6]O[6]C)(H)	C[6](O[6]C[6,6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[3x6]O)(C[6]O[6]C)(H){1|O<2>,2|C<4>}	C[6](O[6]C[6,6])(C[6]C[6]H)(CH3){1|O<1>,3|C<4>}	H(C[6]C[6]2)	120.8120	0.000	1	120.8120	0.000	1	117.3505	3.455	65	117.9056	3.403	90	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:4:	3:	C[6]-3:C[6]-3:H-1:	O[6]-2:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]O[6]C)(H)	C[6](O[6]C[6,6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]O[6]C)(H){2|C<3>}	C[6](O[6]C[6,6])(C[6]C[6]H)(CH3){1|C<2>,1|C<3>,1|O<2>}	H(C[6]C[6]2)	116.1920	0.000	1	116.1920	0.000	1	117.3505	3.455	65	117.9056	3.403	90	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:4:	3:	C[6]-3:C[6]-3:H-1:	O[6]-2:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]O[6]C)(H)	C[6](O[6]C[6,6a])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]O[6]C)(H){2|C<3>}	C[6](O[6]C[6,6a])(C[6]C[6]H)(CH3){3|C<3>}	H(C[6]C[6]2)	117.9840	0.000	1	117.9840	0.000	1	117.3505	3.455	65	117.9056	3.403	90	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:4:	3:	C[6]-3:C[6]-3:H-1:	O[6]-2:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]O[6]C)(H)	C[6](O[6]C[6,6a])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]O[6]C)(H){2|C<3>}	C[6](O[6]C[6,6a])(C[6]C[6]H)(CH3){1|C<3>,1|O<2>,1|O<3>}	H(C[6]C[6]2)	115.5560	2.013	4	115.6167	6.933	6	117.3505	3.455	65	117.9056	3.403	90	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:4:	3:	C[6]-3:C[6]-3:H-1:	O[6]-2:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]O[6]C)(H)	C[6](O[6]C[6,6a])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]O[6]C)(H){2|C<3>}	C[6](O[6]C[6,6a])(C[6]C[6]H)(CH3){1|C<3>,2|O<2>}	H(C[6]C[6]2)	115.7380	4.739	2	115.6167	6.933	6	117.3505	3.455	65	117.9056	3.403	90	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:4:	3:	C[6]-3:C[6]-3:H-1:	O[6]-2:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6a]O[6])(C[6]O[6]C)(H)	C[6](O[6]Si[5,6,6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6a]O[6])(C[6]O[6]C)(H){1|Si<6>,2|C<3>}	C[6](O[6]Si[5,6,6])(C[6]C[6]H)(CH3){1|N<3>,1|S<2>,2|C<3>,2|O<2>}	H(C[6]C[6]2)	119.4240	0.000	1	119.4240	0.000	1	117.3505	3.455	65	117.9056	3.403	90	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:4:	3:	C[6]-3:C[6]-3:H-1:	O[6]-2:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[5,6]C)(C[6]O[6]C)(H)	C[6](O[6]Ga[3x5,6,6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[5,6]C)(C[6]O[6]C)(H){1|Ga<6>,1|C<4>}	C[6](O[6]Ga[3x5,6,6])(C[6]C[6]H)(CH3){1|C<4>,1|O<2>,2|N<3>,2|N<4>}	H(C[6]C[6]2)	116.3580	0.000	1	116.3580	0.000	1	117.3505	3.455	65	117.9056	3.403	90	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:4:	3:	C[6]-3:C[6]-3:H-1:	O[6]-2:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[5,6]C)(C[6]O[6]C)(H)	C[6](O[6]In[5,6,6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[5,6]C)(C[6]O[6]C)(H){1|In<5>,1|C<4>}	C[6](O[6]In[5,6,6])(C[6]C[6]H)(CH3){1|Cl<1>,1|C<4>,1|O<2>,2|N<3>}	H(C[6]C[6]2)	115.1235	0.235	2	115.2557	0.041	6	117.3505	3.455	65	117.9056	3.403	90	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:4:	3:	C[6]-3:C[6]-3:H-1:	O[6]-2:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[5,6]C)(C[6]O[6]C)(H)	C[6](O[6]In[5,6,6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[5,6]C)(C[6]O[6]C)(H){1|In<6>,1|C<4>}	C[6](O[6]In[5,6,6])(C[6]C[6]H)(CH3){1|Cl<1>,1|C<4>,1|O<2>,1|O<3>,2|N<3>}	H(C[6]C[6]2)	115.2195	0.091	2	115.2557	0.041	6	117.3505	3.455	65	117.9056	3.403	90	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:4:	3:	C[6]-3:C[6]-3:H-1:	O[6]-2:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[5,6]C)(C[6]O[6]C)(H)	C[6](O[6]In[5,6,6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[5,6]C)(C[6]O[6]C)(H){1|In<6>,1|C<4>}	C[6](O[6]In[5,6,6])(C[6]C[6]H)(CH3){1|Cl<1>,1|C<4>,2|N<3>,2|O<2>}	H(C[6]C[6]2)	115.4240	0.214	2	115.2557	0.041	6	117.3505	3.455	65	117.9056	3.403	90	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:4:	3:	C[6]-3:C[6]-3:H-1:	O[6]-2:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[5,6]C)(C[6]O[6]C)(H)	C[6](O[6]Si[5,6,6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[5,6]C)(C[6]O[6]C)(H){1|Si<6>,1|C<3>}	C[6](O[6]Si[5,6,6])(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|N<3>,1|S<2>,2|O<2>}	H(C[6]C[6]2)	117.9907	0.413	3	118.0060	0.115	4	117.3505	3.455	65	117.9056	3.403	90	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:4:	3:	C[6]-3:C[6]-3:H-1:	O[6]-2:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[5,6]C)(C[6]O[6]C)(H)	C[6](O[6]Si[5,6,6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[5,6]C)(C[6]O[6]C)(H){1|Si<6>,1|C<4>}	C[6](O[6]Si[5,6,6])(C[6]C[6]H)(CH3){1|C<4>,1|O<2>,2|N<2>,2|N<3>}	H(C[6]C[6]2)	118.0520	0.000	1	118.0060	0.115	4	117.3505	3.455	65	117.9056	3.403	90	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:4:	3:	C[6]-3:C[6]-3:H-1:	O[6]-2:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[5,6]C)(C[6]O[6]C)(H)	C[6](O[6]Si[5,6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[5,6]C)(C[6]O[6]C)(H){1|Si<5>,1|C<4>}	C[6](O[6]Si[5,6])(C[6]C[6]H)(CH3){1|N<3>,1|O<2>,3|C<4>}	H(C[6]C[6]2)	118.8043	0.054	3	118.8043	0.003	3	117.3505	3.455	65	117.9056	3.403	90	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:4:	3:	C[6]-3:C[6]-3:H-1:	O[6]-2:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6,6]C)(C[6]O[6]C)(H)	C[6](O[6]Ga[3x6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6,6]C)(C[6]O[6]C)(H){1|Ga<5>,1|C<4>}	C[6](O[6]Ga[3x6])(C[6]C[6]H)(CH3){1|Cl<1>,1|C<4>,1|O<2>,2|N<3>}	H(C[6]C[6]2)	117.3325	0.636	2	117.3325	0.404	2	117.3505	3.455	65	117.9056	3.403	90	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:4:	3:	C[6]-3:C[6]-3:H-1:	O[6]-2:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6,6]C)(C[6]O[6]C)(H)	C[6](O[6]In[3x6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6,6]C)(C[6]O[6]C)(H){1|In<5>,1|C<4>}	C[6](O[6]In[3x6])(C[6]C[6]H)(CH3){1|Cl<1>,1|C<4>,1|O<2>,2|N<3>}	H(C[6]C[6]2)	115.6820	0.485	4	115.6820	0.235	4	117.3505	3.455	65	117.9056	3.403	90	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:4:	3:	C[6]-3:C[6]-3:H-1:	O[6]-2:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)(C[6]O[6]C)(H)	C[6](O[6]Ga[3x6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)(C[6]O[6]C)(H){1|Ga<6>,1|C<4>}	C[6](O[6]Ga[3x6])(C[6]C[6]H)(CH3){1|C<4>,2|O<2>,3|N<3>}	H(C[6]C[6]2)	117.1433	0.290	3	117.1433	0.084	3	117.3505	3.455	65	117.9056	3.403	90	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:4:	3:	C[6]-3:C[6]-3:H-1:	O[6]-2:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)(C[6]O[6]C)(H)	C[6](O[6]Ga[6,6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)(C[6]O[6]C)(H){1|Ga<5>,1|C<4>}	C[6](O[6]Ga[6,6])(C[6]C[6]H)(CH3){1|Cl<1>,1|C<4>,1|O<2>,2|N<3>}	H(C[6]C[6]2)	116.6963	0.294	3	116.6963	0.087	3	117.3505	3.455	65	117.9056	3.403	90	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:4:	3:	C[6]-3:C[6]-3:H-1:	O[6]-2:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)(C[6]O[6]C)(H)	C[6](O[6]Si[6,6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)(C[6]O[6]C)(H){1|Si<6>,1|C<3>}	C[6](O[6]Si[6,6])(C[6]C[6]H)(CH3){1|C<4>,1|O<2>,2|N<2>,2|N<3>}	H(C[6]C[6]2)	118.6190	0.004	2	118.6162	0.016	5	117.3505	3.455	65	117.9056	3.403	90	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:4:	3:	C[6]-3:C[6]-3:H-1:	O[6]-2:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)(C[6]O[6]C)(H)	C[6](O[6]Si[6,6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)(C[6]O[6]C)(H){1|Si<6>,1|C<4>}	C[6](O[6]Si[6,6])(C[6]C[6]H)(CH3){1|C<4>,1|O<2>,2|N<2>,2|N<3>}	H(C[6]C[6]2)	118.6143	0.180	3	118.6162	0.016	5	117.3505	3.455	65	117.9056	3.403	90	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:4:	3:	C[6]-3:C[6]-3:H-1:	O[6]-2:C[6]-3:C-4:	C[6]-3:	C[6](C[6]O[6]C)2(H)	C[6](O[6]B[6,6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]O[6]C)2(H){1|B<4>}	C[6](O[6]B[6,6])(C[6]C[6]H)(CH3){1|O<2>,3|C<4>}	H(C[6]C[6]2)	121.0138	0.195	4	121.0138	0.038	4	117.3505	3.455	65	117.9056	3.403	90	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:4:	3:	C[6]-3:C[6]-3:H-1:	O[6]-2:C[6]-3:C-4:	C[6]-3:	C[6](C[6]O[6]C)2(H)	C[6](O[6]Ga[3x6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]O[6]C)2(H){1|Ga<6>}	C[6](O[6]Ga[3x6])(C[6]C[6]H)(CH3){1|C<4>,5|O<2>}	H(C[6]C[6]2)	117.0147	0.346	14	117.0147	0.120	14	117.3505	3.455	65	117.9056	3.403	90	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:4:	3:	C[6]-3:C[6]-3:H-1:	O[6]-2:C[6]-3:C-4:	C[6]-3:	C[6](C[6]O[6]C)2(H)	C[6](O[6]Nb[6x3,6,6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]O[6]C)2(H){1|Nb<9>}	C[6](O[6]Nb[6x3,6,6])(C[6]C[6]H)(CH3){1|Nb<9>,1|C<4>,3|O<2>,4|S<3>}	H(C[6]C[6]2)	117.5497	2.975	4	117.5497	8.849	4	117.3505	3.455	65	117.9056	3.403	90	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	2:3:4:	3:	C[6]-3:C[6]-3:H-1:	O[6]-2:C[6]-3:C-4:	C[6]-3:	C[6](C[6]O[6]C)2(H)	C[6](O[6]Si[5,6,6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]O[6]C)2(H){1|Si<6>}	C[6](O[6]Si[5,6,6])(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|N<3>,1|S<2>,2|O<2>}	H(C[6]C[6]2)	119.4445	0.019	2	119.4445	0.000	2	117.3505	3.455	65	117.9056	3.403	90	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[5,6]C[5,6,6a]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6,6a])(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6,6a]C[5])(C[6]C[6]H)(H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6,6a])(H){1|C<4>,2|C<3>}	H(C[6]C[5,6]C[6])	120.4020	0.000	1	120.4020	0.000	1	118.7285	19.365	6	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6])(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6])(H){1|H<1>,2|C<3>}	H(C[6]C[5,6]C[6])	112.9810	0.000	1	112.9810	0.000	1	118.7285	19.365	6	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]N[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6])(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]N[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[5,6]C[6])	120.6595	1.282	2	121.7487	4.381	3	118.7285	19.365	6	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]N[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6])(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]N[5])(C[6]C[6]H)(H){1|N<2>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6])(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[5,6]C[6])	123.9270	0.000	1	121.7487	4.381	3	118.7285	19.365	6	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]S[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6])(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]S[5])(C[6]C[6]H)(H){1|N<3>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6])(H){1|C<3>,1|H<1>,1|S<2>}	H(C[6]C[5,6]C[6])	113.7420	0.000	1	113.7420	0.000	1	118.7285	19.365	6	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]S[5])(C[6]O[6]H)(H)	C[6](C[6]C[5,6]H)(O[6]C[6])(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]S[5])(C[6]O[6]H)(H){1|Ga<5>,1|C<3>,1|O<2>}	C[6](C[6]C[5,6]H)(O[6]C[6])(H){1|C<3>,1|C<4>,1|S<2>}	H(C[6]C[5,6]C[6])	120.0255	0.479	2	119.8440	0.179	5	119.8440	0.179	5	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]S[5])(C[6]O[6]H)(H)	C[6](C[6]C[5,6]H)(O[6]C[6])(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]S[5])(C[6]O[6]H)(H){1|Ga<6>,1|C<3>,1|O<2>}	C[6](C[6]C[5,6]H)(O[6]C[6])(H){1|C<3>,1|C<4>,1|S<2>}	H(C[6]C[5,6]C[6])	119.7230	0.434	3	119.8440	0.179	5	119.8440	0.179	5	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[5a,6]C[5a,6,6]C[5a,6a])(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)(C[6]C[6,6])(H)	H(C[6]C[5a,6]C[6])	C[6](C[5a,6]C[5a,6,6]C[5a,6a])(C[6]C[6]H)(H){1|N<3>,3|C<3>}	C[6](C[6]C[5a,6]H)(C[6]C[6,6])(H){3|C<3>}	H(C[6]C[5a,6]C[6])	119.7570	0.000	1	119.7570	0.000	1	121.0412	7.383	5	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[5a,6]C[5a,6]2)(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)(C[6]C[6])(H)	H(C[6]C[5a,6]C[6])	C[6](C[5a,6]C[5a,6]2)(C[6]C[6]H)(H){1|N<2>,1|N<3>,2|C<3>}	C[6](C[6]C[5a,6]H)(C[6]C[6])(H){1|H<1>,2|C<3>}	H(C[6]C[5a,6]C[6])	119.6260	0.000	1	119.6260	0.000	1	121.0412	7.383	5	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[5a,6]C[5a,6]N[5a])(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)(C[6]C[6])(H)	H(C[6]C[5a,6]C[6])	C[6](C[5a,6]C[5a,6]N[5a])(C[6]C[6]H)(H){1|C<2>,3|C<3>}	C[6](C[6]C[5a,6]H)(C[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[5a,6]C[6])	117.9870	0.000	1	121.9410	11.726	3	121.0412	7.383	5	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[5a,6]C[5a,6]N[5a])(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)(C[6]C[6])(H)	H(C[6]C[5a,6]C[6])	C[6](C[5a,6]C[5a,6]N[5a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,2|C<3>}	C[6](C[6]C[5a,6]H)(C[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[5a,6]C[6])	123.8960	0.000	1	121.9410	11.726	3	121.0412	7.383	5	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[5a,6]C[5a,6]N[5a])(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)(C[6]C[6])(H)	H(C[6]C[5a,6]C[6])	C[6](C[5a,6]C[5a,6]N[5a])(C[6]C[6]H)(H){1|O<2>,2|C<3>}	C[6](C[6]C[5a,6]H)(C[6]C[6])(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[5a,6]C[6])	123.9400	0.000	1	121.9410	11.726	3	121.0412	7.383	5	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6])(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6]H)(C[6]C[6])(H){1|N<3>,2|C<3>}	H(C[6]C[6,6]C[6])	131.6260	0.000	1	125.7105	69.986	2	123.4812	50.961	6	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6])(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){3|C<3>}	C[6](C[6]C[6,6]H)(C[6]C[6])(H){1|C<2>,1|C<3>,1|H<1>}	H(C[6]C[6,6]C[6])	119.7950	0.000	1	125.7105	69.986	2	123.4812	50.961	6	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6])(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|N<3>}	C[6](C[6]C[6,6]H)(C[6]N[6])(H){1|Cd<6>,1|C<2>,1|C<3>}	H(C[6]C[6,6]C[6])	125.1740	11.762	2	125.1740	138.345	2	123.4812	50.961	6	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6])(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]N[6])(C[6]C[6]H)(H){2|C<3>,2|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6,6]C[6])	119.4300	0.000	1	119.4300	0.000	1	123.4812	50.961	6	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6,6]C[6,6a]C[6,6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6])(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]C[6,6])(C[6]C[6]H)(H){1|C<4>,3|C<3>}	C[6](C[6]C[6,6]H)(C[6]C[6])(H){1|H<1>,2|C<3>}	H(C[6]C[6,6]C[6])	119.6880	0.000	1	119.6880	0.000	1	123.4812	50.961	6	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:Cl-1:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]N[6]Cl)(H)	C[6](C[6]C[6,6]H)(N[6]C[6])(Cl)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]N[6]Cl)(H){1|B<4>,1|C<2>,2|C<3>}	C[6](C[6]C[6,6]H)(N[6]C[6])(Cl){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6,6]C[6])	121.0583	0.141	3	121.0678	0.078	13	121.0678	0.078	13	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:Cl-1:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]N[6]Cl)(H)	C[6](C[6]C[6,6]H)(N[6]C[6])(Cl)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]N[6]Cl)(H){1|B<4>,1|H<1>,2|C<3>}	C[6](C[6]C[6,6]H)(N[6]C[6])(Cl){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6,6]C[6])	121.1558	0.176	9	121.0678	0.078	13	121.0678	0.078	13	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:Cl-1:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]N[6]Cl)(H)	C[6](C[6]C[6,6]H)(N[6]C[6])(Cl)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]N[6]Cl)(H){1|B<4>,3|C<3>}	C[6](C[6]C[6,6]H)(N[6]C[6])(Cl){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6,6]C[6])	120.3040	0.000	1	121.0678	0.078	13	121.0678	0.078	13	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]N[6]H)(H)	C[6](C[6]C[6,6]H)(N[6]C[6])(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]N[6]H)(H){1|B<4>,1|C<2>,2|C<3>}	C[6](C[6]C[6,6]H)(N[6]C[6])(H){1|C<3>,1|N<3>,1|O<2>}	H(C[6]C[6,6]C[6])	120.3300	0.000	1	120.9590	0.791	2	120.9590	0.791	2	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]N[6]H)(H)	C[6](C[6]C[6,6]H)(N[6]C[6])(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]N[6]H)(H){1|B<4>,1|C<2>,2|C<3>}	C[6](C[6]C[6,6]H)(N[6]C[6])(H){1|C<3>,2|N<3>}	H(C[6]C[6,6]C[6])	121.5880	0.000	1	120.9590	0.791	2	120.9590	0.791	2	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:O-1:	C[6]-3:	C[6](C[6,6]C[3,6,6]C[4x6])(C[6]O[6]O)(H)	C[6](C[6]C[6,6]H)(O[6]C[6])(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[3,6,6]C[4x6])(C[6]O[6]O)(H){1|O<2>,5|C<4>}	C[6](C[6]C[6,6]H)(O[6]C[6])(O){4|C<4>}	H(C[6]C[6,6]C[6])	118.9742	0.313	4	118.9742	0.098	4	118.9416	0.188	37	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:O-1:	C[6]-3:	C[6](C[6,6]C[3,6,6]C[6,6])(C[6]O[6]O)(H)	C[6](C[6]C[6,6]H)(O[6]C[6])(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[3,6,6]C[6,6])(C[6]O[6]O)(H){1|O<2>,5|C<4>}	C[6](C[6]C[6,6]H)(O[6]C[6])(O){1|H<1>,1|O<2>,2|C<4>}	H(C[6]C[6,6]C[6])	119.5730	0.211	2	119.3367	0.190	3	118.9416	0.188	37	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:O-1:	C[6]-3:	C[6](C[6,6]C[3,6,6]C[6,6])(C[6]O[6]O)(H)	C[6](C[6]C[6,6]H)(O[6]C[6])(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[3,6,6]C[6,6])(C[6]O[6]O)(H){1|O<2>,5|C<4>}	C[6](C[6]C[6,6]H)(O[6]C[6])(O){2|C<4>,2|H<1>}	H(C[6]C[6,6]C[6])	118.8640	0.000	1	119.3367	0.190	3	118.9416	0.188	37	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:O-1:	C[6]-3:	C[6](C[6,6]C[3x6]C[6])(C[6]O[6]O)(H)	C[6](C[6]C[6,6]H)(O[6]C[6,6])(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[3x6]C[6])(C[6]O[6]O)(H){6|C<4>}	C[6](C[6]C[6,6]H)(O[6]C[6,6])(O){1|H<1>,3|C<4>}	H(C[6]C[6,6]C[6])	118.3520	0.000	1	118.3520	0.000	1	118.9416	0.188	37	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:O-1:	C[6]-3:	C[6](C[6,6]C[4x6]C[6])(C[6]O[6]O)(H)	C[6](C[6]C[6,6]H)(O[6]C[6])(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[4x6]C[6])(C[6]O[6]O)(H){2|H<1>,4|C<4>}	C[6](C[6]C[6,6]H)(O[6]C[6])(O){2|C<4>,2|H<1>}	H(C[6]C[6,6]C[6])	118.8235	0.121	2	118.8235	0.015	2	118.9416	0.188	37	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:O-1:	C[6]-3:	C[6](C[6,6]C[5,5,6]C[6,6])(C[6]O[6]O)(H)	C[6](C[6]C[6,6]H)(O[6]C[6])(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,5,6]C[6,6])(C[6]O[6]O)(H){1|O<2>,5|C<4>}	C[6](C[6]C[6,6]H)(O[6]C[6])(O){1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6,6]C[6])	118.6430	0.000	1	118.6430	0.000	1	118.9416	0.188	37	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:O-1:	C[6]-3:	C[6](C[6,6]C[5,6,6]C[6])(C[6]O[6]O)(H)	C[6](C[6]C[6,6]H)(O[6]C[5,6])(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6,6]C[6])(C[6]O[6]O)(H){1|O<2>,5|C<4>}	C[6](C[6]C[6,6]H)(O[6]C[5,6])(O){1|H<1>,3|C<4>}	H(C[6]C[6,6]C[6])	117.5620	0.000	1	117.5620	0.000	1	118.9416	0.188	37	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:O-1:	C[6]-3:	C[6](C[6,6]C[5,6,6]O[6])(C[6]O[6]O)(H)	C[6](C[6]C[6,6]H)(O[6]C[5,6])(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6,6]O[6])(C[6]O[6]O)(H){1|O<2>,3|C<4>}	C[6](C[6]C[6,6]H)(O[6]C[5,6])(O){1|O<2>,3|C<4>}	H(C[6]C[6,6]C[6])	118.9280	0.000	1	118.9280	0.000	1	118.9416	0.188	37	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:O-1:	C[6]-3:	C[6](C[6,6]C[6,6]2)(C[6]O[6]O)(H)	C[6](C[6]C[6,6]H)(O[6]C[6])(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2)(C[6]O[6]O)(H){1|C<3>,4|C<4>}	C[6](C[6]C[6,6]H)(O[6]C[6])(O){1|C<3>,1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[6,6]C[6])	119.6140	0.000	1	119.0207	0.206	11	118.9416	0.188	37	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:O-1:	C[6]-3:	C[6](C[6,6]C[6,6]2)(C[6]O[6]O)(H)	C[6](C[6]C[6,6]H)(O[6]C[6])(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2)(C[6]O[6]O)(H){1|C<3>,4|C<4>}	C[6](C[6]C[6,6]H)(O[6]C[6])(O){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6,6]C[6])	118.8665	0.378	4	119.0207	0.206	11	118.9416	0.188	37	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:O-1:	C[6]-3:	C[6](C[6,6]C[6,6]2)(C[6]O[6]O)(H)	C[6](C[6]C[6,6]H)(O[6]C[6])(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2)(C[6]O[6]O)(H){1|C<3>,4|C<4>}	C[6](C[6]C[6,6]H)(O[6]C[6])(O){1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6,6]C[6])	119.2863	0.310	3	119.0207	0.206	11	118.9416	0.188	37	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:O-1:	C[6]-3:	C[6](C[6,6]C[6,6]2)(C[6]O[6]O)(H)	C[6](C[6]C[6,6]H)(O[6]C[6])(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2)(C[6]O[6]O)(H){1|C<3>,4|C<4>}	C[6](C[6]C[6,6]H)(O[6]C[6])(O){1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6,6]C[6])	119.2040	0.000	1	119.0207	0.206	11	118.9416	0.188	37	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:O-1:	C[6]-3:	C[6](C[6,6]C[6,6]2)(C[6]O[6]O)(H)	C[6](C[6]C[6,6]H)(O[6]C[6])(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2)(C[6]O[6]O)(H){1|H<1>,5|C<4>}	C[6](C[6]C[6,6]H)(O[6]C[6])(O){1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6,6]C[6])	118.9250	0.000	1	119.0207	0.206	11	118.9416	0.188	37	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:O-1:	C[6]-3:	C[6](C[6,6]C[6,6]2)(C[6]O[6]O)(H)	C[6](C[6]C[6,6]H)(O[6]C[6])(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2)(C[6]O[6]O)(H){1|O<2>,5|C<4>}	C[6](C[6]C[6,6]H)(O[6]C[6])(O){1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6,6]C[6])	118.1600	0.000	1	119.0207	0.206	11	118.9416	0.188	37	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:O-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]O[6]O)(H)	C[6](C[6]C[6,6]H)(O[6]C[6])(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]O[6]O)(H){1|C<3>,1|O<2>,4|C<4>}	C[6](C[6]C[6,6]H)(O[6]C[6])(O){1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6,6]C[6])	118.9895	0.233	2	118.9206	0.089	11	118.9416	0.188	37	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:O-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]O[6]O)(H)	C[6](C[6]C[6,6]H)(O[6]C[6])(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]O[6]O)(H){1|C<3>,4|C<4>}	C[6](C[6]C[6,6]H)(O[6]C[6])(O){1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6,6]C[6])	119.0722	0.304	5	118.9206	0.089	11	118.9416	0.188	37	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:O-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]O[6]O)(H)	C[6](C[6]C[6,6]H)(O[6]C[6])(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]O[6]O)(H){1|H<1>,1|O<2>,4|C<4>}	C[6](C[6]C[6,6]H)(O[6]C[6])(O){2|C<4>,2|H<1>}	H(C[6]C[6,6]C[6])	118.8225	0.120	2	118.9206	0.089	11	118.9416	0.188	37	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:O-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]O[6]O)(H)	C[6](C[6]C[6,6]H)(O[6]C[6])(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]O[6]O)(H){2|H<1>,4|C<4>}	C[6](C[6]C[6,6]H)(O[6]C[6])(O){2|C<4>,2|H<1>}	H(C[6]C[6,6]C[6])	118.5710	0.243	2	118.9206	0.089	11	118.9416	0.188	37	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:O-1:	C[6]-3:	C[6](C[6,6]C[6,6a]C[6,6])(C[6]O[6]O)(H)	C[6](C[6]C[6,6]H)(O[6]C[6])(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]C[6,6])(C[6]O[6]O)(H){2|C<3>,3|C<4>}	C[6](C[6]C[6,6]H)(O[6]C[6])(O){1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6,6]C[6])	119.2230	0.205	2	119.2230	0.042	2	118.9416	0.188	37	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6])(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H){1|S<2>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6])(H){1|H<1>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.1520	0.000	1	119.1520	0.000	1	122.4437	18.140	9	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6,6])(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6,6])(H){1|P<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	126.1310	0.000	1	126.1310	0.000	1	122.4437	18.140	9	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6])(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|C<4>,1|N<2>}	C[6](C[6]C[6,6a]H)(C[6]C[6])(H){2|C<3>}	H(C[6]C[6,6a]C[6])	115.3010	0.000	1	120.5473	23.243	3	122.4437	18.140	9	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6])(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6])(H){1|H<1>,2|C<3>}	H(C[6]C[6,6a]C[6])	121.5580	0.000	1	120.5473	23.243	3	122.4437	18.140	9	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6])(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6])(H){1|P<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	124.7830	0.000	1	120.5473	23.243	3	122.4437	18.140	9	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6])(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6])(H){1|Cu<5>,2|C<3>}	H(C[6]C[6,6a]C[6])	124.7625	2.026	2	122.4600	17.957	3	122.4437	18.140	9	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6])(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6])(H){1|Pt<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	117.8550	0.000	1	122.4600	17.957	3	122.4437	18.140	9	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]N[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6])(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]N[6a])(C[6]C[6]H)(H){3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6])(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6,6a]C[6])	127.6880	0.000	1	127.6880	0.000	1	122.4437	18.140	9	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]C[6])(Br)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]C)(H){1|C<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6])(Br){1|H<1>,2|C<3>}	H(C[6]C[6]2)	116.0650	0.000	1	116.0650	0.000	1	117.5538	17.119	4	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6])(Br)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6])(Br){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	118.1650	0.000	1	118.0500	24.202	3	117.5538	17.119	4	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6])(Br)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]H)(H){2|C<3>}	C[6](C[6]C[6]H)(C[6]C[6])(Br){1|C<3>,2|H<1>}	H(C[6]C[6]2)	117.9925	6.956	2	118.0500	24.202	3	117.5538	17.119	4	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6])(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|C<3>,1|C<4>}	C[6](C[6]C[6]H)(C[6]C[6])(Cl){1|C<3>,2|H<1>}	H(C[6]C[6]2)	122.4580	1.891	3	121.5367	2.566	6	121.5367	2.566	6	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6])(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|C<3>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6])(Cl){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1850	0.000	1	121.5367	2.566	6	121.5367	2.566	6	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6])(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|C<3>,1|P<4>}	C[6](C[6]C[6]H)(C[6]C[6])(Cl){1|C<3>,2|H<1>}	H(C[6]C[6]2)	121.2250	0.000	1	121.5367	2.566	6	121.5367	2.566	6	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6])(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){2|C<3>}	C[6](C[6]C[6]H)(C[6]C[6])(Cl){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4360	0.000	1	121.5367	2.566	6	121.5367	2.566	6	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:F-1:	C[6]-3:	C[6](C[6]C[6]F)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6])(F)	H(C[6]C[6]2)	C[6](C[6]C[6]F)(C[6]C[6]H)(H){1|C<3>,1|C<4>}	C[6](C[6]C[6]H)(C[6]C[6])(F){1|C<3>,2|H<1>}	H(C[6]C[6]2)	112.2930	0.000	1	120.6016	14.366	7	120.6016	14.366	7	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:F-1:	C[6]-3:	C[6](C[6]C[6]F)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6])(F)	H(C[6]C[6]2)	C[6](C[6]C[6]F)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6])(F){1|C<3>,1|F<1>,1|H<1>}	H(C[6]C[6]2)	121.7568	1.034	4	120.6016	14.366	7	120.6016	14.366	7	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:F-1:	C[6]-3:	C[6](C[6]C[6]F)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6])(F)	H(C[6]C[6]2)	C[6](C[6]C[6]F)(C[6]C[6]H)(H){1|C<3>,1|P<4>}	C[6](C[6]C[6]H)(C[6]C[6])(F){1|C<3>,2|H<1>}	H(C[6]C[6]2)	122.4455	1.348	2	120.6016	14.366	7	120.6016	14.366	7	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[3,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[3,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,3|C<4>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.5945	0.182	2	119.5945	0.033	2	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[5,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C[6])(C[6]C[6]H)(H){1|N<2>,2|C<4>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6])(H){1|C<3>,1|C<4>}	H(C[6]C[6]2)	118.9440	0.000	1	118.9440	0.000	1	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.7000	0.132	2	119.7000	0.017	2	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Zn<6>,1|C<2>,1|C<3>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7560	0.000	1	120.7560	0.000	1	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H){1|C<2>,1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]C[6])(H){2|C<3>}	H(C[6]C[6]2)	118.7850	0.000	1	119.7913	23.279	3	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.2945	6.711	2	119.7913	23.279	3	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6]H)(H){1|C<2>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	122.5210	0.214	2	121.4245	2.327	4	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3280	1.458	2	121.4245	2.327	4	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]As)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]As)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|As<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	123.6745	3.378	2	123.6745	11.410	2	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|Br<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4340	1.001	2	120.4340	1.003	2	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|C<4>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.8100	0.000	1	119.4393	12.766	62	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.1147	4.033	38	119.4393	12.766	62	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|C<5>,1|H<1>}	H(C[6]C[6]2)	120.3655	0.125	2	119.4393	12.766	62	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	118.9924	2.114	14	119.4393	12.766	62	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,2|C<4>}	H(C[6]C[6]2)	121.5210	3.417	2	119.4393	12.766	62	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	126.5520	0.000	1	119.4393	12.766	62	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,2|C<4>}	H(C[6]C[6]2)	119.1880	0.000	1	119.4393	12.766	62	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|S<2>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	122.1700	0.000	1	119.4393	12.766	62	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){2|C<3>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|C<5>,1|H<1>}	H(C[6]C[6]2)	116.9770	0.000	1	119.4393	12.766	62	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){2|C<3>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,2|C<4>}	H(C[6]C[6]2)	124.5160	0.000	1	119.4393	12.766	62	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|C<3>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|Cl<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.6820	0.000	1	119.6820	0.000	1	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]F)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]F)(C[6]C[6]H)(H){1|C<3>,1|C<4>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,2|F<1>}	H(C[6]C[6]2)	123.9740	0.000	1	123.9740	0.000	1	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]Ge)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Ge)(C[6]C[6]H)(H){1|C<3>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|Ge<4>,1|C<2>,1|H<1>}	H(C[6]C[6]2)	118.8670	0.000	1	118.8670	0.000	1	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|C<4>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	123.5120	0.000	1	119.3371	17.206	20	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	118.4662	4.730	12	119.3371	17.206	20	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|N<4>,1|O<2>}	H(C[6]C[6]2)	118.9950	0.000	1	119.3371	17.206	20	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,2|N<3>}	H(C[6]C[6]2)	126.1020	0.000	1	119.3371	17.206	20	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.0485	2.426	2	119.3371	17.206	20	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|Pd<4>,1|C<3>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.3910	0.000	1	119.3371	17.206	20	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){2|C<3>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.0255	0.998	2	119.3371	17.206	20	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.4210	0.068	2	122.3738	18.525	8	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|N<4>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	118.1690	0.000	1	122.3738	18.525	8	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){2|C<2>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|O<2>}	H(C[6]C[6]2)	126.7510	0.000	1	122.3738	18.525	8	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){2|C<3>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	123.2623	6.391	3	122.3738	18.525	8	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){2|C<3>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,2|O<2>}	H(C[6]C[6]2)	123.4410	0.000	1	122.3738	18.525	8	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<2>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|P<4>}	H(C[6]C[6]2)	113.9650	9.055	2	119.7131	8.847	36	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<2>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<2>,1|P<3>}	H(C[6]C[6]2)	120.2440	0.000	1	119.7131	8.847	36	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|H<1>,1|P<3>}	H(C[6]C[6]2)	120.8740	1.083	2	119.7131	8.847	36	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|H<1>,1|P<4>}	H(C[6]C[6]2)	120.2378	2.180	28	119.7131	8.847	36	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|H<1>,1|P<4>}	H(C[6]C[6]2)	118.0600	0.000	1	119.7131	8.847	36	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<3>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<2>,1|H<1>,1|P<4>}	H(C[6]C[6]2)	117.5150	3.002	2	119.7131	8.847	36	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]S)(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]S)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|H<1>,1|S<4>}	H(C[6]C[6]2)	120.5250	0.055	2	120.2580	0.215	3	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]S)(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]S)(H){1|C<3>,1|S<2>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|H<1>,1|S<2>}	H(C[6]C[6]2)	119.7240	0.000	1	120.2580	0.215	3	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<5>,1|C<3>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	121.1980	0.000	1	121.3970	0.079	2	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<6>,1|C<3>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	121.5960	0.000	1	121.3970	0.079	2	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	118.3480	4.510	4	120.5469	24.241	24	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	130.8060	0.000	1	120.5469	24.241	24	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<2>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	104.7300	0.000	1	120.5469	24.241	24	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	122.2140	0.000	1	120.5469	24.241	24	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|H<1>,2|N<2>}	H(C[6]C[6]2)	118.2850	0.000	1	120.5469	24.241	24	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<6>,1|C<3>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0910	0.000	1	120.5469	24.241	24	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	124.2510	1.926	2	120.5469	24.241	24	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5160	0.159	3	120.5469	24.241	24	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<6>,1|C<3>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	122.0080	0.000	1	120.5469	24.241	24	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<6>,1|C<3>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|Si<5>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7860	0.000	1	120.5469	24.241	24	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	122.5740	0.000	1	120.5469	24.241	24	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7230	6.770	2	120.5469	24.241	24	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	123.1530	0.000	1	120.5469	24.241	24	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<9>,1|C<3>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	121.8380	0.000	2	120.5469	24.241	24	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<4>,1|C<2>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|H<1>,1|N<3>}	H(C[6]C[6]2)	123.5890	0.000	1	120.5469	24.241	24	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){2|C<3>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	117.3260	0.000	1	120.5469	24.241	24	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<6>,1|C<3>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	126.2670	0.000	1	123.6275	13.934	2	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Pd<4>,1|C<3>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.9880	0.000	1	123.6275	13.934	2	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Al<7>,1|C<3>,1|H<2>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<4>,2|H<1>}	H(C[6]C[6]2)	120.3980	0.000	1	120.1021	17.076	269	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|As<3>,1|C<2>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	123.1610	0.000	1	120.1021	17.076	269	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|As<4>,1|C<3>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	125.0400	2.312	2	120.1021	17.076	269	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|B<4>,1|C<3>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	118.5420	1.843	5	120.1021	17.076	269	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Be<3>,1|C<3>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8550	0.000	1	120.1021	17.076	269	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<2>,1|C<3>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	115.1235	7.821	2	120.1021	17.076	269	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<2>,1|C<4>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	118.7735	2.170	2	120.1021	17.076	269	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<2>,1|H<1>,1|P<4>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.9200	0.000	1	120.1021	17.076	269	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<2>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	122.7125	4.063	4	120.1021	17.076	269	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.6760	0.000	1	120.1021	17.076	269	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<2>,1|P<4>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.4610	0.000	1	120.1021	17.076	269	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.4780	0.000	1	120.1021	17.076	269	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0471	4.574	18	120.1021	17.076	269	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|As<3>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	124.6700	0.000	1	120.1021	17.076	269	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|As<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.9670	2.556	3	120.1021	17.076	269	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	123.1730	0.000	1	120.1021	17.076	269	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<2>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1360	0.000	1	120.1021	17.076	269	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	118.3460	5.312	14	120.1021	17.076	269	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	127.8490	0.000	1	120.1021	17.076	269	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	122.6273	4.983	3	120.1021	17.076	269	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	126.0600	0.000	1	120.1021	17.076	269	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|H<1>,1|P<3>}	H(C[6]C[6]2)	119.0590	0.000	1	120.1021	17.076	269	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|H<1>,1|P<4>}	H(C[6]C[6]2)	119.9543	2.478	26	120.1021	17.076	269	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|H<1>,1|S<3>}	H(C[6]C[6]2)	121.0530	0.000	1	120.1021	17.076	269	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|H<1>,1|S<4>}	H(C[6]C[6]2)	119.1770	0.000	1	120.1021	17.076	269	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7873	2.757	54	120.1021	17.076	269	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|Ge<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	122.9100	0.000	1	120.1021	17.076	269	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.0484	3.709	14	120.1021	17.076	269	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|Sn<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9280	0.000	1	120.1021	17.076	269	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	117.7180	2.358	5	120.1021	17.076	269	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	123.4813	7.300	3	120.1021	17.076	269	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	115.9872	3.620	5	120.1021	17.076	269	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|O<3>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.5710	0.000	1	120.1021	17.076	269	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|P<3>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8730	0.000	1	120.1021	17.076	269	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|P<4>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6287	3.560	35	120.1021	17.076	269	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|S<2>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|H<1>,1|S<2>}	H(C[6]C[6]2)	113.7878	7.161	4	120.1021	17.076	269	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|S<2>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	123.1150	3.636	2	120.1021	17.076	269	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|S<4>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	130.6660	0.000	1	120.1021	17.076	269	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|As<3>,1|C<2>,1|H<1>}	H(C[6]C[6]2)	119.7650	4.132	2	120.1021	17.076	269	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<2>,1|H<1>,1|P<4>}	H(C[6]C[6]2)	120.1490	8.057	2	120.1021	17.076	269	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|Se<3>,1|C<2>,1|H<1>}	H(C[6]C[6]2)	120.2400	11.243	2	120.1021	17.076	269	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|P<4>,2|H<1>}	H(C[6]C[6]2)	119.9805	0.125	4	120.1021	17.076	269	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Cu<5>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|Cu<5>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	114.6510	0.000	2	120.1021	17.076	269	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ga<3>,1|C<3>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.6070	0.000	1	120.1021	17.076	269	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ge<4>,1|C<3>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8440	0.000	1	120.1021	17.076	269	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Pd<4>,1|C<3>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	114.3140	0.000	1	120.1021	17.076	269	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Sb<5>,1|C<3>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	122.1130	0.116	2	120.1021	17.076	269	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Se<2>,1|C<3>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9475	11.419	2	120.1021	17.076	269	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Si<4>,1|C<3>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	123.2767	6.824	9	120.1021	17.076	269	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Sn<4>,1|C<3>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	118.6810	1.991	2	120.1021	17.076	269	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Sn<5>,1|C<3>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	124.6650	0.000	1	120.1021	17.076	269	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){2|C<3>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|Au<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.5110	0.000	1	120.1021	17.076	269	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){2|C<3>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.7294	5.149	16	120.1021	17.076	269	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<2>,1|N<2>}	C[6](C[6]C[6]H)(C[6]N[6])(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2630	0.000	1	120.9961	14.734	18	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<2>}	C[6](C[6]C[6]H)(C[6]N[6])(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	125.2843	7.418	3	120.9961	14.734	18	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6])(H){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	118.8507	2.100	3	120.9961	14.734	18	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6])(H){1|Pt<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1560	0.000	1	120.9961	14.734	18	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<2>}	C[6](C[6]C[6]H)(C[6]N[6])(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5600	0.386	2	120.9961	14.734	18	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]N[6])(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.5330	0.000	1	120.9961	14.734	18	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6])(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	118.1640	0.000	1	120.9961	14.734	18	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6])(H){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.1530	0.000	1	120.9961	14.734	18	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6])(H){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	123.4680	0.000	1	120.9961	14.734	18	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6])(H){1|Zn<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.2370	0.000	1	120.9961	14.734	18	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6])(H){1|Re<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3310	0.000	1	120.9961	14.734	18	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6])(H){1|Cu<5>,1|C<2>,1|H<1>}	H(C[6]C[6]2)	121.0500	6.404	2	120.9961	14.734	18	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Ir)(C[6]C[6]H)(H){2|C<3>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|Ir<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1220	0.000	1	120.1220	0.000	1	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]N[5])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]C[6]H)(H){1|H<1>,3|C<3>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.6710	1.196	2	121.0843	1.748	3	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]N[5])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]C[6]H)(H){2|C<3>,2|C<4>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9110	0.000	1	121.0843	1.748	3	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.4480	0.000	1	121.4480	0.000	1	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]Si)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Si)(C[6]C[6]H)(H){1|C<3>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|Si<4>,1|C<2>,1|H<1>}	H(C[6]C[6]2)	118.0910	0.000	1	118.0910	0.000	1	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]Sn)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Sn)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|Sn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2390	0.148	2	121.9847	11.219	4	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]Sn)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Sn)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|Sn<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	123.7305	4.631	2	121.9847	11.219	4	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]Te)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Te)(C[6]C[6]H)(H){2|C<3>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|Te<2>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.2490	0.000	1	119.2490	0.000	1	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pd<4>,3|C<3>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	123.8480	0.000	1	123.8480	0.000	1	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]N[5a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]N[5a]C[6])(C[6]C[6]H)(H){1|O<2>,3|C<3>}	C[6](C[6]C[6]H)(C[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8690	0.000	1	119.8690	0.000	1	120.1214	15.273	477	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:I-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]I)(H)	C[6](C[6]C[6]H)(C[6]C[6])(I)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]I)(H){1|C<3>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6])(I){1|C<3>,2|H<1>}	H(C[6]C[6]2)	115.9690	0.000	1	115.9690	0.000	1	115.9690	0.000	1	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:O-1:	C[6]-3:	C[6](C[6]C[5a]O[6])(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6])(O)	H(C[6]C[6]2)	C[6](C[6]C[5a]O[6])(C[6]C[6]O)(H){3|C<3>}	C[6](C[6]C[6]H)(C[6]C[6])(O){1|C<3>,1|C<4>,1|O<2>}	H(C[6]C[6]2)	119.1500	0.000	1	119.1500	0.000	1	117.5045	5.415	2	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6])(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6])(O){1|Br<1>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	115.8590	0.000	1	115.8590	0.000	1	117.5045	5.415	2	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:Cl-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]N[6]Cl)(H)	C[6](C[6]C[6]H)(N[6]C[6])(Cl)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]N[6]Cl)(H){1|Fe<10>,1|Pd<4>,1|C<3>,2|C<4>}	C[6](C[6]C[6]H)(N[6]C[6])(Cl){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	122.0070	0.000	1	122.0070	0.000	1	121.9376	0.169	15	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:Cl-1:	C[6]-3:	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(N[6]N[6])(Cl)	H(C[6]C[6]2)	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H){1|Pd<4>,1|N<3>}	C[6](C[6]C[6]H)(N[6]N[6])(Cl){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	121.9990	0.000	1	121.4700	0.560	2	121.9376	0.169	15	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:Cl-1:	C[6]-3:	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(N[6]N[6])(Cl)	H(C[6]C[6]2)	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H){2|N<3>}	C[6](C[6]C[6]H)(N[6]N[6])(Cl){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.9410	0.000	1	121.4700	0.560	2	121.9376	0.169	15	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:Cl-1:	C[6]-3:	C[6](C[6]N[6]Cl)(C[6]N[6]2)(H)	C[6](C[6]C[6]H)(N[6]C[6])(Cl)	H(C[6]C[6]2)	C[6](C[6]N[6]Cl)(C[6]N[6]2)(H){1|Ru<6>,1|C<4>,2|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(Cl){1|H<1>,2|N<3>}	H(C[6]C[6]2)	121.5630	0.000	1	121.5630	0.000	1	121.9376	0.169	15	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:Cl-1:	C[6]-3:	C[6](C[6]N[6]Cl)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6])(Cl)	H(C[6]C[6]2)	C[6](C[6]N[6]Cl)(C[6]N[6]N)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6])(Cl){1|N<1>,2|N<3>}	H(C[6]C[6]2)	122.5980	0.000	1	122.1630	0.087	8	121.9376	0.169	15	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:Cl-1:	C[6]-3:	C[6](C[6]N[6]Cl)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6])(Cl)	H(C[6]C[6]2)	C[6](C[6]N[6]Cl)(C[6]N[6]N)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6])(Cl){3|N<3>}	H(C[6]C[6]2)	121.9835	0.287	4	122.1630	0.087	8	121.9376	0.169	15	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:Cl-1:	C[6]-3:	C[6](C[6]N[6]Cl)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6])(Cl)	H(C[6]C[6]2)	C[6](C[6]N[6]Cl)(C[6]N[6]N)(H){1|Fe<5>,1|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(Cl){3|N<3>}	H(C[6]C[6]2)	122.2110	0.072	2	122.1630	0.087	8	121.9376	0.169	15	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:Cl-1:	C[6]-3:	C[6](C[6]N[6]Cl)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6])(Cl)	H(C[6]C[6]2)	C[6](C[6]N[6]Cl)(C[6]N[6]N)(H){1|Fe<6>,1|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(Cl){3|N<3>}	H(C[6]C[6]2)	122.3500	0.000	1	122.1630	0.087	8	121.9376	0.169	15	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:Cl-1:	C[6]-3:	C[6](C[6]N[6]Cl)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)(N[6]C[6])(Cl)	H(C[6]C[6]2)	C[6](C[6]N[6]Cl)(C[6]N[6]O)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6])(Cl){1|N<3>,2|O<1>}	H(C[6]C[6]2)	121.6300	0.107	2	121.7500	0.049	3	121.9376	0.169	15	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:Cl-1:	C[6]-3:	C[6](C[6]N[6]Cl)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)(N[6]C[6])(Cl)	H(C[6]C[6]2)	C[6](C[6]N[6]Cl)(C[6]N[6]O)(H){1|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(Cl){1|N<2>,1|N<3>,1|O<1>}	H(C[6]C[6]2)	121.9900	0.000	1	121.7500	0.049	3	121.9376	0.169	15	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|C<2>,1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(H){2|C<3>}	H(C[6]C[6]2)	134.0690	0.000	1	126.8985	102.832	2	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|C<2>,2|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<2>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.7280	0.000	1	126.8985	102.832	2	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<2>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<2>,1|C<3>}	H(C[6]C[6]2)	122.4640	0.000	1	123.4627	2.115	3	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<2>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	122.7930	0.000	1	123.4627	2.115	3	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<2>,2|C<3>}	H(C[6]C[6]2)	125.1310	0.000	1	123.4627	2.115	3	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<2>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4140	0.000	1	122.7073	29.632	8	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|O<1>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|Br<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5010	0.000	1	122.7073	29.632	8	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<4>,2|H<1>}	H(C[6]C[6]2)	120.0850	0.000	1	122.7073	29.632	8	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,2|C<4>}	H(C[6]C[6]2)	120.2280	0.000	1	122.7073	29.632	8	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<2>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	123.2930	0.000	1	122.7073	29.632	8	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<2>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	122.2120	0.000	1	122.7073	29.632	8	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,2|C<2>}	H(C[6]C[6]2)	135.7830	0.000	1	122.7073	29.632	8	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<8>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|Rh<8>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.1420	0.000	1	122.7073	29.632	8	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]N[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|N<3>}	C[6](C[6]C[6]H)(N[6]N[6])(H){1|Ca<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.4045	1.053	2	121.1279	0.254	33	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]N[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|N<3>}	C[6](C[6]C[6]H)(N[6]N[6])(H){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.1160	0.000	1	121.1279	0.254	33	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]N[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|N<3>}	C[6](C[6]C[6]H)(N[6]N[6])(H){1|Li<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0200	0.000	1	121.1279	0.254	33	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]N[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|N<3>}	C[6](C[6]C[6]H)(N[6]N[6])(H){1|Mg<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7840	0.000	1	121.1279	0.254	33	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]N[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(N[6]N[6])(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6407	0.491	6	121.1279	0.254	33	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]N[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(N[6]N[6])(H){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.3257	0.198	3	121.1279	0.254	33	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]N[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(N[6]N[6])(H){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.4089	0.209	9	121.1279	0.254	33	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]N[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(N[6]N[6])(H){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.0510	0.575	4	121.1279	0.254	33	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]N[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(N[6]N[6])(H){1|Re<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.2410	0.000	1	121.1279	0.254	33	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]N[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(N[6]N[6])(H){1|Ru<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.7160	0.000	1	121.1279	0.254	33	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]N[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(N[6]N[6])(H){1|Zn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.2078	0.274	4	121.1279	0.254	33	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H){1|Co<6>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	121.4183	0.328	3	121.6839	0.190	16	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H){1|Co<8>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,2|N<3>}	H(C[6]C[6]2)	122.1330	0.000	1	121.6839	0.190	16	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H){1|Cu<5>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	121.5460	0.016	2	121.6839	0.190	16	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H){1|Ir<8>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.1080	0.000	1	121.6839	0.190	16	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H){1|Ir<8>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,2|N<3>}	H(C[6]C[6]2)	122.0480	0.000	1	121.6839	0.190	16	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H){1|N<3>,1|V<7>,2|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.3230	0.000	1	121.6839	0.190	16	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H){1|N<3>,1|V<7>,2|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,2|N<3>}	H(C[6]C[6]2)	122.1100	0.000	1	121.6839	0.190	16	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H){1|Ni<5>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	122.1515	0.808	2	121.6839	0.190	16	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H){1|Rh<8>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,2|N<3>}	H(C[6]C[6]2)	121.9410	0.000	1	121.6839	0.190	16	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H){1|Ru<9>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,2|N<3>}	H(C[6]C[6]2)	121.8920	0.000	1	121.6839	0.190	16	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H){1|Zn<5>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	121.3685	0.037	2	121.6839	0.190	16	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|Ru<10>,1|Ru<8>,1|C<4>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|Ru<10>,1|O<2>,2|C<4>}	H(C[6]C[6]2)	120.6290	0.000	1	120.6290	0.000	1	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|C<2>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|S<2>}	H(C[6]C[6]2)	118.1670	0.000	1	118.1670	0.000	1	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){3|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<2>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	114.1135	1.705	2	114.1135	2.906	2	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]N[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]N[6]C)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<4>,2|N<3>}	H(C[6]C[6]2)	120.7843	0.197	3	121.1866	0.139	10	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]N[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]N[6]C)(C[6]N[6]H)(H){1|Co<6>,1|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.4110	0.000	1	121.1866	0.139	10	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]N[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]N[6]C)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	121.0175	0.100	2	121.1866	0.139	10	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]N[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]N[6]C)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.4100	0.194	2	121.1866	0.139	10	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]N[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]N[6]C)(C[6]N[6]H)(H){1|Li<5>,1|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.6235	0.220	2	121.1866	0.139	10	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]N[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)(C[6]N[6]N)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|S<1>,2|N<3>}	H(C[6]C[6]2)	122.1700	0.000	1	121.7825	0.300	2	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]N[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)(C[6]N[6]N)(H){1|Co<6>,1|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(H){3|N<3>}	H(C[6]C[6]2)	121.3950	0.000	1	121.7825	0.300	2	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]N[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)(C[6]N[6]O)(H){1|Zn<4>,1|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|N<3>,2|O<1>}	H(C[6]C[6]2)	124.8350	0.000	1	124.8350	0.000	1	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]N[6]H)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)(C[6]N[6]S)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|N<3>,2|S<2>}	H(C[6]C[6]2)	121.1510	0.000	1	121.1510	0.000	1	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Ag<4>,1|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	121.6070	0.000	1	121.4758	0.834	361	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|C<3>,1|C<4>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<2>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.2440	0.000	1	121.4758	0.834	361	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|C<3>,1|C<4>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	121.6030	0.219	2	121.4758	0.834	361	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|C<3>,1|C<4>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	121.0370	0.000	1	121.4758	0.834	361	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.4360	0.243	6	121.4758	0.834	361	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	121.7329	1.108	12	121.4758	0.834	361	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,1|N<3>,1|S<1>}	H(C[6]C[6]2)	122.0570	1.721	3	121.4758	0.834	361	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	121.7773	0.087	3	121.4758	0.834	361	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	121.8451	1.350	32	121.4758	0.834	361	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.6673	0.528	3	121.4758	0.834	361	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|C<3>,1|O<1>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.7790	0.000	1	121.4758	0.834	361	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|C<3>,1|W<7>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	121.0080	0.000	1	121.4758	0.834	361	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Ca<11>,1|C<4>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|Ca<11>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	121.7420	0.000	1	121.4758	0.834	361	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Ca<8>,1|C<4>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|Ca<8>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	121.8240	0.000	1	121.4758	0.834	361	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Cd<6>,1|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.4060	0.164	4	121.4758	0.834	361	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Cd<6>,1|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	122.0160	0.000	1	121.4758	0.834	361	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Ce<17>,1|C<4>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|Ce<17>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	121.3970	0.000	1	121.4758	0.834	361	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Co<6>,1|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.2350	0.921	10	121.4758	0.834	361	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Cr<6>,1|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.2140	0.000	1	121.4758	0.834	361	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Cu<4>,1|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.5658	0.410	4	121.4758	0.834	361	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Cu<4>,1|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	121.7178	0.140	5	121.4758	0.834	361	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Cu<4>,1|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	121.4940	0.000	1	121.4758	0.834	361	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Cu<5>,1|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.4450	0.000	1	121.4758	0.834	361	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Cu<5>,1|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	121.7970	0.000	1	121.4758	0.834	361	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Cu<5>,1|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	121.5206	0.278	10	121.4758	0.834	361	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Cu<6>,1|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	121.2670	0.000	1	121.4758	0.834	361	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Cu<6>,1|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	121.7810	0.000	1	121.4758	0.834	361	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Eu<9>,1|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.4592	0.081	4	121.4758	0.834	361	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Fe<6>,1|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.2234	0.268	21	121.4758	0.834	361	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Fe<6>,1|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	121.4825	0.163	4	121.4758	0.834	361	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Ir<6>,1|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.3884	0.615	14	121.4758	0.834	361	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Ir<8>,1|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	122.0515	0.865	8	121.4758	0.834	361	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Mn<6>,1|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.5056	0.422	28	121.4758	0.834	361	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Mn<6>,1|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	121.3670	0.211	2	121.4758	0.834	361	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Mn<6>,1|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	121.3940	0.000	1	121.4758	0.834	361	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Mn<7>,1|C<4>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|Mn<7>,1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	121.2860	0.000	1	121.4758	0.834	361	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Ni<4>,1|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.2515	0.221	4	121.4758	0.834	361	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Ni<4>,1|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	121.9400	0.175	3	121.4758	0.834	361	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Ni<6>,1|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.3691	0.283	20	121.4758	0.834	361	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Ni<6>,1|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	121.7698	0.126	5	121.4758	0.834	361	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Ni<6>,1|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	124.5897	5.837	4	121.4758	0.834	361	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Pd<4>,1|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.4491	0.370	15	121.4758	0.834	361	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Pd<4>,1|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	122.0630	0.083	2	121.4758	0.834	361	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Pd<4>,1|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	121.2512	0.255	20	121.4758	0.834	361	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Pd<4>,1|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	121.3455	0.197	4	121.4758	0.834	361	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Pd<6>,1|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.4395	0.186	2	121.4758	0.834	361	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Pt<4>,1|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.1371	0.543	21	121.4758	0.834	361	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Pt<5>,1|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	121.4020	0.279	2	121.4758	0.834	361	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Pt<6>,1|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.9693	0.219	4	121.4758	0.834	361	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Re<6>,1|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.3525	0.407	17	121.4758	0.834	361	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Re<6>,1|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,1|N<3>,1|S<3>}	H(C[6]C[6]2)	120.3990	0.000	1	121.4758	0.834	361	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Re<6>,1|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	121.0687	0.240	4	121.4758	0.834	361	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Re<6>,1|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	122.4400	0.000	1	121.4758	0.834	361	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Rh<6>,1|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	121.0365	0.477	2	121.4758	0.834	361	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Rh<8>,1|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	121.5086	1.132	5	121.4758	0.834	361	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Ru<6>,1|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.2133	0.426	4	121.4758	0.834	361	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Ru<6>,1|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	121.2814	0.414	8	121.4758	0.834	361	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Ru<7>,1|C<4>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|Ru<7>,1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	119.8710	0.000	1	121.4758	0.834	361	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Ru<8>,1|C<4>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|Ru<8>,1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	121.2553	0.309	7	121.4758	0.834	361	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Ru<9>,1|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	121.4980	0.000	1	121.4758	0.834	361	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Sn<7>,1|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	121.4620	0.198	3	121.4758	0.834	361	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|U<16>,1|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.8040	0.000	1	121.4758	0.834	361	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Zn<4>,1|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	121.9935	0.657	2	121.4758	0.834	361	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Zn<4>,1|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	122.0450	0.000	1	121.4758	0.834	361	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Zn<5>,1|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.5875	0.351	2	121.4758	0.834	361	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](C[6]C[6]H)(N[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Zn<6>,1|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.5073	0.033	3	121.4758	0.834	361	121.4767	1.932	441	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:O-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)(N[6]N[6])(O)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]O)(H){1|C<4>,1|N<2>}	C[6](C[6]C[6]H)(N[6]N[6])(O){1|C<3>,1|C<4>}	H(C[6]C[6]2)	120.3250	0.000	1	120.3250	0.000	1	119.1182	1.497	16	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)(N[6]C[6])(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|C<3>,1|C<4>}	C[6](C[6]C[6]H)(N[6]C[6])(O){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.4650	0.000	1	119.8725	0.332	2	119.1182	1.497	16	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)(N[6]C[6])(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6])(O){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.2800	0.000	1	119.8725	0.332	2	119.1182	1.497	16	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:O-1:	C[6]-3:	C[6](C[6]N[6]C)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)(N[6]C[6])(O)	H(C[6]C[6]2)	C[6](C[6]N[6]C)(C[6]N[6]O)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6])(O){1|C<3>,1|N<3>,1|O<1>}	H(C[6]C[6]2)	116.5870	0.000	1	116.5870	0.000	1	119.1182	1.497	16	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:O-1:	C[6]-3:	C[6](C[6]N[6]Cl)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)(N[6]C[6])(O)	H(C[6]C[6]2)	C[6](C[6]N[6]Cl)(C[6]N[6]O)(H){1|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(O){1|Cl<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	121.9380	0.000	1	121.9380	0.000	1	119.1182	1.497	16	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:O-1:	C[6]-3:	C[6](C[6]N[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)(N[6]C[6])(O)	H(C[6]C[6]2)	C[6](C[6]N[6]H)(C[6]N[6]O)(H){1|C<3>,1|C<4>}	C[6](C[6]C[6]H)(N[6]C[6])(O){1|H<1>,1|N<3>,1|O<1>}	H(C[6]C[6]2)	120.0475	0.110	2	120.0475	0.012	2	119.1182	1.497	16	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:O-1:	C[6]-3:	C[6](C[6]N[6]O)(C[6]O[6]C)(H)	C[6](C[6]C[6]H)(N[6]S[6])(O)	H(C[6]C[6]2)	C[6](C[6]N[6]O)(C[6]O[6]C)(H){1|S<4>}	C[6](C[6]C[6]H)(N[6]S[6])(O){1|C<4>,1|O<2>,2|O<1>}	H(C[6]C[6]2)	118.5779	0.317	9	118.5779	0.100	9	119.1182	1.497	16	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:H-1:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]O[6]H)(H)	C[6](C[6]C[6]H)(O[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]O[6]H)(H){1|C<3>,1|H<1>,2|S<2>}	C[6](C[6]C[6]H)(O[6]C[6])(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.4895	0.110	2	119.4895	0.012	2	120.0556	0.700	58	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]O)(C[6]O[6]H)(H)	C[6](C[6]C[6]H)(O[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]O[6]H)(H){1|C<3>,1|O<2>}	C[6](C[6]C[6]H)(O[6]C[6])(H){1|C<3>,1|C<4>,1|O<2>}	H(C[6]C[6]2)	120.5866	0.643	18	120.1402	1.481	25	120.0556	0.700	58	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]O)(C[6]O[6]H)(H)	C[6](C[6]C[6]H)(O[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]O[6]H)(H){1|C<4>,2|H<1>}	C[6](C[6]C[6]H)(O[6]C[6])(H){1|C<3>,1|C<4>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	119.2870	0.402	2	120.1402	1.481	25	120.0556	0.700	58	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]O)(C[6]O[6]H)(H)	C[6](C[6]C[6]H)(O[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]O[6]H)(H){1|C<4>,2|H<1>}	C[6](C[6]C[6]H)(O[6]C[6])(H){1|C<3>,1|O<1>,2|C<4>}	H(C[6]C[6]2)	119.9820	0.000	1	120.1402	1.481	25	120.0556	0.700	58	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]O)(C[6]O[6]H)(H)	C[6](C[6]C[6]H)(O[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]O[6]H)(H){1|C<4>,2|H<1>}	C[6](C[6]C[6]H)(O[6]C[6])(H){1|H<1>,1|O<1>,2|C<4>}	H(C[6]C[6]2)	118.5980	2.143	4	120.1402	1.481	25	120.0556	0.700	58	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]S)(C[6]O[6]H)(H)	C[6](C[6]C[6]H)(O[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]S)(C[6]O[6]H)(H){1|C<3>,1|O<2>}	C[6](C[6]C[6]H)(O[6]C[6])(H){1|C<3>,1|C<4>,1|S<1>}	H(C[6]C[6]2)	119.7520	0.108	4	120.0100	0.120	25	120.0556	0.700	58	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]S)(C[6]O[6]H)(H)	C[6](C[6]C[6]H)(O[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]S)(C[6]O[6]H)(H){1|C<3>,1|O<2>}	C[6](C[6]C[6]H)(O[6]C[6])(H){1|C<3>,1|C<4>,1|S<2>}	H(C[6]C[6]2)	120.1243	0.305	19	120.0100	0.120	25	120.0556	0.700	58	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]S)(C[6]O[6]H)(H)	C[6](C[6]C[6]H)(O[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]S)(C[6]O[6]H)(H){1|C<3>,1|O<2>}	C[6](C[6]C[6]H)(O[6]C[6])(H){1|S<1>,2|C<3>}	H(C[6]C[6]2)	119.4400	0.102	2	120.0100	0.120	25	120.0556	0.700	58	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]Se)(C[6]O[6]H)(H)	C[6](C[6]C[6]H)(O[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Se)(C[6]O[6]H)(H){1|C<3>,1|O<2>}	C[6](C[6]C[6]H)(O[6]C[6])(H){1|Se<2>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	120.0817	0.344	6	120.0817	0.118	6	120.0556	0.700	58	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:O-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]O[6]O)(H)	C[6](C[6]C[6]H)(O[6]C[6])(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]O[6]O)(H){1|C<3>,2|C<4>}	C[6](C[6]C[6]H)(O[6]C[6])(O){1|H<1>,3|C<4>}	H(C[6]C[6]2)	118.3257	2.140	4	118.3257	4.580	4	119.0499	1.175	39	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:O-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]O[6]O)(H)	C[6](C[6]C[6]H)(O[6]C[6])(O)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]O[6]O)(H){1|C<4>,2|H<1>}	C[6](C[6]C[6]H)(O[6]C[6])(O){1|H<1>,3|C<4>}	H(C[6]C[6]2)	119.3500	0.617	3	119.1570	0.403	4	119.0499	1.175	39	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:O-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]O[6]O)(H)	C[6](C[6]C[6]H)(O[6]C[6])(O)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]O[6]O)(H){1|H<1>,2|C<4>}	C[6](C[6]C[6]H)(O[6]C[6])(O){4|C<4>}	H(C[6]C[6]2)	118.5780	0.000	1	119.1570	0.403	4	119.0499	1.175	39	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]O[6]O)(H)	C[6](C[6]C[6]H)(O[6]C[6])(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]O[6]O)(H){1|C<3>,1|C<4>}	C[6](C[6]C[6]H)(O[6]C[6])(O){1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.0860	0.000	1	119.2152	0.770	12	119.0499	1.175	39	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]O[6]O)(H)	C[6](C[6]C[6]H)(O[6]C[6])(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]O[6]O)(H){1|C<4>,1|F<1>,1|H<1>}	C[6](C[6]C[6]H)(O[6]C[6])(O){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.6600	0.000	1	119.2152	0.770	12	119.0499	1.175	39	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]O[6]O)(H)	C[6](C[6]C[6]H)(O[6]C[6])(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]O[6]O)(H){1|C<4>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(O[6]C[6])(O){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.4220	0.000	1	119.2152	0.770	12	119.0499	1.175	39	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]O[6]O)(H)	C[6](C[6]C[6]H)(O[6]C[6])(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]O[6]O)(H){1|C<4>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(O[6]C[6])(O){2|C<4>,2|H<1>}	H(C[6]C[6]2)	116.7440	0.000	1	119.2152	0.770	12	119.0499	1.175	39	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]O[6]O)(H)	C[6](C[6]C[6]H)(O[6]C[6])(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]O[6]O)(H){1|C<4>,2|F<1>}	C[6](C[6]C[6]H)(O[6]C[6])(O){2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.3550	0.000	1	119.2152	0.770	12	119.0499	1.175	39	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]O[6]O)(H)	C[6](C[6]C[6]H)(O[6]C[6])(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]O[6]O)(H){1|C<4>,2|H<1>}	C[6](C[6]C[6]H)(O[6]C[6])(O){2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.6164	0.202	7	119.2152	0.770	12	119.0499	1.175	39	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:O-1:	C[6]-3:	C[6](C[6]C[6]O)(C[6]O[6]O)(H)	C[6](C[6]C[6]H)(O[6]C[6])(O)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]O[6]O)(H){1|C<4>,2|H<1>}	C[6](C[6]C[6]H)(O[6]C[6])(O){1|C<3>,1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	118.7423	1.482	3	119.0221	1.377	9	119.0499	1.175	39	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:O-1:	C[6]-3:	C[6](C[6]C[6]O)(C[6]O[6]O)(H)	C[6](C[6]C[6]H)(O[6]C[6])(O)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]O[6]O)(H){1|H<1>,2|C<4>}	C[6](C[6]C[6]H)(O[6]C[6])(O){1|C<3>,1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	118.6827	1.535	3	119.0221	1.377	9	119.0499	1.175	39	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:O-1:	C[6]-3:	C[6](C[6]C[6]O)(C[6]O[6]O)(H)	C[6](C[6]C[6]H)(O[6]C[6])(O)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]O[6]O)(H){1|H<1>,2|C<4>}	C[6](C[6]C[6]H)(O[6]C[6])(O){1|H<1>,1|O<2>,2|C<4>}	H(C[6]C[6]2)	119.9150	0.000	1	119.0221	1.377	9	119.0499	1.175	39	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:O-1:	C[6]-3:	C[6](C[6]C[6]O)(C[6]O[6]O)(H)	C[6](C[6]C[6]H)(O[6]C[6])(O)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]O[6]O)(H){3|C<4>}	C[6](C[6]C[6]H)(O[6]C[6])(O){1|H<1>,1|O<1>,2|C<4>}	H(C[6]C[6]2)	119.5045	0.245	2	119.0221	1.377	9	119.0499	1.175	39	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:O-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]O[6]O)(H)	C[6](C[6]C[6]H)(O[6]C[6])(O)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]O[6]O)(H){1|C<4>,3|C<3>}	C[6](C[6]C[6]H)(O[6]C[6])(O){2|C<3>,2|H<1>}	H(C[6]C[6]2)	118.3455	0.448	2	118.8292	0.644	5	119.0499	1.175	39	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:O-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]O[6]O)(H)	C[6](C[6]C[6]H)(O[6]C[6])(O)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]O[6]O)(H){1|Cl<1>,1|C<4>,1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(O[6]C[6])(O){1|C<4>,3|C<3>}	H(C[6]C[6]2)	118.1700	0.000	1	118.8292	0.644	5	119.0499	1.175	39	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:O-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]O[6]O)(H)	C[6](C[6]C[6]H)(O[6]C[6])(O)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]O[6]O)(H){2|H<1>,3|C<3>}	C[6](C[6]C[6]H)(O[6]C[6])(O){1|C<3>,1|C<4>,1|O<1>}	H(C[6]C[6]2)	119.6425	0.385	2	118.8292	0.644	5	119.0499	1.175	39	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:O-1:	C[6]-3:	C[6](C[6]N[6]C)(C[6]O[6]O)(H)	C[6](C[6]C[6]H)(O[6]C[6])(O)	H(C[6]C[6]2)	C[6](C[6]N[6]C)(C[6]O[6]O)(H){1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(O[6]C[6])(O){1|C<4>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.3200	0.000	1	120.3200	0.000	1	119.0499	1.175	39	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:O-1:	C[6]-3:	C[6](C[6]O[6]C)(C[6]O[6]O)(H)	C[6](C[6]C[6]H)(O[6]C[6])(O)	H(C[6]C[6]2)	C[6](C[6]O[6]C)(C[6]O[6]O)(H){1|C<4>}	C[6](C[6]C[6]H)(O[6]C[6])(O){1|O<2>,3|C<4>}	H(C[6]C[6]2)	119.1918	1.038	4	119.1918	1.077	4	119.0499	1.175	39	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:S[6]-2:H-1:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]S[6]H)(H)	C[6](C[6]C[6]H)(S[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]S[6]H)(H){1|C<3>,1|H<1>,2|S<2>}	C[6](C[6]C[6]H)(S[6]C[6])(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	117.1700	0.506	2	117.1700	0.256	2	117.4372	0.134	5	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:S[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]S)(C[6]S[6]H)(H)	C[6](C[6]C[6]H)(S[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]S)(C[6]S[6]H)(H){1|C<3>,1|O<2>}	C[6](C[6]C[6]H)(S[6]C[6])(H){1|C<3>,1|C<4>,1|S<2>}	H(C[6]C[6]2)	117.6153	0.147	3	117.6153	0.022	3	117.4372	0.134	5	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]N[6]H)(C[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(C[6]C[6])(H){1|C<3>,2|C<4>}	H(C[6]C[6]N[6])	121.3010	0.000	1	121.3010	0.000	1	121.8328	1.901	5	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]N[6]H)(C[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|Br<1>,1|C<3>}	C[6](C[6]N[6]H)(C[6]C[6])(H){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	120.0430	0.000	1	121.9657	2.417	4	121.8328	1.901	5	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]N[6]H)(C[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|C<4>}	C[6](C[6]N[6]H)(C[6]C[6])(H){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	122.6067	1.078	3	121.9657	2.417	4	121.8328	1.901	5	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:N[6]-2:Br-1:	C[6]-3:	C[6](C[6]N[6]Br)(N[6]C[6]Co)(H)	C[6](C[6]N[6]H)(N[6]C[6])(Br)	H(C[6]C[6]N[6])	C[6](C[6]N[6]Br)(N[6]C[6]Co)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6])(Br){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.7060	0.000	1	119.7060	0.000	1	120.1510	0.518	4	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:N[6]-2:Br-1:	C[6]-3:	C[6](C[6]N[6]Br)(N[6]C[6]Ni)(H)	C[6](C[6]N[6]H)(N[6]C[6])(Br)	H(C[6]C[6]N[6])	C[6](C[6]N[6]Br)(N[6]C[6]Ni)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6])(Br){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.6650	0.000	1	119.6650	0.000	1	120.1510	0.518	4	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:N[6]-2:Br-1:	C[6]-3:	C[6](C[6]N[6]Br)(N[6]C[6]Re)(H)	C[6](C[6]N[6]H)(N[6]C[6])(Br)	H(C[6]C[6]N[6])	C[6](C[6]N[6]Br)(N[6]C[6]Re)(H){1|C<3>,1|N<3>}	C[6](C[6]N[6]H)(N[6]C[6])(Br){1|Re<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	120.6165	0.828	2	120.6165	0.686	2	120.1510	0.518	4	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:N[6]-2:Cl-1:	C[6]-3:	C[6](C[6]N[6]Cl)(N[6]C[6]Co)(H)	C[6](C[6]N[6]H)(N[6]C[6])(Cl)	H(C[6]C[6]N[6])	C[6](C[6]N[6]Cl)(N[6]C[6]Co)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6])(Cl){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.5780	0.000	1	119.5780	0.000	1	120.2978	0.833	16	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:N[6]-2:Cl-1:	C[6]-3:	C[6](C[6]N[6]Cl)(N[6]C[6]Fe)(H)	C[6](C[6]N[6]H)(N[6]C[6])(Cl)	H(C[6]C[6]N[6])	C[6](C[6]N[6]Cl)(N[6]C[6]Fe)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6])(Cl){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.9080	0.000	1	119.9080	0.000	1	120.2978	0.833	16	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:N[6]-2:Cl-1:	C[6]-3:	C[6](C[6]N[6]Cl)(N[6]C[6]Ni)(H)	C[6](C[6]N[6]H)(N[6]C[6])(Cl)	H(C[6]C[6]N[6])	C[6](C[6]N[6]Cl)(N[6]C[6]Ni)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6])(Cl){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.4850	0.000	1	119.4850	0.000	1	120.2978	0.833	16	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:N[6]-2:Cl-1:	C[6]-3:	C[6](C[6]N[6]Cl)(N[6]C[6]O)(H)	C[6](C[6]N[6]H)(N[6]C[6])(Cl)	H(C[6]C[6]N[6])	C[6](C[6]N[6]Cl)(N[6]C[6]O)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6])(Cl){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]N[6])	123.4740	0.000	1	123.4740	0.000	1	120.2978	0.833	16	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:N[6]-2:Cl-1:	C[6]-3:	C[6](C[6]N[6]Cl)(N[6]C[6]Zn)(H)	C[6](C[6]N[6]H)(N[6]C[6])(Cl)	H(C[6]C[6]N[6])	C[6](C[6]N[6]Cl)(N[6]C[6]Zn)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6])(Cl){1|Cl<1>,1|Zn<4>,1|C<3>}	H(C[6]C[6]N[6])	120.1933	0.293	12	120.1933	0.086	12	120.2978	0.833	16	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6]B)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6]B)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.0845	0.155	2	119.0845	0.024	2	120.7088	1.790	87	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6]C)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6]C)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	120.6565	0.464	14	120.6269	0.200	25	120.7088	1.790	87	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6]C)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6]C)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]N[6])	121.0737	0.274	3	120.6269	0.200	25	120.7088	1.790	87	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6]C)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6]C)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|C<3>,1|C<5>,1|H<1>}	H(C[6]C[6]N[6])	120.1910	0.040	2	120.6269	0.200	25	120.7088	1.790	87	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6]C)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6]C)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|C<3>,2|C<4>}	H(C[6]C[6]N[6])	120.6638	0.104	4	120.6269	0.200	25	120.7088	1.790	87	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6]C)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6]C)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|C<4>,2|C<3>}	H(C[6]C[6]N[6])	120.4950	0.000	1	120.6269	0.200	25	120.7088	1.790	87	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6]C)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6]C)(H){1|C<3>,1|S<1>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	119.7280	0.000	1	120.6269	0.200	25	120.7088	1.790	87	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6]H)(H){1|C<3>,1|C<4>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	125.0335	0.459	2	120.9391	2.880	43	120.7088	1.790	87	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]N[6])	121.4435	0.101	2	120.9391	2.880	43	120.7088	1.790	87	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	121.4649	2.297	13	120.9391	2.880	43	120.7088	1.790	87	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|H<1>,2|C<3>}	H(C[6]C[6]N[6])	120.3610	1.785	2	120.9391	2.880	43	120.7088	1.790	87	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6]H)(H){1|C<3>,1|N<3>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	119.8622	0.416	6	120.9391	2.880	43	120.7088	1.790	87	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6]H)(H){1|C<3>,1|N<3>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|H<1>,2|C<3>}	H(C[6]C[6]N[6])	120.3746	0.104	8	120.9391	2.880	43	120.7088	1.790	87	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6]H)(H){1|C<3>,1|S<1>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]N[6])	120.7670	0.000	1	120.9391	2.880	43	120.7088	1.790	87	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6]H)(H){1|C<3>,1|S<2>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|S<2>}	H(C[6]C[6]N[6])	120.4483	0.867	6	120.9391	2.880	43	120.7088	1.790	87	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6]H)(H){1|C<3>,1|S<3>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|S<3>}	H(C[6]C[6]N[6])	120.6230	0.058	2	120.9391	2.880	43	120.7088	1.790	87	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6]H)(H){2|C<3>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Cl<1>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	120.7890	0.000	1	120.9391	2.880	43	120.7088	1.790	87	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6]O)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6]O)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]N[6])	120.5755	0.152	10	120.7499	0.900	13	120.7088	1.790	87	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6]O)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6]O)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|C<3>,1|O<1>,1|S<4>}	H(C[6]C[6]N[6])	119.8950	0.000	1	120.7499	0.900	13	120.7088	1.790	87	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6]O)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6]O)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Cl<1>,1|C<3>,1|O<1>}	H(C[6]C[6]N[6])	123.8070	0.000	1	120.7499	0.900	13	120.7088	1.790	87	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6]O)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6]O)(H){2|C<3>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]N[6])	120.2920	0.000	1	120.7499	0.900	13	120.7088	1.790	87	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6]V)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6]V)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|V<11>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	120.2160	0.710	2	120.2160	0.504	2	120.7088	1.790	87	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6]W)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6]W)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,1|W<6>}	H(C[6]C[6]N[6])	118.6320	0.105	2	118.6320	0.011	2	120.7088	1.790	87	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:O[6]-2:H-1:	C[6]-3:	C[6](C[6]O[6]H)(N[6]C[6]2)(H)	C[6](C[6]N[6]H)(O[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](C[6]O[6]H)(N[6]C[6]2)(H){1|C<4>,2|H<1>,2|N<2>}	C[6](C[6]N[6]H)(O[6]C[6])(H){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6]N[6])	112.4670	0.000	1	112.4670	0.000	1	118.6763	19.725	4	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:O[6]-2:H-1:	C[6]-3:	C[6](C[6]O[6]H)(N[6]C[6]C)(H)	C[6](C[6]N[6]H)(O[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](C[6]O[6]H)(N[6]C[6]C)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(O[6]C[6])(H){1|H<1>,2|C<3>}	H(C[6]C[6]N[6])	119.6110	0.198	2	120.7460	3.884	3	118.6763	19.725	4	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:O[6]-2:H-1:	C[6]-3:	C[6](C[6]O[6]H)(N[6]C[6]C)(H)	C[6](C[6]N[6]H)(O[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](C[6]O[6]H)(N[6]C[6]C)(H){2|C<3>}	C[6](C[6]N[6]H)(O[6]C[6])(H){1|H<1>,2|C<3>}	H(C[6]C[6]N[6])	123.0160	0.000	1	120.7460	3.884	3	118.6763	19.725	4	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	C[6]-3:O[6]-3:H-1:	C[6]-3:O[6]-2:H-1:	C[6]-3:	C[6](C[6]O[6]H)(O[6]C[6]W)(H)	C[6](C[6]O[6]H)(O[6]C[6])(H)	H(C[6]C[6]O[6])	C[6](C[6]O[6]H)(O[6]C[6]W)(H){1|C<4>,2|H<1>}	C[6](C[6]O[6]H)(O[6]C[6])(H){1|C<4>,1|W<6>,2|H<1>}	H(C[6]C[6]O[6])	108.9800	0.000	1	108.9800	0.000	1	108.9800	0.000	1	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](N[5,6]Ga[3x5]C[5,6])(C[6]N[6]H)(H)	C[6](C[6]N[5,6]H)(N[6]C[6])(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]Ga[3x5]C[5,6])(C[6]N[6]H)(H){2|C<3>,2|N<3>,2|S<2>}	C[6](C[6]N[5,6]H)(N[6]C[6])(H){1|Ga<5>,1|C<3>,1|H<1>}	H(C[6]N[5,6]C[6])	120.0000	0.000	1	120.0000	0.000	1	120.0000	0.000	1	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](N[6]C[6]Al)(C[6]C[6]H)(H)	C[6](C[6]N[6]H)(C[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Al)(C[6]C[6]H)(H){2|C<3>}	C[6](C[6]N[6]H)(C[6]C[6])(H){1|Al<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.0970	0.000	1	119.0970	0.000	1	120.6175	3.998	13	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	C[6](C[6]N[6]H)(C[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){2|C<3>}	C[6](C[6]N[6]H)(C[6]C[6])(H){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.6780	0.000	1	117.6780	0.000	1	120.6175	3.998	13	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]N[6]H)(C[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(C[6]C[6])(H){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	121.0220	1.723	2	121.2120	1.592	3	120.6175	3.998	13	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]N[6]H)(C[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){2|C<3>}	C[6](C[6]N[6]H)(C[6]C[6])(H){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	121.5920	0.000	1	121.2120	1.592	3	120.6175	3.998	13	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	C[6](C[6]N[6]H)(C[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){2|C<3>}	C[6](C[6]N[6]H)(C[6]C[6])(H){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2690	0.000	1	118.2690	0.000	1	120.6175	3.998	13	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	C[6](C[6]N[6]H)(C[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|C<3>,1|C<4>}	C[6](C[6]N[6]H)(C[6]C[6])(H){1|Mn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	121.2050	0.000	1	120.3550	1.445	2	120.6175	3.998	13	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	C[6](C[6]N[6]H)(C[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){2|C<3>}	C[6](C[6]N[6]H)(C[6]C[6])(H){1|Mn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.5050	0.000	1	120.3550	1.445	2	120.6175	3.998	13	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	C[6](C[6]N[6]H)(C[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){2|C<3>}	C[6](C[6]N[6]H)(C[6]C[6])(H){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.4680	0.700	2	119.4680	0.490	2	120.6175	3.998	13	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]N[6]H)(C[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){2|C<3>}	C[6](C[6]N[6]H)(C[6]C[6])(H){1|Ru<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	123.6665	0.945	2	123.6665	0.894	2	120.6175	3.998	13	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	C[6](C[6]N[6]H)(C[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){2|C<3>}	C[6](C[6]N[6]H)(C[6]C[6])(H){1|Zn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	122.3680	0.000	1	122.3680	0.000	1	120.6175	3.998	13	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](N[6]C[6]Ag)(C[6]N[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ag)(C[6]N[6]H)(H){2|C<3>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Ag<5>,2|C<3>}	H(C[6]C[6]N[6])	119.0830	0.467	2	119.0830	0.218	2	119.6436	0.532	279	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](N[6]C[6]Al)(C[6]N[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Al)(C[6]N[6]H)(H){2|C<3>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Al<4>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	119.4490	0.123	8	119.3610	0.046	10	119.6436	0.532	279	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](N[6]C[6]Al)(C[6]N[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Al)(C[6]N[6]H)(H){2|C<3>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Al<5>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	119.0090	0.042	2	119.3610	0.046	10	119.6436	0.532	279	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](N[6]C[6]Au)(C[6]N[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Au)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Au<2>,2|C<3>}	H(C[6]C[6]N[6])	119.3250	0.000	1	119.3250	0.000	1	119.6436	0.532	279	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](N[6]C[6]Bi)(C[6]N[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Bi)(C[6]N[6]H)(H){2|C<3>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Bi<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.7660	0.055	2	119.7660	0.003	2	119.6436	0.532	279	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](N[6]C[6]Cd)(C[6]N[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cd)(C[6]N[6]H)(H){2|C<3>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Cd<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.2345	0.216	2	119.2833	0.030	3	119.6436	0.532	279	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](N[6]C[6]Cd)(C[6]N[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cd)(C[6]N[6]H)(H){2|C<3>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Cd<7>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.3810	0.000	1	119.2833	0.030	3	119.6436	0.532	279	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]N[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]N[6]H)(H){1|C<3>,1|C<4>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8880	0.229	3	119.5540	0.441	46	119.6436	0.532	279	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]N[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Br<1>,1|Co<6>,1|C<3>}	H(C[6]C[6]N[6])	119.2920	0.000	1	119.5540	0.441	46	119.6436	0.532	279	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]N[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Cl<1>,1|Co<6>,1|C<3>}	H(C[6]C[6]N[6])	119.4010	0.000	1	119.5540	0.441	46	119.6436	0.532	279	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]N[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Co<6>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	119.4790	0.000	1	119.5540	0.441	46	119.6436	0.532	279	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]N[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8725	0.384	2	119.5540	0.441	46	119.6436	0.532	279	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]N[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Co<6>,1|C<3>,1|I<1>}	H(C[6]C[6]N[6])	119.1010	0.000	1	119.5540	0.441	46	119.6436	0.532	279	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]N[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Co<6>,1|C<3>,1|N<3>}	H(C[6]C[6]N[6])	120.2628	1.031	5	119.5540	0.441	46	119.6436	0.532	279	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]N[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Co<6>,1|C<3>,1|O<2>}	H(C[6]C[6]N[6])	119.5370	0.000	1	119.5540	0.441	46	119.6436	0.532	279	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]N[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Co<6>,1|C<3>,1|S<2>}	H(C[6]C[6]N[6])	119.5460	0.000	1	119.5540	0.441	46	119.6436	0.532	279	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]N[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Co<6>,2|C<3>}	H(C[6]C[6]N[6])	119.0050	0.000	1	119.5540	0.441	46	119.6436	0.532	279	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]N[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]N[6]H)(H){2|C<3>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.5762	0.631	25	119.5540	0.441	46	119.6436	0.532	279	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]N[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]N[6]H)(H){2|C<3>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Co<6>,1|C<3>,1|N<3>}	H(C[6]C[6]N[6])	120.1850	0.000	1	119.5540	0.441	46	119.6436	0.532	279	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]N[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]N[6]H)(H){2|C<3>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Co<6>,2|C<3>}	H(C[6]C[6]N[6])	119.6033	0.023	3	119.5540	0.441	46	119.6436	0.532	279	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Cu<4>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	119.4655	0.227	2	119.7430	0.696	40	119.6436	0.532	279	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Cu<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	122.8060	0.325	2	119.7430	0.696	40	119.6436	0.532	279	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Cu<5>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	119.8907	0.136	4	119.7430	0.696	40	119.6436	0.532	279	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.7850	0.000	1	119.7430	0.696	40	119.6436	0.532	279	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Cu<5>,1|C<3>,1|N<3>}	H(C[6]C[6]N[6])	119.8550	0.257	2	119.7430	0.696	40	119.6436	0.532	279	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Cu<5>,2|C<3>}	H(C[6]C[6]N[6])	119.4975	0.021	2	119.7430	0.696	40	119.6436	0.532	279	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Cu<6>,1|C<3>,1|N<2>}	H(C[6]C[6]N[6])	119.7540	0.000	1	119.7430	0.696	40	119.6436	0.532	279	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H){1|C<3>,1|N<3>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Cu<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.9120	0.000	1	119.7430	0.696	40	119.6436	0.532	279	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H){2|C<3>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Cu<3>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.0350	0.000	1	119.7430	0.696	40	119.6436	0.532	279	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H){2|C<3>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Cu<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.2280	0.122	3	119.7430	0.696	40	119.6436	0.532	279	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H){2|C<3>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Cu<4>,2|C<3>}	H(C[6]C[6]N[6])	119.6120	0.000	1	119.7430	0.696	40	119.6436	0.532	279	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H){2|C<3>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.8154	0.170	11	119.7430	0.696	40	119.6436	0.532	279	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H){2|C<3>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Cu<5>,2|C<3>}	H(C[6]C[6]N[6])	119.9720	0.329	3	119.7430	0.696	40	119.6436	0.532	279	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H){2|C<3>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Cu<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.3028	0.196	5	119.7430	0.696	40	119.6436	0.532	279	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H){2|C<3>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Cu<6>,2|C<3>}	H(C[6]C[6]N[6])	119.7270	0.000	1	119.7430	0.696	40	119.6436	0.532	279	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](N[6]C[6]Fe)(C[6]N[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Fe)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Cl<1>,1|Fe<6>,1|C<3>}	H(C[6]C[6]N[6])	119.1690	0.000	1	119.6497	0.991	17	119.6436	0.532	279	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](N[6]C[6]Fe)(C[6]N[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Fe)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Fe<6>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	119.4750	0.000	1	119.6497	0.991	17	119.6436	0.532	279	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](N[6]C[6]Fe)(C[6]N[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Fe)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.9885	0.162	2	119.6497	0.991	17	119.6436	0.532	279	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](N[6]C[6]Fe)(C[6]N[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Fe)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Fe<6>,1|C<3>,1|S<2>}	H(C[6]C[6]N[6])	119.2210	0.000	1	119.6497	0.991	17	119.6436	0.532	279	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](N[6]C[6]Fe)(C[6]N[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Fe)(C[6]N[6]H)(H){2|C<3>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.8503	1.129	12	119.6497	0.991	17	119.6436	0.532	279	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](N[6]C[6]Ga)(C[6]N[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ga)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Ga<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.7325	0.346	2	119.7325	0.120	2	119.6436	0.532	279	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](N[6]C[6]Hg)(C[6]N[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Hg)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Hg<4>,2|C<3>}	H(C[6]C[6]N[6])	119.5300	0.256	4	119.5300	0.066	4	119.6436	0.532	279	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]N[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]N[6]H)(H){1|C<3>,1|N<3>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Ir<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.0750	0.000	1	119.2690	0.065	3	119.6436	0.532	279	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]N[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]N[6]H)(H){2|C<3>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Ir<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.1750	0.000	1	119.2690	0.065	3	119.6436	0.532	279	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]N[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]N[6]H)(H){2|C<3>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Ir<6>,2|C<3>}	H(C[6]C[6]N[6])	119.5570	0.000	1	119.2690	0.065	3	119.6436	0.532	279	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](N[6]C[6]Mn)(C[6]N[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mn)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Mn<6>,1|C<3>,1|N<2>}	H(C[6]C[6]N[6])	119.0560	0.000	1	119.2219	0.345	24	119.6436	0.532	279	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](N[6]C[6]Mn)(C[6]N[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mn)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Mn<6>,1|C<3>,1|N<3>}	H(C[6]C[6]N[6])	119.6830	0.156	2	119.2219	0.345	24	119.6436	0.532	279	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](N[6]C[6]Mn)(C[6]N[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mn)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Mn<6>,1|C<3>,1|O<2>}	H(C[6]C[6]N[6])	119.5050	0.000	1	119.2219	0.345	24	119.6436	0.532	279	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](N[6]C[6]Mn)(C[6]N[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mn)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Mn<6>,2|C<3>}	H(C[6]C[6]N[6])	119.2225	0.056	2	119.2219	0.345	24	119.6436	0.532	279	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](N[6]C[6]Mn)(C[6]N[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mn)(C[6]N[6]H)(H){2|C<3>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Mn<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.2670	0.000	1	119.2219	0.345	24	119.6436	0.532	279	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](N[6]C[6]Mn)(C[6]N[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mn)(C[6]N[6]H)(H){2|C<3>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Mn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.9314	0.447	14	119.2219	0.345	24	119.6436	0.532	279	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](N[6]C[6]Mn)(C[6]N[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mn)(C[6]N[6]H)(H){2|C<3>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Mn<6>,1|C<3>,1|N<3>}	H(C[6]C[6]N[6])	120.4820	0.462	2	119.2219	0.345	24	119.6436	0.532	279	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](N[6]C[6]Mn)(C[6]N[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mn)(C[6]N[6]H)(H){2|C<3>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Mn<6>,2|C<3>}	H(C[6]C[6]N[6])	119.6830	0.000	1	119.2219	0.345	24	119.6436	0.532	279	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]N[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Br<1>,1|Ni<6>,1|C<3>}	H(C[6]C[6]N[6])	119.2980	0.000	1	119.7937	0.384	23	119.6436	0.532	279	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]N[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Cl<1>,1|Ni<6>,1|C<3>}	H(C[6]C[6]N[6])	119.4730	0.000	1	119.7937	0.384	23	119.6436	0.532	279	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]N[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Ni<6>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	119.5330	0.000	1	119.7937	0.384	23	119.6436	0.532	279	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]N[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Ni<6>,1|C<3>,1|I<1>}	H(C[6]C[6]N[6])	119.2010	0.000	1	119.7937	0.384	23	119.6436	0.532	279	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]N[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]N[6]H)(H){2|C<3>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Ni<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	120.7445	0.517	2	119.7937	0.384	23	119.6436	0.532	279	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]N[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]N[6]H)(H){2|C<3>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.6426	0.613	13	119.7937	0.384	23	119.6436	0.532	279	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]N[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]N[6]H)(H){2|C<3>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Ni<6>,1|C<3>,1|N<3>}	H(C[6]C[6]N[6])	120.2270	0.118	4	119.7937	0.384	23	119.6436	0.532	279	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]N[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]N[6]H)(H){1|C<3>,1|C<4>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.7203	0.313	3	119.8208	0.214	11	119.6436	0.532	279	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]N[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.4693	0.414	4	119.8208	0.214	11	119.6436	0.532	279	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]N[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]N[6]H)(H){2|C<3>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	120.2755	0.392	2	119.8208	0.214	11	119.6436	0.532	279	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]N[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]N[6]H)(H){2|C<3>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Pd<4>,2|C<3>}	H(C[6]C[6]N[6])	120.2200	0.148	2	119.8208	0.214	11	119.6436	0.532	279	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]N[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Pt<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	120.0212	0.210	10	120.0233	0.078	17	119.6436	0.532	279	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]N[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Pt<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	120.0055	0.456	2	120.0233	0.078	17	119.6436	0.532	279	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]N[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]N[6]H)(H){2|C<3>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Pt<4>,2|C<3>}	H(C[6]C[6]N[6])	119.9763	0.500	3	120.0233	0.078	17	119.6436	0.532	279	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]N[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]N[6]H)(H){2|C<3>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Pt<5>,2|C<3>}	H(C[6]C[6]N[6])	120.3680	0.000	1	120.0233	0.078	17	119.6436	0.532	279	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]N[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]N[6]H)(H){2|C<3>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Pt<6>,2|C<3>}	H(C[6]C[6]N[6])	119.8760	0.000	1	120.0233	0.078	17	119.6436	0.532	279	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](N[6]C[6]Re)(C[6]N[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Re)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Re<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	121.7460	3.028	2	119.6774	0.872	24	119.6436	0.532	279	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](N[6]C[6]Re)(C[6]N[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Re)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Re<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.4993	0.320	14	119.6774	0.872	24	119.6436	0.532	279	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](N[6]C[6]Re)(C[6]N[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Re)(C[6]N[6]H)(H){2|C<3>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Re<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.4719	0.179	8	119.6774	0.872	24	119.6436	0.532	279	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](N[6]C[6]Rh)(C[6]N[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Rh)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Rh<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.4330	0.156	2	119.4330	0.024	2	119.6436	0.532	279	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]N[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]N[6]H)(H){1|C<3>,1|C<4>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Ru<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.1150	0.000	1	119.3904	0.044	12	119.6436	0.532	279	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]N[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Ru<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.3950	0.123	2	119.3904	0.044	12	119.6436	0.532	279	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]N[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]N[6]H)(H){2|C<3>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Ru<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.3265	0.189	2	119.3904	0.044	12	119.6436	0.532	279	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]N[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]N[6]H)(H){2|C<3>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Ru<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.4467	0.234	7	119.3904	0.044	12	119.6436	0.532	279	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](N[6]C[6]Sn)(C[6]N[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Sn)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Sn<6>,2|C<3>}	H(C[6]C[6]N[6])	119.7120	0.000	1	119.8943	0.114	11	119.6436	0.532	279	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](N[6]C[6]Sn)(C[6]N[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Sn)(C[6]N[6]H)(H){2|C<3>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Sn<4>,1|C<3>,1|N<3>}	H(C[6]C[6]N[6])	120.1213	0.273	3	119.8943	0.114	11	119.6436	0.532	279	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](N[6]C[6]Sn)(C[6]N[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Sn)(C[6]N[6]H)(H){2|C<3>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Sn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	120.0730	0.242	4	119.8943	0.114	11	119.6436	0.532	279	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](N[6]C[6]Sn)(C[6]N[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Sn)(C[6]N[6]H)(H){2|C<3>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Sn<7>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.4897	0.064	3	119.8943	0.114	11	119.6436	0.532	279	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]N[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Zn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.1610	0.059	2	119.8320	1.217	25	119.6436	0.532	279	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]N[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Zn<4>,1|C<3>,1|N<3>}	H(C[6]C[6]N[6])	119.8010	0.000	1	119.8320	1.217	25	119.6436	0.532	279	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]N[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Zn<4>,2|C<3>}	H(C[6]C[6]N[6])	119.9802	1.344	6	119.8320	1.217	25	119.6436	0.532	279	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]N[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Zn<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	122.3520	0.938	2	119.8320	1.217	25	119.6436	0.532	279	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]N[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Zn<6>,1|C<3>,1|N<2>}	H(C[6]C[6]N[6])	119.1960	0.000	1	119.8320	1.217	25	119.6436	0.532	279	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]N[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]N[6]H)(H){2|C<3>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Zn<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.5190	0.000	1	119.8320	1.217	25	119.6436	0.532	279	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]N[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]N[6]H)(H){2|C<3>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Zn<6>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	119.5605	0.387	2	119.8320	1.217	25	119.6436	0.532	279	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]N[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6])(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]N[6]H)(H){2|C<3>}	C[6](C[6]N[6]H)(N[6]C[6])(H){1|Zn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.5255	0.653	10	119.8320	1.217	25	119.6436	0.532	279	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:I-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]N[6]I)(H)	C[6](C[6]N[6]H)(N[6]C[6])(I)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]N[6]I)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6])(I){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.0040	0.000	1	119.0040	0.000	1	119.3050	0.181	2	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:I-1:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]N[6]I)(H)	C[6](C[6]N[6]H)(N[6]C[6])(I)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]N[6]I)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6])(I){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.6060	0.000	1	119.6060	0.000	1	119.3050	0.181	2	120.4185	6.827	1566	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:2:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:S[6]-2:N-2:	C[6]-3:	C[6](C[5,6]C[5,6]C[5])(C[6]S[6]N)(H)	C[6](C[6]C[5,6]H)(S[6]C[6])(NC[6a])	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5])(C[6]S[6]N)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]H)(S[6]C[6])(NC[6a]){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[5,6]C[6])	117.5225	0.187	2	117.6707	0.069	4	117.6707	0.069	4	120.4550	3.600	84	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:2:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:S[6]-2:N-2:	C[6]-3:	C[6](C[5,6]C[5,6]C[5])(C[6]S[6]N)(H)	C[6](C[6]C[5,6]H)(S[6]C[6])(NC[6a])	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5])(C[6]S[6]N)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]H)(S[6]C[6])(NC[6a]){1|C<3>,2|C<4>}	H(C[6]C[5,6]C[6])	117.8190	0.291	2	117.6707	0.069	4	117.6707	0.069	4	120.4550	3.600	84	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:2:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:O-2:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]N[6]O)(H)	C[6](C[6]C[6,6]H)(N[6]C[6])(OC)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]N[6]O)(H){1|B<4>,1|C<2>,2|C<3>}	C[6](C[6]C[6,6]H)(N[6]C[6])(OC){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6,6]C[6])	120.4090	0.105	3	120.3840	0.010	4	120.3840	0.010	4	120.4550	3.600	84	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:2:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:O-2:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]N[6]O)(H)	C[6](C[6]C[6,6]H)(N[6]C[6])(OC)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]N[6]O)(H){1|B<4>,3|C<3>}	C[6](C[6]C[6,6]H)(N[6]C[6])(OC){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6,6]C[6])	120.3090	0.000	1	120.3840	0.010	4	120.3840	0.010	4	120.4550	3.600	84	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:C-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6])(CC)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|C<4>}	C[6](C[6]C[6]H)(C[6]C[6])(CC){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7710	0.000	1	121.6985	7.431	2	121.1100	4.754	3	120.4550	3.600	84	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:C-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6])(CC)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Cl<1>,1|C<3>}	C[6](C[6]C[6]H)(C[6]C[6])(CC){1|C<3>,2|H<1>}	H(C[6]C[6]2)	123.6260	0.000	1	121.6985	7.431	2	121.1100	4.754	3	120.4550	3.600	84	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:C-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6])(CH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6])(CH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9330	0.000	1	119.9330	0.000	1	121.1100	4.754	3	120.4550	3.600	84	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]C[6])(NC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6])(NC){1|C<3>,2|H<1>}	H(C[6]C[6]2)	124.5260	0.000	1	124.5260	0.000	1	120.7220	28.941	2	120.4550	3.600	84	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]C[6])(NN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|C<4>}	C[6](C[6]C[6]H)(C[6]C[6])(NN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	116.9180	0.000	1	116.9180	0.000	1	120.7220	28.941	2	120.4550	3.600	84	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6])(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6])(OC){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2395	0.243	2	119.5002	1.785	4	118.3289	11.666	7	120.4550	3.600	84	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6])(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){2|C<3>}	C[6](C[6]C[6]H)(C[6]C[6])(OC){1|C<3>,2|H<1>}	H(C[6]C[6]2)	118.7610	1.764	2	119.5002	1.785	4	118.3289	11.666	7	120.4550	3.600	84	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6])(OP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6])(OP){1|C<3>,2|H<1>}	H(C[6]C[6]2)	110.9960	0.000	1	110.9960	0.000	1	118.3289	11.666	7	120.4550	3.600	84	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6])(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<4>,1|N<2>}	C[6](C[6]C[6]H)(C[6]N[6])(OC){1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6210	0.000	1	120.6210	0.000	1	118.3289	11.666	7	120.4550	3.600	84	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:O-2:	C[6]-3:	C[6](C[6]C[6]N)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6])(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]C[6]O)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6])(OC){1|C<3>,1|H<1>,1|N<4>}	H(C[6]C[6]2)	118.6840	0.000	1	118.6840	0.000	1	118.3289	11.666	7	120.4550	3.600	84	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:C-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6])(CC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<2>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6])(CC){1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.0010	0.000	1	121.0010	0.000	1	121.0010	0.000	1	120.4550	3.600	84	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)(N[6]N[6])(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Cl<1>,1|N<3>}	C[6](C[6]C[6]H)(N[6]N[6])(OC){1|Re<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	122.3550	0.000	1	121.7265	0.790	2	121.5417	0.742	38	120.4550	3.600	84	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)(N[6]N[6])(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){2|N<3>}	C[6](C[6]C[6]H)(N[6]N[6])(OC){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.0980	0.000	1	121.7265	0.790	2	121.5417	0.742	38	120.4550	3.600	84	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)(N[6]N[6])(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|C<3>,1|N<3>}	C[6](C[6]C[6]H)(N[6]N[6])(OH){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1550	0.000	1	120.1550	0.000	1	121.5417	0.742	38	120.4550	3.600	84	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:O-2:	C[6]-3:	C[6](C[6]N[6]C)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)(N[6]C[6])(OC)	H(C[6]C[6]2)	C[6](C[6]N[6]C)(C[6]N[6]O)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6])(OC){1|C<4>,2|N<3>}	H(C[6]C[6]2)	121.2240	0.409	6	121.2443	0.142	7	121.5417	0.742	38	120.4550	3.600	84	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:O-2:	C[6]-3:	C[6](C[6]N[6]C)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)(N[6]C[6])(OC)	H(C[6]C[6]2)	C[6](C[6]N[6]C)(C[6]N[6]O)(H){1|Mn<9>,1|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(OC){1|C<4>,2|N<3>}	H(C[6]C[6]2)	121.3660	0.000	1	121.2443	0.142	7	121.5417	0.742	38	120.4550	3.600	84	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:O-2:	C[6]-3:	C[6](C[6]N[6]C)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)(N[6]C[6])(OH)	H(C[6]C[6]2)	C[6](C[6]N[6]C)(C[6]N[6]O)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6])(OH){1|C<4>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	120.8490	0.000	1	120.7790	0.004	3	121.5417	0.742	38	120.4550	3.600	84	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:O-2:	C[6]-3:	C[6](C[6]N[6]C)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)(N[6]C[6])(OH)	H(C[6]C[6]2)	C[6](C[6]N[6]C)(C[6]N[6]O)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6])(OH){1|C<4>,2|N<3>}	H(C[6]C[6]2)	120.7440	0.008	2	120.7790	0.004	3	121.5417	0.742	38	120.4550	3.600	84	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:O-2:	C[6]-3:	C[6](C[6]N[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)(N[6]C[6])(OH)	H(C[6]C[6]2)	C[6](C[6]N[6]H)(C[6]N[6]O)(H){1|Pd<4>,1|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(OH){1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	120.6590	0.000	1	120.6590	0.000	1	121.5417	0.742	38	120.4550	3.600	84	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:O-2:	C[6]-3:	C[6](C[6]N[6]O)(C[6]O[6]C)(H)	C[6](C[6]C[6]H)(N[6]S[6])(OH)	H(C[6]C[6]2)	C[6](C[6]N[6]O)(C[6]O[6]C)(H){1|S<4>}	C[6](C[6]C[6]H)(N[6]S[6])(OH){1|C<4>,1|O<2>,2|O<1>}	H(C[6]C[6]2)	119.2280	0.000	1	119.2280	0.000	1	121.5417	0.742	38	120.4550	3.600	84	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:O-2:	C[6]-3:	C[6](C[6]N[6]O)(C[6]O[6]C)(H)	C[6](C[6]C[6]H)(N[6]S[6])(ONi)	H(C[6]C[6]2)	C[6](C[6]N[6]O)(C[6]O[6]C)(H){1|S<4>}	C[6](C[6]C[6]H)(N[6]S[6])(ONi){1|C<4>,1|O<2>,2|O<1>}	H(C[6]C[6]2)	118.5810	0.000	1	118.5810	0.000	1	121.5417	0.742	38	120.4550	3.600	84	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:O-2:	C[6]-3:	C[6](C[6]N[6]O)2(H)	C[6](C[6]C[6]H)(N[6]C[6])(OC)	H(C[6]C[6]2)	C[6](C[6]N[6]O)2(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6])(OC){1|N<3>,1|O<2>,1|S<2>}	H(C[6]C[6]2)	122.2380	0.000	1	122.0664	0.024	22	121.5417	0.742	38	120.4550	3.600	84	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:O-2:	C[6]-3:	C[6](C[6]N[6]O)2(H)	C[6](C[6]C[6]H)(N[6]C[6])(OC)	H(C[6]C[6]2)	C[6](C[6]N[6]O)2(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6])(OC){1|O<2>,2|N<3>}	H(C[6]C[6]2)	122.0582	0.152	21	122.0664	0.024	22	121.5417	0.742	38	120.4550	3.600	84	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]O[6]O)(H)	C[6](C[6]C[6]H)(O[6]C[6])(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]O[6]O)(H){1|B<4>,1|C<3>}	C[6](C[6]C[6]H)(O[6]C[6])(OC){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	121.4790	0.000	1	121.1548	0.695	4	120.7960	0.732	6	120.4550	3.600	84	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]O[6]O)(H)	C[6](C[6]C[6]H)(O[6]C[6])(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]O[6]O)(H){1|B<4>,1|C<3>}	C[6](C[6]C[6]H)(O[6]C[6])(OC){1|H<1>,2|C<3>}	H(C[6]C[6]2)	121.6080	0.231	2	121.1548	0.695	4	120.7960	0.732	6	120.4550	3.600	84	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]O[6]O)(H)	C[6](C[6]C[6]H)(O[6]C[6])(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]O[6]O)(H){2|C<3>}	C[6](C[6]C[6]H)(O[6]C[6])(OC){1|Cr<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9240	0.000	1	121.1548	0.695	4	120.7960	0.732	6	120.4550	3.600	84	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:O-2:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]O[6]O)(H)	C[6](C[6]C[6]H)(O[6]C[6])(OC)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]O[6]O)(H){1|In<4>,3|C<3>}	C[6](C[6]C[6]H)(O[6]C[6])(OC){3|C<3>}	H(C[6]C[6]2)	120.2000	0.000	1	120.2000	0.000	1	120.7960	0.732	6	120.4550	3.600	84	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:O-2:	C[6]-3:	C[6](C[6]C[6a]O[6])(C[6]O[6]O)(H)	C[6](C[6]C[6]H)(O[6]B[6])(OC)	H(C[6]C[6]2)	C[6](C[6]C[6a]O[6])(C[6]O[6]O)(H){1|B<4>,2|C<3>}	C[6](C[6]C[6]H)(O[6]B[6])(OC){1|C<3>,1|O<2>,2|F<1>}	H(C[6]C[6]2)	119.9570	0.000	1	119.9570	0.000	1	120.7960	0.732	6	120.4550	3.600	84	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:S-2:	C[6]-3:	C[6](C[6]C[6a]O[6])(C[6]O[6]S)(H)	C[6](C[6]C[6]H)(O[6]B[6])(SC)	H(C[6]C[6]2)	C[6](C[6]C[6a]O[6])(C[6]O[6]S)(H){1|B<4>,2|C<3>}	C[6](C[6]C[6]H)(O[6]B[6])(SC){1|C<3>,1|O<2>,2|F<1>}	H(C[6]C[6]2)	120.4040	0.000	1	120.4040	0.000	1	120.4040	0.000	1	120.4550	3.600	84	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:P[6]-2:O-2:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]P[6]O)(H)	C[6](C[6]C[6]H)(P[6]C[6])(OSn)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]P[6]O)(H){1|H<1>,3|C<3>}	C[6](C[6]C[6]H)(P[6]C[6])(OSn){3|C<3>}	H(C[6]C[6]2)	117.7650	0.000	1	117.7650	0.000	1	117.7650	0.000	1	120.4550	3.600	84	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:S[6]-2:S-2:	C[6]-3:	C[6](C[6]S[6]S)2(H)	C[6](C[6]C[6]H)(S[6]C[6])(SC)	H(C[6]C[6]2)	C[6](C[6]S[6]S)2(H){1|C<4>}	C[6](C[6]C[6]H)(S[6]C[6])(SC){1|C<3>,1|O<2>,2|S<2>}	H(C[6]C[6]2)	116.5620	0.000	1	116.5620	0.000	1	116.5165	0.004	2	120.4550	3.600	84	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:S[6]-2:S-2:	C[6]-3:	C[6](C[6]S[6]S)2(H)	C[6](C[6]C[6]H)(S[6]C[6])(SCr)	H(C[6]C[6]2)	C[6](C[6]S[6]S)2(H){1|C<4>}	C[6](C[6]C[6]H)(S[6]C[6])(SCr){1|C<3>,1|O<2>,2|S<2>}	H(C[6]C[6]2)	116.4710	0.000	1	116.4710	0.000	1	116.5165	0.004	2	120.4550	3.600	84	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:2:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:C-2:	C[6]-3:	C[6](N[6]C[6]Ag)(C[6]N[6]C)(H)	C[6](C[6]N[6]H)(N[6]C[6])(CN)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ag)(C[6]N[6]C)(H){2|C<3>}	C[6](C[6]N[6]H)(N[6]C[6])(CN){1|Ag<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.6550	0.211	2	119.6550	0.044	2	119.6550	0.044	2	120.4550	3.600	84	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:2:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:N-2:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]N[6]N)(H)	C[6](C[6]N[6]H)(N[6]C[6])(NC)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]N[6]N)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6])(NC){1|Cu<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.1900	0.000	1	119.1900	0.000	1	119.1563	0.037	3	120.4550	3.600	84	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:2:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:N-2:	C[6]-3:	C[6](N[6]C[6]Mn)(C[6]N[6]N)(H)	C[6](C[6]N[6]H)(N[6]C[6])(NC)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mn)(C[6]N[6]N)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6])(NC){1|Mn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.3290	0.000	1	119.3290	0.000	1	119.1563	0.037	3	120.4550	3.600	84	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:2:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:N-2:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]N[6]N)(H)	C[6](C[6]N[6]H)(N[6]C[6])(NC)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]N[6]N)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6])(NC){1|Zn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.9500	0.000	1	118.9500	0.000	1	119.1563	0.037	3	120.4550	3.600	84	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:2:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:O-2:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]N[6]O)(H)	C[6](C[6]N[6]H)(N[6]C[6])(OC)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]N[6]O)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6])(OC){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.6200	0.000	1	119.6200	0.000	1	120.2417	0.189	8	120.4550	3.600	84	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:2:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:O-2:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]N[6]O)(H)	C[6](C[6]N[6]H)(N[6]C[6])(OC[6a])	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]N[6]O)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6])(OC[6a]){1|Cu<5>,1|C<3>,1|O<2>}	H(C[6]C[6]N[6])	120.4530	0.223	6	120.4530	0.050	6	120.2417	0.189	8	120.4550	3.600	84	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:2:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:O-2:	C[6]-3:	C[6](N[6]C[6]Mn)(C[6]N[6]O)(H)	C[6](C[6]N[6]H)(N[6]C[6])(OC)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mn)(C[6]N[6]O)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6])(OC){1|Mn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.5960	0.000	1	119.5960	0.000	1	120.2417	0.189	8	120.4550	3.600	84	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:2:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:S-2:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]N[6]S)(H)	C[6](C[6]N[6]H)(N[6]C[6])(SC)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]N[6]S)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6])(SC){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.1650	0.000	1	119.1650	0.000	1	119.3240	0.051	2	120.4550	3.600	84	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:2:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:S-2:	C[6]-3:	C[6](N[6]C[6]Fe)(C[6]N[6]S)(H)	C[6](C[6]N[6]H)(N[6]C[6])(SC[6a])	H(C[6]C[6]N[6])	C[6](N[6]C[6]Fe)(C[6]N[6]S)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6])(SC[6a]){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.4830	0.000	1	119.4830	0.000	1	119.3240	0.051	2	120.4550	3.600	84	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:3:	3:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:C-3:	C[6]-3:	C[6](C[5a,6]N[5a,6]C[5a])(C[6]N[6]C)(H)	C[6](C[6]C[5a,6]H)(N[6]C[6])(COO)	H(C[6]C[5a,6]C[6])	C[6](C[5a,6]N[5a,6]C[5a])(C[6]N[6]C)(H){1|C<4>,1|H<1>,2|C<3>}	C[6](C[6]C[5a,6]H)(N[6]C[6])(COO){1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[5a,6]C[6])	120.5405	0.084	2	120.5405	0.007	2	120.5405	0.007	2	119.8146	4.733	183	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:N-3:	C[6]-3:	C[6](C[6,6]C[6,6]O[6])(C[6]C[6]N)(H)	C[6](C[6]C[6,6]H)(C[6]C[6])(NCC)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]O[6])(C[6]C[6]N)(H){3|C<3>}	C[6](C[6]C[6,6]H)(C[6]C[6])(NCC){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6,6]C[6])	124.8090	0.000	1	124.8090	0.000	1	124.8090	0.000	1	119.8146	4.733	183	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:N-3:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]N[6]N)(H)	C[6](C[6]C[6,6]H)(N[6]C[6])(NCC)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]N[6]N)(H){1|B<4>,1|C<2>,2|C<3>}	C[6](C[6]C[6,6]H)(N[6]C[6])(NCC){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6,6]C[6])	120.0530	0.000	1	119.9350	0.028	2	119.9077	0.016	3	119.8146	4.733	183	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:N-3:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]N[6]N)(H)	C[6](C[6]C[6,6]H)(N[6]C[6])(NCC)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]N[6]N)(H){1|B<4>,3|C<3>}	C[6](C[6]C[6,6]H)(N[6]C[6])(NCC){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6,6]C[6])	119.8170	0.000	1	119.9350	0.028	2	119.9077	0.016	3	119.8146	4.733	183	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:N-3:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]N[6]N)(H)	C[6](C[6]C[6,6]H)(N[6]C[6])(NC[6a]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]N[6]N)(H){1|B<4>,1|C<2>,2|C<3>}	C[6](C[6]C[6,6]H)(N[6]C[6])(NC[6a]H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6,6]C[6])	119.8530	0.000	1	119.8530	0.000	1	119.9077	0.016	3	119.8146	4.733	183	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:C-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]O[6]C)(H)	C[6](C[6]C[6,6]H)(O[6]C[6])(CCH)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]O[6]C)(H){1|Cl<1>,1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[6,6]H)(O[6]C[6])(CCH){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6,6]C[6])	118.7850	0.453	4	118.7428	0.129	6	118.7428	0.129	6	119.8146	4.733	183	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:C-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]O[6]C)(H)	C[6](C[6]C[6,6]H)(O[6]C[6])(CCH)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]O[6]C)(H){1|H<1>,3|C<3>}	C[6](C[6]C[6,6]H)(O[6]C[6])(CCH){1|H<1>,2|C<3>}	H(C[6]C[6,6]C[6])	118.6585	0.080	2	118.7428	0.129	6	118.7428	0.129	6	119.8146	4.733	183	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:O[6]-2:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]O[6])2(H)	C[6](C[5a]C[5a]N[5a])(O[6]B[5a,6])(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]O[6])2(H){1|B<4>,2|C<3>,2|N<3>}	C[6](C[5a]C[5a]N[5a])(O[6]B[5a,6])(C[6]C[6]H){1|C<4>,1|H<1>,3|C<3>,3|O<2>}	H(C[6]C[6]2)	119.9861	0.245	12	119.9556	0.098	20	119.9556	0.098	20	119.8146	4.733	183	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:O[6]-2:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]O[6])2(H)	C[6](C[5a]C[5a]N[5a])(O[6]B[5a,6])(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]O[6])2(H){1|B<4>,2|C<3>,2|N<3>}	C[6](C[5a]C[5a]N[5a])(O[6]B[5a,6])(C[6]C[6]H){2|H<1>,3|C<3>,3|O<2>}	H(C[6]C[6]2)	119.9100	0.409	8	119.9556	0.098	20	119.9556	0.098	20	119.8146	4.733	183	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6])(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|C<4>}	C[6](C[6]C[6]H)(C[6]C[6])(CCH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	122.0480	0.000	1	122.0480	0.000	1	119.9131	21.226	16	119.8146	4.733	183	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6])(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<2>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6])(CCN){1|C<3>,1|H<1>}	H(C[6]C[6]2)	128.4270	0.000	1	123.1346	15.205	5	119.9131	21.226	16	119.8146	4.733	183	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6])(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6])(CCN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	121.8115	2.933	4	123.1346	15.205	5	119.9131	21.226	16	119.8146	4.733	183	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6])(CCO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6])(CCO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	117.8240	0.000	1	117.8240	0.000	1	119.9131	21.226	16	119.8146	4.733	183	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6])(CC[5a]2)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6])(CC[5a]2){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.4780	0.000	1	119.4780	0.000	1	119.9131	21.226	16	119.8146	4.733	183	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6])(CC[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6])(CC[6]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	117.5740	0.000	1	117.5740	0.000	1	119.9131	21.226	16	119.8146	4.733	183	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6])(CC[6a]C)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<2>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6])(CC[6a]C){1|C<3>,1|H<1>}	H(C[6]C[6]2)	113.9450	0.000	1	113.9450	0.000	1	119.9131	21.226	16	119.8146	4.733	183	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6])(CC[6a]N)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6])(CC[6a]N){1|C<3>,2|H<1>}	H(C[6]C[6]2)	116.1167	1.859	3	116.1167	3.457	3	119.9131	21.226	16	119.8146	4.733	183	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6])(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ag<3>,1|C<3>}	C[6](C[6]C[6]H)(C[6]C[6])(CNO){1|N<3>,2|H<1>}	H(C[6]C[6]2)	129.3750	0.000	1	129.3750	0.000	1	119.9131	21.226	16	119.8146	4.733	183	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6])(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>}	C[6](C[6]C[6]H)(C[6]C[6])(COO){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	116.5520	0.000	1	116.5520	0.000	1	119.9131	21.226	16	119.8146	4.733	183	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:C-3:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(C[6]C[6])(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6])(COO){1|N<3>,2|C<3>}	H(C[6]C[6]2)	117.7900	0.000	1	117.7900	0.000	1	119.9131	21.226	16	119.8146	4.733	183	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:N-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]C[6])(NOO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]N)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6])(NOO){3|C<3>}	H(C[6]C[6]2)	120.6240	0.000	1	120.6240	0.000	1	118.6915	10.507	11	119.8146	4.733	183	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]C[6])(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<2>,1|C<3>}	C[6](C[6]C[6]H)(C[6]C[6])(NCC){1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.4510	0.000	1	121.4510	0.000	1	118.6915	10.507	11	119.8146	4.733	183	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]C[6])(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6])(NCH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.1160	0.000	1	119.1160	0.000	1	118.6915	10.507	11	119.8146	4.733	183	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]C[6])(NC[6]Cu)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6])(NC[6]Cu){1|C<3>,2|H<1>}	H(C[6]C[6]2)	118.9560	0.000	1	118.9560	0.000	1	118.6915	10.507	11	119.8146	4.733	183	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]C[6])(NC[6a]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|C<4>}	C[6](C[6]C[6]H)(C[6]C[6])(NC[6a]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	112.2100	0.000	1	112.2100	0.000	1	118.6915	10.507	11	119.8146	4.733	183	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]C[6])(NOO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<2>,1|C<3>}	C[6](C[6]C[6]H)(C[6]C[6])(NOO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	117.8540	0.000	1	118.2875	0.376	2	118.6915	10.507	11	119.8146	4.733	183	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]C[6])(NOO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|C<4>}	C[6](C[6]C[6]H)(C[6]C[6])(NOO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	118.7210	0.000	1	118.2875	0.376	2	118.6915	10.507	11	119.8146	4.733	183	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]C[6])(NPdC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6])(NPdC){1|C<3>,2|H<1>}	H(C[6]C[6]2)	113.8720	0.000	1	116.2830	11.626	2	118.6915	10.507	11	119.8146	4.733	183	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]C[6])(NPdC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6])(NPdC){1|C<3>,2|H<1>}	H(C[6]C[6]2)	118.6940	0.000	1	116.2830	11.626	2	118.6915	10.507	11	119.8146	4.733	183	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:N-3:	C[6]-3:	C[6](C[6]C[6]N)2(H)	C[6](C[6]C[6]H)(C[6]C[6])(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]N)2(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6])(NCH){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4880	0.000	1	120.4880	0.000	1	118.6915	10.507	11	119.8146	4.733	183	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:N-3:	C[6]-3:	C[6](C[6]C[6]N)2(H)	C[6](C[6]C[6]H)(C[6]C[6])(NOO)	H(C[6]C[6]2)	C[6](C[6]C[6]N)2(H){1|C<3>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6])(NOO){1|C<3>,2|N<3>}	H(C[6]C[6]2)	123.6210	0.000	1	123.6210	0.000	1	118.6915	10.507	11	119.8146	4.733	183	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:S-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]S)(H)	C[6](C[6]C[6]H)(C[6]C[6])(SCO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]S)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6])(SCO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	121.3690	0.000	1	121.3690	0.000	1	121.3690	0.000	1	119.8146	4.733	183	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]N[6])(CN[6]O)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){2|N<3>}	C[6](C[6]C[6]H)(N[6]N[6])(CN[6]O){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.0220	0.000	1	120.0220	0.000	1	120.3849	3.502	19	119.8146	4.733	183	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6])(CHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6])(CHH){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.6920	3.673	2	120.6920	13.489	2	120.3849	3.502	19	119.8146	4.733	183	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6])(CHO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6])(CHO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	116.4530	3.000	2	116.4530	8.997	2	120.3849	3.502	19	119.8146	4.733	183	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]N[6])(CNN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|N<3>}	C[6](C[6]C[6]H)(N[6]N[6])(CNN){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.9917	0.231	3	120.9917	0.054	3	120.3849	3.502	19	119.8146	4.733	183	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]N[6])(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|N<3>}	C[6](C[6]C[6]H)(N[6]N[6])(COO){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.8265	0.250	2	120.8265	0.062	2	120.3849	3.502	19	119.8146	4.733	183	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:C-3:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6])(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]C)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6])(COO){1|O<1>,2|C<3>}	H(C[6]C[6]2)	119.8785	0.070	2	119.8785	0.005	2	120.3849	3.502	19	119.8146	4.733	183	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:C-3:	C[6]-3:	C[6](C[6]N[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6])(CCH)	H(C[6]C[6]2)	C[6](C[6]N[6]C)(C[6]N[6]H)(H){1|Ti<10>,1|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(CCH){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8005	0.220	2	120.8005	0.048	2	120.3849	3.502	19	119.8146	4.733	183	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:C-3:	C[6]-3:	C[6](C[6]N[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6])(COO)	H(C[6]C[6]2)	C[6](C[6]N[6]C)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(COO){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.4650	0.089	2	121.4650	0.008	2	120.3849	3.502	19	119.8146	4.733	183	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:C-3:	C[6]-3:	C[6](C[6]N[6]C)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)(N[6]C[6])(COO)	H(C[6]C[6]2)	C[6](C[6]N[6]C)(C[6]N[6]O)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6])(COO){1|N<3>,2|O<1>}	H(C[6]C[6]2)	120.4550	0.000	1	120.4550	0.000	1	120.3849	3.502	19	119.8146	4.733	183	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:C-3:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](C[6]C[6]H)(N[6]C[6])(CHH)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(CHH){1|C<4>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	122.2050	0.000	1	122.2050	0.000	1	120.3849	3.502	19	119.8146	4.733	183	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:C-3:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](C[6]C[6]H)(N[6]C[6])(COO)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Mg<6>,1|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(COO){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.4260	0.000	1	121.4260	0.000	1	120.3849	3.502	19	119.8146	4.733	183	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6])(NC[6a]C)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6])(NC[6a]C){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6320	0.000	1	120.6320	0.000	1	120.7034	4.811	26	119.8146	4.733	183	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:N-3:	C[6]-3:	C[6](C[6]N[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6])(NHH)	H(C[6]C[6]2)	C[6](C[6]N[6]H)(C[6]N[6]N)(H){1|C<3>,1|C<4>}	C[6](C[6]C[6]H)(N[6]C[6])(NHH){1|H<1>,2|N<3>}	H(C[6]C[6]2)	122.0370	0.288	2	120.0775	9.576	12	120.7034	4.811	26	119.8146	4.733	183	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:N-3:	C[6]-3:	C[6](C[6]N[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6])(NHH)	H(C[6]C[6]2)	C[6](C[6]N[6]H)(C[6]N[6]N)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6])(NHH){1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.9497	0.186	3	120.0775	9.576	12	120.7034	4.811	26	119.8146	4.733	183	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:N-3:	C[6]-3:	C[6](C[6]N[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6])(NHH)	H(C[6]C[6]2)	C[6](C[6]N[6]H)(C[6]N[6]N)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6])(NHH){1|H<1>,2|N<3>}	H(C[6]C[6]2)	119.1439	3.854	7	120.0775	9.576	12	120.7034	4.811	26	119.8146	4.733	183	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:N-3:	C[6]-3:	C[6](C[6]N[6]N)2(H)	C[6](C[6]C[6]H)(N[6]C[6])(NCN)	H(C[6]C[6]2)	C[6](C[6]N[6]N)2(H){1|Mn<5>,1|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(NCN){1|H<1>,2|N<3>}	H(C[6]C[6]2)	121.6780	0.000	1	121.6780	0.000	1	120.7034	4.811	26	119.8146	4.733	183	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:N-3:	C[6]-3:	C[6](C[6]N[6]N)2(H)	C[6](C[6]C[6]H)(N[6]C[6])(NC[6a]H)	H(C[6]C[6]2)	C[6](C[6]N[6]N)2(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6])(NC[6a]H){1|C<4>,2|N<3>}	H(C[6]C[6]2)	121.3340	0.000	1	121.3340	0.000	1	120.7034	4.811	26	119.8146	4.733	183	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:N-3:	C[6]-3:	C[6](C[6]N[6]N)2(H)	C[6](C[6]C[6]H)(N[6]C[6])(NHH)	H(C[6]C[6]2)	C[6](C[6]N[6]N)2(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6])(NHH){1|N<2>,2|N<3>}	H(C[6]C[6]2)	120.8750	0.000	2	121.2468	0.563	11	120.7034	4.811	26	119.8146	4.733	183	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:N-3:	C[6]-3:	C[6](C[6]N[6]N)2(H)	C[6](C[6]C[6]H)(N[6]C[6])(NHH)	H(C[6]C[6]2)	C[6](C[6]N[6]N)2(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6])(NHH){1|S<1>,2|N<3>}	H(C[6]C[6]2)	121.9020	0.983	4	121.2468	0.563	11	120.7034	4.811	26	119.8146	4.733	183	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:N-3:	C[6]-3:	C[6](C[6]N[6]N)2(H)	C[6](C[6]C[6]H)(N[6]C[6])(NHH)	H(C[6]C[6]2)	C[6](C[6]N[6]N)2(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6])(NHH){3|N<3>}	H(C[6]C[6]2)	120.8895	0.093	4	121.2468	0.563	11	120.7034	4.811	26	119.8146	4.733	183	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:N-3:	C[6]-3:	C[6](C[6]N[6]N)2(H)	C[6](C[6]C[6]H)(N[6]C[6])(NHH)	H(C[6]C[6]2)	C[6](C[6]N[6]N)2(H){1|Ru<7>,1|C<4>}	C[6](C[6]C[6]H)(N[6]C[6])(NHH){1|Ru<7>,1|S<2>,2|N<3>}	H(C[6]C[6]2)	120.7990	0.000	1	121.2468	0.563	11	120.7034	4.811	26	119.8146	4.733	183	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]O[6]C)(H)	C[6](C[6]C[6]H)(O[6]C[6])(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]O[6]C)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(O[6]C[6])(CCH){1|C<4>,2|C<3>}	H(C[6]C[6]2)	119.3440	0.000	1	119.3456	0.035	7	119.4651	0.050	11	119.8146	4.733	183	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]O[6]C)(H)	C[6](C[6]C[6]H)(O[6]C[6])(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]O[6]C)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(O[6]C[6])(CCH){3|C<3>}	H(C[6]C[6]2)	119.3458	0.205	6	119.3456	0.035	7	119.4651	0.050	11	119.8146	4.733	183	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:C-3:	C[6]-3:	C[6](C[6]C[6a]O[6])(C[6]O[6]C)(H)	C[6](C[6]C[6]H)(O[6]B[6])(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6a]O[6])(C[6]O[6]C)(H){1|B<4>,2|C<3>}	C[6](C[6]C[6]H)(O[6]B[6])(CCH){1|C<3>,1|O<2>,2|F<1>}	H(C[6]C[6]2)	119.5690	0.000	1	119.5690	0.000	1	119.4651	0.050	11	119.8146	4.733	183	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:C-3:	C[6]-3:	C[6](C[6]O[6]C)2(H)	C[6](C[6]C[6]H)(O[6]B[6])(CCH)	H(C[6]C[6]2)	C[6](C[6]O[6]C)2(H){1|B<4>}	C[6](C[6]C[6]H)(O[6]B[6])(CCH){1|C<3>,1|O<2>,2|F<1>}	H(C[6]C[6]2)	119.7093	0.027	3	119.7093	0.001	3	119.4651	0.050	11	119.8146	4.733	183	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-2:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[5,6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[5,6])(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[5,6]H)(H){1|Ru<10>,2|C<3>,2|C<4>}	C[6](C[6a]C[6a]2)(N[6]C[5,6])(C[6]C[6]H){1|Ru<10>,1|H<1>,2|C<3>,4|C<4>}	H(C[6]C[6]2)	119.3008	0.104	6	119.3008	0.011	6	119.4753	0.117	8	119.8146	4.733	183	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-2:C[6]-3:	C[6]-3:	C[6](C[6]N[5a,6]C[6a])(C[6]C[6a]N[6])(H)	C[6](C[6a]C[6a]2)(N[6]C[5a,6])(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[5a,6]C[6a])(C[6]C[6a]N[6])(H){1|N<2>,5|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[5a,6])(C[6]C[6]H){2|H<1>,2|N<3>,3|C<3>}	H(C[6]C[6]2)	119.9985	0.189	2	119.9985	0.036	2	119.4753	0.117	8	119.8146	4.733	183	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:O[6]-2:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]O[6])(C[6]C[6,6a]C)(H)	C[6](C[6a]C[6a]2)(O[6]C[6,6a])(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]O[6])(C[6]C[6,6a]C)(H){4|C<3>}	C[6](C[6a]C[6a]2)(O[6]C[6,6a])(C[6]C[6]H){1|C<4>,1|H<1>,1|O<2>,4|C<3>}	H(C[6]C[6]2)	119.1223	0.069	3	118.8839	0.116	7	118.7661	2.333	20	119.8146	4.733	183	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:O[6]-2:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]O[6])(C[6]C[6,6a]C)(H)	C[6](C[6a]C[6a]2)(O[6]C[6,6a])(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]O[6])(C[6]C[6,6a]C)(H){4|C<3>}	C[6](C[6a]C[6a]2)(O[6]C[6,6a])(C[6]C[6]H){1|C<4>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	118.9460	0.000	1	118.8839	0.116	7	118.7661	2.333	20	119.8146	4.733	183	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:O[6]-2:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]O[6])(C[6]C[6,6a]C)(H)	C[6](C[6a]C[6a]2)(O[6]C[6,6a])(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]O[6])(C[6]C[6,6a]C)(H){4|C<3>}	C[6](C[6a]C[6a]2)(O[6]C[6,6a])(C[6]C[6]H){1|H<1>,1|O<2>,5|C<3>}	H(C[6]C[6]2)	119.0790	0.000	1	118.8839	0.116	7	118.7661	2.333	20	119.8146	4.733	183	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:O[6]-2:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]O[6])(C[6]C[6,6a]C)(H)	C[6](C[6a]C[6a]2)(O[6]C[6,6a])(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]O[6])(C[6]C[6,6a]C)(H){4|C<3>}	C[6](C[6a]C[6a]2)(O[6]C[6,6a])(C[6]C[6]H){2|H<1>,5|C<3>}	H(C[6]C[6]2)	118.3975	0.013	2	118.8839	0.116	7	118.7661	2.333	20	119.8146	4.733	183	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:O[6]-2:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]O[6])(C[6]C[6,6a]O)(H)	C[6](C[6a]C[6a]2)(O[6]C[6,6a])(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]O[6])(C[6]C[6,6a]O)(H){4|C<3>}	C[6](C[6a]C[6a]2)(O[6]C[6,6a])(C[6]C[6]H){1|H<1>,2|O<2>,4|C<3>}	H(C[6]C[6]2)	119.5070	0.000	1	119.1465	0.260	2	118.7661	2.333	20	119.8146	4.733	183	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:O[6]-2:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]O[6])(C[6]C[6,6a]O)(H)	C[6](C[6a]C[6a]2)(O[6]C[6,6a])(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]O[6])(C[6]C[6,6a]O)(H){4|C<3>}	C[6](C[6a]C[6a]2)(O[6]C[6,6a])(C[6]C[6]H){1|O<2>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	118.7860	0.000	1	119.1465	0.260	2	118.7661	2.333	20	119.8146	4.733	183	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:O[6]-2:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]O[6])(C[6]N[5a,6]W)(H)	C[6](C[6a]C[6a]2)(O[6]C[5a,6])(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]O[6])(C[6]N[5a,6]W)(H){1|N<2>,3|C<3>}	C[6](C[6a]C[6a]2)(O[6]C[5a,6])(C[6]C[6]H){1|N<3>,1|W<6>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	117.4620	0.000	1	117.4620	0.000	1	118.7661	2.333	20	119.8146	4.733	183	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:O[6]-2:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]O[6])(C[6]N[6,6]O)(H)	C[6](C[6a]C[6a]2)(O[6]C[6,6])(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]O[6])(C[6]N[6,6]O)(H){2|C<3>,2|C<4>}	C[6](C[6a]C[6a]2)(O[6]C[6,6])(C[6]C[6]H){1|C<4>,1|N<3>,1|O<1>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	121.2395	1.471	2	121.2395	2.165	2	118.7661	2.333	20	119.8146	4.733	183	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:O[6]-2:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]O[6])2(H)	C[6](C[6a]C[6a]2)(O[6]B[5a,6])(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]O[6])2(H){1|B<4>,4|C<3>}	C[6](C[6a]C[6a]2)(O[6]B[5a,6])(C[6]C[6]H){2|H<1>,3|C<3>,3|O<2>}	H(C[6]C[6]2)	119.9090	2.745	2	119.9090	7.535	2	118.7661	2.333	20	119.8146	4.733	183	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:O[6]-2:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]O[6])2(H)	C[6](C[6a]C[6a]2)(O[6]Ga[3x6])(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]O[6])2(H){1|Ga<6>,4|C<3>}	C[6](C[6a]C[6a]2)(O[6]Ga[3x6])(C[6]C[6]H){1|H<1>,3|C<3>,6|O<2>}	H(C[6]C[6]2)	118.1400	0.535	2	118.2575	0.130	4	118.7661	2.333	20	119.8146	4.733	183	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:O[6]-2:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]O[6])2(H)	C[6](C[6a]C[6a]2)(O[6]Ga[3x6])(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]O[6])2(H){1|Ga<6>,4|C<3>}	C[6](C[6a]C[6a]2)(O[6]Ga[3x6])(C[6]C[6]H){2|H<1>,3|C<3>,5|O<2>}	H(C[6]C[6]2)	118.3750	0.221	2	118.2575	0.130	4	118.7661	2.333	20	119.8146	4.733	183	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:O[6]-2:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]O[6])2(H)	C[6](C[6a]C[6a]2)(O[6]In[4x6])(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]O[6])2(H){1|In<6>,4|C<3>}	C[6](C[6a]C[6a]2)(O[6]In[4x6])(C[6]C[6]H){1|Cl<1>,1|O<2>,2|H<1>,3|C<3>,3|N<3>}	H(C[6]C[6]2)	116.0265	0.541	2	116.0265	0.293	2	118.7661	2.333	20	119.8146	4.733	183	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:S[6]-2:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]S[6])(C[6]C[6,6a]N)(H)	C[6](C[6a]C[6a]2)(S[6]C[6,6a])(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]S[6])(C[6]C[6,6a]N)(H){4|C<3>}	C[6](C[6a]C[6a]2)(S[6]C[6,6a])(C[6]C[6]H){1|N<2>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	116.4310	0.000	1	116.4310	0.000	1	116.4310	0.000	1	119.8146	4.733	183	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:N[6]-2:C-3:	C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6]C)(H)	C[6](C[6]N[6]H)(N[6]C[6])(COO)	H(C[6]C[6]N[6])	C[6](C[6]N[6]C)(N[6]C[6]C)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6])(COO){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	120.6680	0.000	1	120.6680	0.000	1	120.9677	0.521	3	119.8146	4.733	183	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:N[6]-2:C-3:	C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6])(CCH)	H(C[6]C[6]N[6])	C[6](C[6]N[6]C)(N[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6])(CCH){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	120.4440	0.000	1	120.4440	0.000	1	120.9677	0.521	3	119.8146	4.733	183	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:N[6]-2:C-3:	C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6])(COO)	H(C[6]C[6]N[6])	C[6](C[6]N[6]C)(N[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6])(COO){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	121.7910	0.000	1	121.7910	0.000	1	120.9677	0.521	3	119.8146	4.733	183	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:N[6]-2:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(N[6]C[6,6a]C)(H)	C[6](C[6]C[6]N[6])(N[6]C[6,6a])(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]N[6])(N[6]C[6,6a]C)(H){1|N<2>,3|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6,6a])(C[6]N[6]H){1|C<4>,1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]N[6])	121.8623	1.314	4	122.4622	3.094	5	122.4622	3.094	5	119.8146	4.733	183	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:N[6]-2:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(N[6]C[6,6a]C)(H)	C[6](C[6]C[6]N[6])(N[6]C[6,6a])(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]N[6])(N[6]C[6,6a]C)(H){1|N<3>,3|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6,6a])(C[6]N[6]H){1|C<4>,1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]N[6])	124.8620	0.000	1	122.4622	3.094	5	122.4622	3.094	5	119.8146	4.733	183	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:N[6]-2:N-3:	C[6]-3:	C[6](C[6]N[6]N)(N[6]C[6]C)(H)	C[6](C[6]N[6]H)(N[6]C[6])(NHH)	H(C[6]C[6]N[6])	C[6](C[6]N[6]N)(N[6]C[6]C)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6])(NHH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	120.5623	0.157	3	120.5623	0.025	3	120.6662	0.033	5	119.8146	4.733	183	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:N[6]-2:N-3:	C[6]-3:	C[6](C[6]N[6]N)(N[6]C[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6])(NHH)	H(C[6]C[6]N[6])	C[6](C[6]N[6]N)(N[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6])(NHH){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	120.8220	0.057	2	120.8220	0.003	2	120.6662	0.033	5	119.8146	4.733	183	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:3:	3:	C[6]-3:N[6]-3:H-1:	C[6a]-3:N[6]-2:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(N[6]C[6,6a]Pt)(H)	C[6](C[6a]C[6a]N[6a])(N[6]C[6,6a])(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[6a]N[6])(N[6]C[6,6a]Pt)(H){1|N<2>,3|C<3>}	C[6](C[6a]C[6a]N[6a])(N[6]C[6,6a])(C[6]N[6]H){1|Pt<4>,1|H<1>,4|C<3>}	H(C[6]C[6]N[6])	118.8480	0.000	1	118.8480	0.000	1	118.8480	0.000	1	119.8146	4.733	183	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:C-3:	C[6]-3:	C[6](N[6]C[6]Au)(C[6]N[6]C)(H)	C[6](C[6]N[6]H)(N[6]C[6])(CNO)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Au)(C[6]N[6]C)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6])(CNO){1|Au<2>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.3990	0.000	1	119.3990	0.000	1	119.3817	0.665	15	119.8146	4.733	183	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:C-3:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]N[6]C)(H)	C[6](C[6]N[6]H)(N[6]C[6])(CCH)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]N[6]C)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6])(CCH){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8135	0.008	2	118.8135	0.000	2	119.3817	0.665	15	119.8146	4.733	183	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:C-3:	C[6]-3:	C[6](N[6]C[6]Hg)(C[6]N[6]C)(H)	C[6](C[6]N[6]H)(N[6]C[6])(COO)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Hg)(C[6]N[6]C)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6])(COO){1|Hg<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.5440	0.460	4	119.5440	0.211	4	119.3817	0.665	15	119.8146	4.733	183	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:C-3:	C[6]-3:	C[6](N[6]C[6]Mn)(C[6]N[6]C)(H)	C[6](C[6]N[6]H)(N[6]C[6])(CNO)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mn)(C[6]N[6]C)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6])(CNO){1|Mn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.3710	0.000	1	119.3710	0.000	1	119.3817	0.665	15	119.8146	4.733	183	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:C-3:	C[6]-3:	C[6](N[6]C[6]Sn)(C[6]N[6]C)(H)	C[6](C[6]N[6]H)(N[6]C[6])(CCN)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Sn)(C[6]N[6]C)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6])(CCN){1|Sn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.2310	0.000	1	119.2310	0.000	1	119.3817	0.665	15	119.8146	4.733	183	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:C-3:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]N[6]C)(H)	C[6](C[6]N[6]H)(N[6]C[6])(CNO)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]N[6]C)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6])(CNO){1|Zn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.4870	1.252	6	119.4870	1.568	6	119.3817	0.665	15	119.8146	4.733	183	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:N-3:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]N[6]N)(H)	C[6](C[6]N[6]H)(N[6]C[6])(NHH)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]N[6]N)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6])(NHH){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2424	1.646	5	118.2424	2.710	5	118.6563	1.626	9	119.8146	4.733	183	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:N-3:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]N[6]N)(H)	C[6](C[6]N[6]H)(N[6]C[6])(NCC)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]N[6]N)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6])(NCC){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.3490	0.000	1	119.3490	0.000	1	118.6563	1.626	9	119.8146	4.733	183	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:N-3:	C[6]-3:	C[6](N[6]C[6]Mn)(C[6]N[6]N)(H)	C[6](C[6]N[6]H)(N[6]C[6])(NHH)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mn)(C[6]N[6]N)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6])(NHH){1|Mn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.9345	0.002	2	118.9345	0.000	2	118.6563	1.626	9	119.8146	4.733	183	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:N-3:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]N[6]N)(H)	C[6](C[6]N[6]H)(N[6]C[6])(NHH)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]N[6]N)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6])(NHH){1|Zn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.4770	0.000	1	119.4770	0.000	1	118.6563	1.626	9	119.8146	4.733	183	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:C-4:	C[6]-3:	C[6](C[5,6]N[5,6]S[5])(C[6]O[6]C)(H)	C[6](C[6]C[5,6]H)(O[6]Nb[6])(CF3)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]S[5])(C[6]O[6]C)(H){1|Nb<6>,2|C<3>}	C[6](C[6]C[5,6]H)(O[6]Nb[6])(CF3){1|N<3>,1|S<2>,4|O<2>}	H(C[6]C[5,6]C[6])	118.7940	0.000	1	118.7940	0.000	1	118.7940	0.000	1	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:C-4:	C[6]-3:	C[6](C[6,6]C[6,6]N[6])(C[6]N[6]C)(H)	C[6](C[6]C[6,6]H)(N[6]C[6])(CH3)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]N[6])(C[6]N[6]C)(H){1|C<3>,2|C<4>}	C[6](C[6]C[6,6]H)(N[6]C[6])(CH3){1|C<3>,1|N<2>,1|O<1>}	H(C[6]C[6,6]C[6])	120.3260	0.000	1	120.3260	0.000	1	120.3260	0.000	1	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:C-4:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]O[6]C)(H)	C[6](C[6]C[6,6]H)(O[6]C[6])(CH3)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]O[6]C)(H){1|C<4>,1|H<1>,2|C<3>}	C[6](C[6]C[6,6]H)(O[6]C[6])(CH3){1|H<1>,2|C<3>}	H(C[6]C[6,6]C[6])	119.2060	0.000	1	119.0244	1.104	8	118.9506	0.717	26	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:C-4:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]O[6]C)(H)	C[6](C[6]C[6,6]H)(O[6]C[6])(CH3)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]O[6]C)(H){1|C<4>,1|O<1>,2|C<3>}	C[6](C[6]C[6,6]H)(O[6]C[6])(CH3){1|H<1>,1|O<2>,2|C<3>}	H(C[6]C[6,6]C[6])	120.4190	0.000	1	119.0244	1.104	8	118.9506	0.717	26	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:C-4:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]O[6]C)(H)	C[6](C[6]C[6,6]H)(O[6]C[6])(CH3)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]O[6]C)(H){1|C<4>,3|C<3>}	C[6](C[6]C[6,6]H)(O[6]C[6])(CH3){1|H<1>,2|C<3>}	H(C[6]C[6,6]C[6])	116.7630	0.000	1	119.0244	1.104	8	118.9506	0.717	26	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:C-4:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]O[6]C)(H)	C[6](C[6]C[6,6]H)(O[6]C[6])(CH3)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]O[6]C)(H){1|C<4>,3|C<3>}	C[6](C[6]C[6,6]H)(O[6]C[6])(CH3){3|C<3>}	H(C[6]C[6,6]C[6])	119.5650	0.000	1	119.0244	1.104	8	118.9506	0.717	26	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:C-4:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]O[6]C)(H)	C[6](C[6]C[6,6]H)(O[6]C[6])(CH3)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]O[6]C)(H){2|C<3>,2|C<4>}	C[6](C[6]C[6,6]H)(O[6]C[6])(CH3){1|H<1>,2|C<3>}	H(C[6]C[6,6]C[6])	119.0605	0.335	4	119.0244	1.104	8	118.9506	0.717	26	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:C-4:	C[6]-3:	C[6](C[6,6]C[6,6]O[6])(C[6]O[6]C)(H)	C[6](C[6]C[6,6]H)(O[6]C[6])(CH3)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]O[6])(C[6]O[6]C)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6,6]H)(O[6]C[6])(CH3){1|C<3>,1|O<2>,2|H<1>}	H(C[6]C[6,6]C[6])	121.0040	0.000	1	121.0040	0.000	1	118.9506	0.717	26	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:C-4:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]O[6]C)(H)	C[6](C[6]C[6,6]H)(O[6]B[3x6])(CH3)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]O[6]C)(H){1|B<4>,1|H<1>,2|C<3>}	C[6](C[6]C[6,6]H)(O[6]B[3x6])(CH3){1|C<3>,1|N<3>,2|C<4>}	H(C[6]C[6,6]C[6])	119.4440	0.000	1	119.4440	0.000	1	118.9506	0.717	26	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:C-4:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]O[6]C)(H)	C[6](C[6]C[6,6]H)(O[6]B[6])(CH3)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]O[6]C)(H){1|B<4>,1|H<1>,2|C<3>}	C[6](C[6]C[6,6]H)(O[6]B[6])(CH3){1|C<3>,1|N<3>,2|F<1>}	H(C[6]C[6,6]C[6])	118.8513	0.288	14	118.8807	0.090	15	118.9506	0.717	26	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:C-4:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]O[6]C)(H)	C[6](C[6]C[6,6]H)(O[6]B[6])(CH3)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]O[6]C)(H){1|B<4>,1|H<1>,2|C<3>}	C[6](C[6]C[6,6]H)(O[6]B[6])(CH3){1|N<3>,3|C<3>}	H(C[6]C[6,6]C[6])	119.2920	0.000	1	118.8807	0.090	15	118.9506	0.717	26	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:C-4:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]O[6]C)(H)	C[6](C[6]C[6,6]H)(O[6]Nb[6])(CF3)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]O[6]C)(H){1|Nb<6>,1|H<1>,2|C<3>}	C[6](C[6]C[6,6]H)(O[6]Nb[6])(CF3){1|C<3>,1|N<3>,4|O<2>}	H(C[6]C[6,6]C[6])	116.8620	0.000	1	116.8620	0.000	1	118.9506	0.717	26	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:S-4:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]S)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6])(SO3)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]S)(H){1|H<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6])(SO3){1|H<1>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.1020	0.000	1	120.1020	0.000	1	120.1020	0.000	1	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:C-4:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]O[6]C)(H)	C[6](C[6]C[6,6a]H)(O[6]C[6])(CC3)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]O[6]C)(H){1|H<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(O[6]C[6])(CC3){1|S<1>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.4150	0.017	2	119.4150	0.000	2	120.4181	3.899	9	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:C-4:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]O[6]C)(H)	C[6](C[6]C[6,6a]H)(O[6]C[6])(CCHH)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]O[6]C)(H){1|H<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(O[6]C[6])(CCHH){1|S<1>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.3710	0.000	1	120.3710	0.000	1	120.4181	3.899	9	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:C-4:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]O[6]C)(H)	C[6](C[6]C[6,6a]H)(O[6]C[6])(CH3)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]O[6]C)(H){1|C<4>,1|O<2>,2|C<3>}	C[6](C[6]C[6,6a]H)(O[6]C[6])(CH3){2|C<3>,2|H<1>}	H(C[6]C[6,6a]C[6])	119.9990	0.000	1	119.9990	0.000	1	120.4181	3.899	9	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:C-4:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]O[6]C)(H)	C[6](C[6]C[6,6a]H)(O[6]C[6])(CHHO)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]O[6]C)(H){1|C<4>,1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(O[6]C[6])(CHHO){1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.5730	0.000	1	119.5730	0.000	1	120.4181	3.899	9	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:C-4:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]O[6]C)(H)	C[6](C[6]C[6,6a]H)(O[6]Si[6])(CCCH)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]O[6]C)(H){1|Si<4>,1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(O[6]Si[6])(CCCH){4|C<3>}	H(C[6]C[6,6a]C[6])	116.9210	0.000	1	116.9210	0.000	1	120.4181	3.899	9	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:C-4:	C[6]-3:	C[6](C[6,6a]C[6,6a]O[6a])(C[6]O[6]C)(H)	C[6](C[6]C[6,6a]H)(O[6]C[6])(CH3)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]O[6a])(C[6]O[6]C)(H){3|C<3>}	C[6](C[6]C[6,6a]H)(O[6]C[6])(CH3){1|C<3>,2|O<2>}	H(C[6]C[6,6a]C[6])	122.6897	0.536	3	122.6897	0.288	3	120.4181	3.899	9	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:B-4:	C[6]-3:	C[6](C[6]C[6]B)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]C[6])(BC[6a]3)	H(C[6]C[6]2)	C[6](C[6]C[6]B)(C[6]C[6]C)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6])(BC[6a]3){1|C<3>,2|C<4>}	H(C[6]C[6]2)	118.5060	0.000	1	118.5060	0.000	1	118.8440	0.228	2	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:B-4:	C[6]-3:	C[6](C[6]C[6]B)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6])(BC[6a]3)	H(C[6]C[6]2)	C[6](C[6]C[6]B)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6])(BC[6a]3){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.1820	0.000	1	119.1820	0.000	1	118.8440	0.228	2	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6])(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6])(CC3){1|C<3>,2|H<1>}	H(C[6]C[6]2)	122.9740	0.000	1	121.2565	5.900	2	118.6996	8.952	32	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6])(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){2|C<3>}	C[6](C[6]C[6]H)(C[6]C[6])(CC3){1|Ir<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.5390	0.000	1	121.2565	5.900	2	118.6996	8.952	32	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6])(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|C<4>}	C[6](C[6]C[6]H)(C[6]C[6])(CCHH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.8570	0.000	1	117.3105	25.155	2	118.6996	8.952	32	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6])(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6])(CCHH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	113.7640	0.000	1	117.3105	25.155	2	118.6996	8.952	32	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6])(CCHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6])(CCHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	117.5190	0.000	2	117.5190	0.000	2	118.6996	8.952	32	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6])(CCHO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<2>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6])(CCHO){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.0930	0.000	1	119.0930	0.000	1	118.6996	8.952	32	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6])(CCHP)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6])(CCHP){1|C<3>,2|H<1>}	H(C[6]C[6]2)	117.0620	0.000	1	117.0620	0.000	1	118.6996	8.952	32	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6])(CC[5]CH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6])(CC[5]CH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.3980	0.000	1	119.3980	0.000	1	118.6996	8.952	32	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6])(CF3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6])(CF3){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2960	0.000	1	119.1770	2.504	2	118.6996	8.952	32	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6])(CF3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|S<4>}	C[6](C[6]C[6]H)(C[6]C[6])(CF3){1|C<3>,2|H<1>}	H(C[6]C[6]2)	118.0580	0.000	1	119.1770	2.504	2	118.6996	8.952	32	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6])(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<2>,1|S<4>}	C[6](C[6]C[6]H)(C[6]C[6])(CH3){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.3130	0.000	1	118.3252	6.680	8	118.6996	8.952	32	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6])(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|C<4>}	C[6](C[6]C[6]H)(C[6]C[6])(CH3){1|C<3>,2|H<1>}	H(C[6]C[6]2)	114.9630	0.000	1	118.3252	6.680	8	118.6996	8.952	32	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6])(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6])(CH3){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.0245	2.474	2	118.3252	6.680	8	118.6996	8.952	32	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6])(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6])(CH3){1|C<3>,1|H<1>,1|P<4>}	H(C[6]C[6]2)	117.4570	0.000	1	118.3252	6.680	8	118.6996	8.952	32	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6])(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6])(CH3){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.7150	0.000	1	118.3252	6.680	8	118.6996	8.952	32	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6])(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Li<6>,1|Ti<9>,1|C<4>}	C[6](C[6]C[6]H)(C[6]C[6])(CH3){1|Li<6>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	114.5150	0.000	1	118.3252	6.680	8	118.6996	8.952	32	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6])(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Zr<13>,1|C<3>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6])(CH3){1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.5900	0.000	1	118.3252	6.680	8	118.6996	8.952	32	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6])(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<2>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6])(CHHO){1|C<3>,1|H<1>}	H(C[6]C[6]2)	117.6200	0.000	1	115.2115	11.602	2	118.6996	8.952	32	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6])(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6])(CHHO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	112.8030	0.000	1	115.2115	11.602	2	118.6996	8.952	32	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6])(CHHS)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|C<4>}	C[6](C[6]C[6]H)(C[6]C[6])(CHHS){1|C<3>,2|H<1>}	H(C[6]C[6]2)	122.8310	0.000	1	122.8310	0.000	1	118.6996	8.952	32	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6])(CHNP)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Cl<1>,1|C<3>}	C[6](C[6]C[6]H)(C[6]C[6])(CHNP){1|C<3>,2|H<1>}	H(C[6]C[6]2)	117.2540	0.000	1	117.2540	0.000	1	118.6996	8.952	32	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6])(CN[5]CH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6])(CN[5]CH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	111.2040	0.000	1	111.2040	0.000	1	118.6996	8.952	32	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]C[6])(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]N)(H){1|C<3>,1|C<4>}	C[6](C[6]C[6]H)(C[6]C[6])(CCHH){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	124.1030	0.000	1	124.1030	0.000	1	118.6996	8.952	32	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6])(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|C<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6])(CHHO){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.0720	0.000	1	120.0720	0.000	1	118.6996	8.952	32	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6])(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>}	C[6](C[6]C[6]H)(C[6]C[6])(CCHH){1|N<2>,2|H<1>}	H(C[6]C[6]2)	122.8200	0.000	1	122.8200	0.000	1	118.6996	8.952	32	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(C[6]C[6])(CF3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6])(CF3){1|B<4>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	120.9650	0.000	1	120.9650	0.000	1	118.6996	8.952	32	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(C[6]C[6])(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|C<4>}	C[6](C[6]C[6]H)(C[6]C[6])(CH3){1|C<2>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	121.3720	0.000	1	119.0085	2.569	4	118.6996	8.952	32	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(C[6]C[6])(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6])(CH3){1|C<3>,2|C<4>}	H(C[6]C[6]2)	118.1785	0.497	2	119.0085	2.569	4	118.6996	8.952	32	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(C[6]C[6])(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|P<4>}	C[6](C[6]C[6]H)(C[6]C[6])(CH3){1|C<3>,2|C<4>}	H(C[6]C[6]2)	118.3050	0.000	1	119.0085	2.569	4	118.6996	8.952	32	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:N-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]C[6])(NH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6])(NH3){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1760	0.000	1	120.1760	0.000	1	120.1760	0.000	1	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:P-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](C[6]C[6]H)(C[6]C[6])(PC[6a]3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6])(PC[6a]3){1|C<3>,2|H<1>}	H(C[6]C[6]2)	115.0540	0.000	1	115.0540	0.000	1	118.1093	9.373	3	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:P-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](C[6]C[6]H)(C[6]C[6])(PN[5]NN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6])(PN[5]NN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	118.0970	0.000	1	118.0970	0.000	1	118.1093	9.373	3	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:P-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](C[6]C[6]H)(C[6]C[6])(PNiCC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6])(PNiCC){1|C<3>,2|H<1>}	H(C[6]C[6]2)	121.1770	0.000	1	121.1770	0.000	1	118.1093	9.373	3	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:S-4:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]S)(H)	C[6](C[6]C[6]H)(C[6]C[6])(SC[6]OO)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]S)(H){1|C<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6])(SC[6]OO){2|Br<1>,1|C<3>}	H(C[6]C[6]2)	122.9260	0.000	1	122.9260	0.000	1	121.2173	6.019	7	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:S-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]S)(H)	C[6](C[6]C[6]H)(C[6]C[6])(SC[5]OO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]S)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6])(SC[5]OO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	122.2360	0.000	1	122.2360	0.000	1	121.2173	6.019	7	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:S-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]S)(H)	C[6](C[6]C[6]H)(C[6]C[6])(SNOO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]S)(H){1|C<3>,1|C<4>}	C[6](C[6]C[6]H)(C[6]C[6])(SNOO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	121.2180	1.055	2	121.2180	1.113	2	121.2173	6.019	7	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:S-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]S)(H)	C[6](C[6]C[6]H)(C[6]C[6])(SN[5]OO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]S)(H){1|C<3>,1|C<4>}	C[6](C[6]C[6]H)(C[6]C[6])(SN[5]OO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	116.5450	0.000	1	116.5450	0.000	1	121.2173	6.019	7	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:S-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]S)(H)	C[6](C[6]C[6]H)(C[6]C[6])(SN[6]OO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]S)(H){1|C<2>,1|C<4>}	C[6](C[6]C[6]H)(C[6]C[6])(SN[6]OO){1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2750	0.000	1	122.1890	7.327	2	121.2173	6.019	7	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-2:S-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]S)(H)	C[6](C[6]C[6]H)(C[6]C[6])(SN[6]OO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]S)(H){1|C<3>,1|C<4>}	C[6](C[6]C[6]H)(C[6]C[6])(SN[6]OO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	124.1030	0.000	1	122.1890	7.327	2	121.2173	6.019	7	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]N[6])(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|N<3>,1|S<1>}	C[6](C[6]C[6]H)(N[6]N[6])(CC3){1|B<4>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	120.3290	0.485	2	119.6247	0.174	18	120.3727	0.420	138	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]N[6])(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|N<3>,1|S<2>}	C[6](C[6]C[6]H)(N[6]N[6])(CC3){1|B<4>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	119.6330	0.264	13	119.6247	0.174	18	120.3727	0.420	138	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]N[6])(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|N<3>,1|S<2>}	C[6](C[6]C[6]H)(N[6]N[6])(CC3){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.1190	0.259	3	119.6247	0.174	18	120.3727	0.420	138	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]N[6])(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]N[6])(CH3){1|S<4>,2|C<4>}	H(C[6]C[6]2)	119.8280	0.000	1	119.8280	0.000	1	120.3727	0.420	138	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6])(CCHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<2>,1|O<2>}	C[6](C[6]C[6]H)(N[6]C[6])(CCHN){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.1200	0.000	1	119.1200	0.000	1	120.3727	0.420	138	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6])(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6])(CH3){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	120.6820	0.000	1	120.2110	0.444	2	120.3727	0.420	138	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6])(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mo<7>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6])(CH3){1|Mo<7>,1|C<4>,1|H<1>,1|P<4>}	H(C[6]C[6]2)	119.7400	0.000	1	120.2110	0.444	2	120.3727	0.420	138	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6])(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<2>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6])(CHHN){1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3520	0.341	2	120.3520	0.116	2	120.3727	0.420	138	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]N[6])(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|N<3>,1|S<2>}	C[6](C[6]C[6]H)(N[6]N[6])(CC3){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2400	0.119	6	120.2562	0.042	9	120.3727	0.420	138	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]N[6])(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|N<3>,1|S<2>}	C[6](C[6]C[6]H)(N[6]N[6])(CC3){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0990	0.219	2	120.2562	0.042	9	120.3727	0.420	138	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]N[6])(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){2|N<3>}	C[6](C[6]C[6]H)(N[6]N[6])(CC3){1|Re<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6680	0.000	1	120.2562	0.042	9	120.3727	0.420	138	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]N[6])(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|N<3>,1|S<2>}	C[6](C[6]C[6]H)(N[6]N[6])(CH3){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1690	0.057	3	120.1690	0.003	3	120.3727	0.420	138	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:C-4:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6])(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]N[6]C)(H){4|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(CH3){1|Se<1>,1|C<3>,1|N<3>}	H(C[6]C[6]2)	120.6320	0.132	3	120.6320	0.017	3	120.3727	0.420	138	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:C-4:	C[6]-3:	C[6](C[6]N[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6])(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6])(CH3){1|H<1>,2|N<3>}	H(C[6]C[6]2)	121.1896	0.123	5	121.1268	0.083	12	120.3727	0.420	138	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:C-4:	C[6]-3:	C[6](C[6]N[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6])(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.3240	0.359	2	121.1268	0.083	12	120.3727	0.420	138	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:C-4:	C[6]-3:	C[6](C[6]N[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6])(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(CH3){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.9720	0.000	1	121.1268	0.083	12	120.3727	0.420	138	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:C-4:	C[6]-3:	C[6](C[6]N[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6])(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(CH3){1|H<1>,2|N<3>}	H(C[6]C[6]2)	121.5590	0.000	1	121.1268	0.083	12	120.3727	0.420	138	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:C-4:	C[6]-3:	C[6](C[6]N[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6])(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.9130	0.088	2	121.1268	0.083	12	120.3727	0.420	138	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:C-4:	C[6]-3:	C[6](C[6]N[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6])(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(CH3){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.5680	0.000	1	121.1268	0.083	12	120.3727	0.420	138	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](C[6]C[6]H)(N[6]C[6])(CC3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Fe<5>,1|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(CC3){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.5960	0.000	1	120.5960	0.000	1	120.3727	0.420	138	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](C[6]C[6]H)(N[6]C[6])(CF3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Fe<6>,1|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(CF3){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.1910	0.000	1	120.1910	0.000	1	120.3727	0.420	138	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](C[6]C[6]H)(N[6]C[6])(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Ag<5>,1|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(CH3){1|C<4>,1|N<3>,1|S<3>}	H(C[6]C[6]2)	117.5070	0.000	1	120.4599	0.390	85	120.3727	0.420	138	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](C[6]C[6]H)(N[6]C[6])(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6])(CH3){1|C<4>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.6045	0.253	15	120.4599	0.390	85	120.3727	0.420	138	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](C[6]C[6]H)(N[6]C[6])(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6])(CH3){1|C<4>,1|N<3>,1|S<1>}	H(C[6]C[6]2)	118.2630	0.000	1	120.4599	0.390	85	120.3727	0.420	138	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](C[6]C[6]H)(N[6]C[6])(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6])(CH3){1|C<4>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	120.6564	0.375	5	120.4599	0.390	85	120.3727	0.420	138	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](C[6]C[6]H)(N[6]C[6])(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6])(CH3){1|C<4>,2|N<3>}	H(C[6]C[6]2)	120.7165	0.405	33	120.4599	0.390	85	120.3727	0.420	138	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](C[6]C[6]H)(N[6]C[6])(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(CH3){1|C<3>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	119.1460	0.000	1	120.4599	0.390	85	120.3727	0.420	138	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](C[6]C[6]H)(N[6]C[6])(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Cd<6>,1|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(CH3){1|C<4>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	120.5780	0.000	1	120.4599	0.390	85	120.3727	0.420	138	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](C[6]C[6]H)(N[6]C[6])(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Cd<6>,1|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(CH3){1|C<4>,1|N<3>,1|S<3>}	H(C[6]C[6]2)	120.2720	0.345	2	120.4599	0.390	85	120.3727	0.420	138	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](C[6]C[6]H)(N[6]C[6])(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Co<6>,1|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(CH3){1|C<4>,2|N<3>}	H(C[6]C[6]2)	120.5245	0.268	2	120.4599	0.390	85	120.3727	0.420	138	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](C[6]C[6]H)(N[6]C[6])(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Cu<4>,1|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(CH3){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3530	0.000	1	120.4599	0.390	85	120.3727	0.420	138	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](C[6]C[6]H)(N[6]C[6])(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Cu<6>,1|C<4>}	C[6](C[6]C[6]H)(N[6]C[6])(CH3){1|Cu<6>,1|C<4>,2|N<3>}	H(C[6]C[6]2)	120.2990	0.000	1	120.4599	0.390	85	120.3727	0.420	138	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](C[6]C[6]H)(N[6]C[6])(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Eu<12>,1|C<4>}	C[6](C[6]C[6]H)(N[6]C[6])(CH3){1|Eu<12>,1|C<4>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	120.3310	0.000	1	120.4599	0.390	85	120.3727	0.420	138	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](C[6]C[6]H)(N[6]C[6])(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Gd<15>,1|C<4>}	C[6](C[6]C[6]H)(N[6]C[6])(CH3){1|Gd<15>,1|C<4>,1|N<3>,1|N<4>}	H(C[6]C[6]2)	120.6030	0.249	2	120.4599	0.390	85	120.3727	0.420	138	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](C[6]C[6]H)(N[6]C[6])(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Ir<6>,1|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(CH3){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	119.9030	0.682	2	120.4599	0.390	85	120.3727	0.420	138	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](C[6]C[6]H)(N[6]C[6])(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Mn<6>,1|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(CH3){1|C<4>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	120.7130	0.000	1	120.4599	0.390	85	120.3727	0.420	138	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](C[6]C[6]H)(N[6]C[6])(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Ni<6>,1|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(CH3){1|C<4>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	120.8717	0.190	4	120.4599	0.390	85	120.3727	0.420	138	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](C[6]C[6]H)(N[6]C[6])(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Pd<4>,1|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(CH3){1|N<3>,2|C<4>}	H(C[6]C[6]2)	119.9566	0.111	5	120.4599	0.390	85	120.3727	0.420	138	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](C[6]C[6]H)(N[6]C[6])(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Pr<12>,1|C<4>}	C[6](C[6]C[6]H)(N[6]C[6])(CH3){1|Pr<12>,1|C<4>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	120.1760	0.000	1	120.4599	0.390	85	120.3727	0.420	138	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](C[6]C[6]H)(N[6]C[6])(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Rh<5>,1|C<4>}	C[6](C[6]C[6]H)(N[6]C[6])(CH3){1|Rh<5>,1|C<4>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	119.9900	0.000	1	120.4599	0.390	85	120.3727	0.420	138	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](C[6]C[6]H)(N[6]C[6])(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Sm<12>,1|C<4>}	C[6](C[6]C[6]H)(N[6]C[6])(CH3){1|Sm<12>,1|C<4>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	120.7480	0.000	1	120.4599	0.390	85	120.3727	0.420	138	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](C[6]C[6]H)(N[6]C[6])(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Sn<5>,1|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(CH3){1|C<4>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	120.5330	0.000	1	120.4599	0.390	85	120.3727	0.420	138	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](C[6]C[6]H)(N[6]C[6])(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){2|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(CH3){1|C<3>,1|N<3>,1|O<1>}	H(C[6]C[6]2)	119.1240	0.686	2	120.4599	0.390	85	120.3727	0.420	138	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](C[6]C[6]H)(N[6]C[6])(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){2|C<3>}	C[6](C[6]C[6]H)(N[6]C[6])(CH3){1|C<4>,1|N<3>,1|S<1>}	H(C[6]C[6]2)	120.3360	0.000	1	120.4599	0.390	85	120.3727	0.420	138	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:C-4:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]O[6]C)(H)	C[6](C[6]C[6]H)(O[6]C[6])(CC3)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]O[6]C)(H){1|C<3>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(O[6]C[6])(CC3){1|C<4>,2|C<3>}	H(C[6]C[6]2)	118.3900	0.082	2	118.7672	0.075	13	118.9971	1.016	90	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:C-4:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]O[6]C)(H)	C[6](C[6]C[6]H)(O[6]C[6])(CC3)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]O[6]C)(H){1|C<3>,1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(O[6]C[6])(CC3){1|C<4>,2|C<3>}	H(C[6]C[6]2)	118.8357	0.235	11	118.7672	0.075	13	118.9971	1.016	90	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:C-4:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]O[6]C)(H)	C[6](C[6]C[6]H)(O[6]C[6])(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]O[6]C)(H){1|H<1>,3|C<3>}	C[6](C[6]C[6]H)(O[6]C[6])(CH3){1|C<4>,2|C<3>}	H(C[6]C[6]2)	119.1425	0.042	2	119.1425	0.002	2	118.9971	1.016	90	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:C-4:	C[6]-3:	C[6](C[6]C[5]O[6])(C[6]O[6]C)(H)	C[6](C[6]C[6]H)(O[6]B[6])(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5]O[6])(C[6]O[6]C)(H){1|Fe<10>,1|B<4>,1|C<4>,1|P<3>}	C[6](C[6]C[6]H)(O[6]B[6])(CH3){1|C<4>,1|O<2>,2|F<1>}	H(C[6]C[6]2)	118.3440	0.000	1	119.1205	1.206	2	118.9971	1.016	90	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:C-4:	C[6]-3:	C[6](C[6]C[5]O[6])(C[6]O[6]C)(H)	C[6](C[6]C[6]H)(O[6]B[6])(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5]O[6])(C[6]O[6]C)(H){1|Fe<10>,1|B<4>,2|C<4>}	C[6](C[6]C[6]H)(O[6]B[6])(CH3){1|C<4>,1|O<2>,2|F<1>}	H(C[6]C[6]2)	119.8970	0.000	1	119.1205	1.206	2	118.9971	1.016	90	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:C-4:	C[6]-3:	C[6](C[6]C[5a]O[6])(C[6]O[6]C)(H)	C[6](C[6]C[6]H)(O[6]B[6])(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5a]O[6])(C[6]O[6]C)(H){1|B<4>,1|C<3>,1|N<3>}	C[6](C[6]C[6]H)(O[6]B[6])(CH3){1|C<3>,1|O<2>,2|F<1>}	H(C[6]C[6]2)	120.1460	0.000	1	120.1460	0.000	1	118.9971	1.016	90	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:C-4:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]O[6]C)(H)	C[6](C[6]C[6]H)(O[6]C[6])(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]O[6]C)(H){1|C<3>,2|C<4>}	C[6](C[6]C[6]H)(O[6]C[6])(CH3){1|C<4>,2|O<1>}	H(C[6]C[6]2)	119.0460	0.000	1	119.0460	0.000	1	118.9971	1.016	90	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:C-4:	C[6]-3:	C[6](C[6]C[6]2)(C[6]O[6]C)(H)	C[6](C[6]C[6]H)(O[6]C[6])(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]O[6]C)(H){1|C<3>,1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(O[6]C[6])(CC3){1|C<4>,2|C<3>}	H(C[6]C[6]2)	118.5735	0.226	2	118.5735	0.051	2	118.9971	1.016	90	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]O[6]C)(H)	C[6](C[6]C[6]H)(O[6]C[6])(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]O[6]C)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(O[6]C[6])(CC3){1|C<4>,2|C<3>}	H(C[6]C[6]2)	119.0500	0.162	6	119.1227	0.059	7	118.9971	1.016	90	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]O[6]C)(H)	C[6](C[6]C[6]H)(O[6]C[6])(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]O[6]C)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(O[6]C[6])(CC3){3|C<3>}	H(C[6]C[6]2)	119.5590	0.000	1	119.1227	0.059	7	118.9971	1.016	90	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]O[6]C)(H)	C[6](C[6]C[6]H)(O[6]C[6])(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]O[6]C)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(O[6]C[6])(CH3){1|C<4>,2|C<3>}	H(C[6]C[6]2)	119.5245	0.135	4	119.5245	0.018	4	118.9971	1.016	90	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:C-4:	C[6]-3:	C[6](C[6]C[6]O)(C[6]O[6]C)(H)	C[6](C[6]C[6]H)(O[6]C[6])(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]O[6]C)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(O[6]C[6])(CH3){1|C<3>,1|C<4>,1|O<2>}	H(C[6]C[6]2)	119.5135	0.838	4	119.4719	0.240	16	118.9971	1.016	90	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:C-4:	C[6]-3:	C[6](C[6]C[6]O)(C[6]O[6]C)(H)	C[6](C[6]C[6]H)(O[6]C[6])(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]O[6]C)(H){2|C<3>}	C[6](C[6]C[6]H)(O[6]C[6])(CH3){1|C<3>,2|O<1>}	H(C[6]C[6]2)	119.4580	0.368	12	119.4719	0.240	16	118.9971	1.016	90	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:C-4:	C[6]-3:	C[6](C[6]C[6]S)(C[6]O[6]C)(H)	C[6](C[6]C[6]H)(O[6]C[6])(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]S)(C[6]O[6]C)(H){1|C<3>,1|O<2>}	C[6](C[6]C[6]H)(O[6]C[6])(CH3){1|C<3>,1|H<1>,1|S<2>}	H(C[6]C[6]2)	119.1060	0.000	1	119.7690	0.143	5	118.9971	1.016	90	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:C-4:	C[6]-3:	C[6](C[6]C[6]S)(C[6]O[6]C)(H)	C[6](C[6]C[6]H)(O[6]C[6])(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]S)(C[6]O[6]C)(H){1|C<3>,1|O<2>}	C[6](C[6]C[6]H)(O[6]C[6])(CH3){1|S<1>,2|C<3>}	H(C[6]C[6]2)	119.8560	0.000	1	119.7690	0.143	5	118.9971	1.016	90	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:C-4:	C[6]-3:	C[6](C[6]C[6]S)(C[6]O[6]C)(H)	C[6](C[6]C[6]H)(O[6]C[6])(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]S)(C[6]O[6]C)(H){1|C<3>,1|O<2>}	C[6](C[6]C[6]H)(O[6]C[6])(CH3){1|S<2>,2|C<3>}	H(C[6]C[6]2)	119.9610	0.082	3	119.7690	0.143	5	118.9971	1.016	90	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:C-4:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]O[6]C)(H)	C[6](C[6]C[6]H)(O[6]C[6])(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]O[6]C)(H){1|H<1>,3|C<3>}	C[6](C[6]C[6]H)(O[6]C[6])(CH3){1|C<4>,2|C<3>}	H(C[6]C[6]2)	119.2145	0.209	4	119.2145	0.044	4	118.9971	1.016	90	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:C-4:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]O[6]C)(H)	C[6](C[6]C[6]H)(O[6]C[6])(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]O[6]C)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6]H)(O[6]C[6])(CH3){1|C<4>,1|N<2>,2|C<3>}	H(C[6]C[6]2)	120.9540	0.000	1	120.9540	0.000	1	118.9971	1.016	90	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:C-4:	C[6]-3:	C[6](C[6]C[6a]O[6])(C[6]O[6]C)(H)	C[6](C[6]C[6]H)(O[6]B[6])(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6a]O[6])(C[6]O[6]C)(H){1|B<4>,2|C<3>}	C[6](C[6]C[6]H)(O[6]B[6])(CH3){1|C<3>,1|O<2>,2|F<1>}	H(C[6]C[6]2)	119.6303	0.461	3	119.6303	0.212	3	118.9971	1.016	90	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:C-4:	C[6]-3:	C[6](C[6]N[6]C)(C[6]O[6]C)(H)	C[6](C[6]C[6]H)(O[6]Ga[6])(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)(C[6]O[6]C)(H){1|Ga<4>,1|C<4>}	C[6](C[6]C[6]H)(O[6]Ga[6])(CH3){1|C<4>,3|N<3>}	H(C[6]C[6]2)	116.0200	0.000	1	115.9445	0.011	2	118.9971	1.016	90	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:C-4:	C[6]-3:	C[6](C[6]N[6]C)(C[6]O[6]C)(H)	C[6](C[6]C[6]H)(O[6]Ga[6])(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)(C[6]O[6]C)(H){1|Ga<4>,1|C<4>}	C[6](C[6]C[6]H)(O[6]Ga[6])(CH3){2|Cl<1>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	115.8690	0.000	1	115.9445	0.011	2	118.9971	1.016	90	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:C-4:	C[6]-3:	C[6](C[6]N[6]C)(C[6]O[6]C)(H)	C[6](C[6]C[6]H)(O[6]Ge[6])(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)(C[6]O[6]C)(H){1|Ge<3>,1|C<3>}	C[6](C[6]C[6]H)(O[6]Ge[6])(CH3){1|Cl<1>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	117.0460	0.000	1	117.0460	0.000	1	118.9971	1.016	90	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:C-4:	C[6]-3:	C[6](C[6]N[6]O)(C[6]O[6]C)(H)	C[6](C[6]C[6]H)(O[6]C[6])(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]O)(C[6]O[6]C)(H){2|C<4>}	C[6](C[6]C[6]H)(O[6]C[6])(CH3){1|N<3>,1|O<1>,2|C<3>}	H(C[6]C[6]2)	119.1180	0.000	1	119.1180	0.000	1	118.9971	1.016	90	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:C-4:	C[6]-3:	C[6](C[6]N[6]O)(C[6]O[6]C)(H)	C[6](C[6]C[6]H)(O[6]S[6])(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]O)(C[6]O[6]C)(H){1|H<1>,1|S<4>}	C[6](C[6]C[6]H)(O[6]S[6])(CH3){1|N<3>,3|O<1>}	H(C[6]C[6]2)	118.9890	0.415	3	118.7001	0.165	15	118.9971	1.016	90	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:C-4:	C[6]-3:	C[6](C[6]N[6]O)(C[6]O[6]C)(H)	C[6](C[6]C[6]H)(O[6]S[6])(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]O)(C[6]O[6]C)(H){1|Pd<4>,1|S<4>}	C[6](C[6]C[6]H)(O[6]S[6])(CH3){1|N<3>,3|O<1>}	H(C[6]C[6]2)	118.1310	0.000	1	118.7001	0.165	15	118.9971	1.016	90	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:C-4:	C[6]-3:	C[6](C[6]N[6]O)(C[6]O[6]C)(H)	C[6](C[6]C[6]H)(O[6]S[6])(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]O)(C[6]O[6]C)(H){1|S<4>}	C[6](C[6]C[6]H)(O[6]S[6])(CH3){1|N<2>,1|O<2>,2|O<1>}	H(C[6]C[6]2)	118.9010	0.638	2	118.7001	0.165	15	118.9971	1.016	90	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:C-4:	C[6]-3:	C[6](C[6]N[6]O)(C[6]O[6]C)(H)	C[6](C[6]C[6]H)(O[6]S[6])(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]O)(C[6]O[6]C)(H){1|S<4>}	C[6](C[6]C[6]H)(O[6]S[6])(CH3){1|N<2>,3|O<1>}	H(C[6]C[6]2)	118.6224	0.325	9	118.7001	0.165	15	118.9971	1.016	90	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:C-4:	C[6]-3:	C[6](C[6]O[6]C)(C[6]O[6]O)(H)	C[6](C[6]C[6]H)(O[6]C[6])(CCHH)	H(C[6]C[6]2)	C[6](C[6]O[6]C)(C[6]O[6]O)(H){1|C<4>}	C[6](C[6]C[6]H)(O[6]C[6])(CCHH){1|O<1>,1|O<2>,2|C<4>}	H(C[6]C[6]2)	120.7240	1.739	3	120.7240	3.026	3	118.9971	1.016	90	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:C-4:	C[6]-3:	C[6](C[6]O[6]C)(C[6]O[6]O)(H)	C[6](C[6]C[6]H)(O[6]C[6])(CC[5]HH)	H(C[6]C[6]2)	C[6](C[6]O[6]C)(C[6]O[6]O)(H){1|C<4>}	C[6](C[6]C[6]H)(O[6]C[6])(CC[5]HH){1|O<1>,1|O<2>,2|C<4>}	H(C[6]C[6]2)	119.6180	0.000	1	119.6180	0.000	1	118.9971	1.016	90	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:C-4:	C[6]-3:	C[6](C[6]O[6]C)2(H)	C[6](C[6]C[6]H)(O[6]In[6])(CH3)	H(C[6]C[6]2)	C[6](C[6]O[6]C)2(H){1|In<4>}	C[6](C[6]C[6]H)(O[6]In[6])(CH3){1|O<2>,3|C<4>}	H(C[6]C[6]2)	115.6350	0.048	2	115.6350	0.002	2	118.9971	1.016	90	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:C-4:	C[6]-3:	C[6](C[6]O[6]C)2(H)	C[6](C[6]C[6]H)(O[6]Nb[6])(CH3)	H(C[6]C[6]2)	C[6](C[6]O[6]C)2(H){1|Nb<6>}	C[6](C[6]C[6]H)(O[6]Nb[6])(CH3){1|Cl<1>,1|C<4>,4|O<2>}	H(C[6]C[6]2)	118.1225	0.066	2	118.0580	0.007	4	118.9971	1.016	90	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:O[6]-2:C-4:	C[6]-3:	C[6](C[6]O[6]C)2(H)	C[6](C[6]C[6]H)(O[6]Nb[6])(CH3)	H(C[6]C[6]2)	C[6](C[6]O[6]C)2(H){1|Nb<6>}	C[6](C[6]C[6]H)(O[6]Nb[6])(CH3){2|Cl<1>,1|C<4>,3|O<2>}	H(C[6]C[6]2)	117.9935	0.037	2	118.0580	0.007	4	118.9971	1.016	90	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:P[6]-2:Si-4:	C[6]-3:	C[6](C[6]P[6]Si)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(P[6]C[6])(SiC3)	H(C[6]C[6]2)	C[6](C[6]P[6]Si)(C[6]C[6]H)(H){1|C<3>,1|C<4>}	C[6](C[6]C[6]H)(P[6]C[6])(SiC3){1|C<3>,1|H<1>,1|P<3>}	H(C[6]C[6]2)	117.2530	0.000	1	117.3170	0.008	2	117.3170	0.008	2	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:P[6]-2:Si-4:	C[6]-3:	C[6](C[6]P[6]Si)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(P[6]C[6])(SiC3)	H(C[6]C[6]2)	C[6](C[6]P[6]Si)(C[6]C[6]H)(H){1|C<3>,1|C<4>}	C[6](C[6]C[6]H)(P[6]C[6])(SiC3){1|C<3>,1|H<1>,1|P<4>}	H(C[6]C[6]2)	117.3810	0.000	1	117.3170	0.008	2	117.3170	0.008	2	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:S[6]-2:C-4:	C[6]-3:	C[6](C[6]C[6]O)(C[6]S[6]C)(H)	C[6](C[6]C[6]H)(S[6]C[6])(CCCO)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]S[6]C)(H){1|H<1>,2|C<4>}	C[6](C[6]C[6]H)(S[6]C[6])(CCCO){1|C<4>,1|O<1>,2|H<1>}	H(C[6]C[6]2)	116.2210	0.000	1	116.2210	0.000	1	116.2210	0.000	1	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-2:C-4:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]C)(H)	C[6](C[6]N[6]H)(C[6]C[6])(CH3)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]C)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(C[6]C[6])(CH3){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	125.0010	0.000	1	125.0010	0.000	1	125.0010	0.000	1	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:N[6]-2:C-4:	C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6]C)(H)	C[6](C[6]N[6]H)(N[6]C[6])(CH3)	H(C[6]C[6]N[6])	C[6](C[6]N[6]C)(N[6]C[6]C)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6])(CH3){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	119.7913	0.351	4	119.7913	0.123	4	119.6812	0.761	14	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:N[6]-2:C-4:	C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6])(CH3)	H(C[6]C[6]N[6])	C[6](C[6]N[6]C)(N[6]C[6]H)(H){1|C<3>,1|C<4>}	C[6](C[6]N[6]H)(N[6]C[6])(CH3){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	120.4027	0.243	6	120.4027	0.059	6	119.6812	0.761	14	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:N[6]-2:C-4:	C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6]W)(H)	C[6](C[6]N[6]H)(N[6]C[6])(CH3)	H(C[6]C[6]N[6])	C[6](C[6]N[6]C)(N[6]C[6]W)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6])(CH3){1|C<3>,1|C<4>,1|W<6>}	H(C[6]C[6]N[6])	118.4890	0.352	4	118.4890	0.124	4	119.6812	0.761	14	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:C-4:	C[6]-3:	C[6](N[6,6]C[6,6]B[6])(C[6]N[6]C)(H)	C[6](C[6]N[6,6]H)(N[6]C[6])(CH3)	H(C[6]N[6,6]C[6])	C[6](N[6,6]C[6,6]B[6])(C[6]N[6]C)(H){1|O<2>,2|C<3>,2|F<1>}	C[6](C[6]N[6,6]H)(N[6]C[6])(CH3){1|B<4>,1|C<3>,1|H<1>}	H(C[6]N[6,6]C[6])	119.2565	0.129	2	119.6775	1.333	4	119.6775	1.333	4	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:C-4:	C[6]-3:	C[6](N[6,6]C[6,6]B[6])(C[6]N[6]C)(H)	C[6](C[6]N[6,6]H)(N[6]C[6])(CH3)	H(C[6]N[6,6]C[6])	C[6](N[6,6]C[6,6]B[6])(C[6]N[6]C)(H){1|O<2>,4|C<3>}	C[6](C[6]N[6,6]H)(N[6]C[6])(CH3){1|B<4>,1|C<3>,1|H<1>}	H(C[6]N[6,6]C[6])	120.0985	1.809	2	119.6775	1.333	4	119.6775	1.333	4	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:C-4:	C[6]-3:	C[6](N[6]C[6]Cd)(C[6]N[6]C)(H)	C[6](C[6]N[6]H)(N[6]C[6])(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cd)(C[6]N[6]C)(H){2|C<3>}	C[6](C[6]N[6]H)(N[6]C[6])(CH3){1|Cd<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8210	0.279	2	118.8210	0.078	2	119.0448	0.149	38	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:C-4:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]N[6]C)(H)	C[6](C[6]N[6]H)(N[6]C[6])(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]N[6]C)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6])(CH3){1|Co<6>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	119.0333	0.230	4	118.9130	0.210	8	119.0448	0.149	38	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:C-4:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]N[6]C)(H)	C[6](C[6]N[6]H)(N[6]C[6])(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]N[6]C)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6])(CH3){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7580	0.000	1	118.9130	0.210	8	119.0448	0.149	38	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:C-4:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]N[6]C)(H)	C[6](C[6]N[6]H)(N[6]C[6])(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]N[6]C)(H){2|C<3>}	C[6](C[6]N[6]H)(N[6]C[6])(CH3){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8043	0.773	3	118.9130	0.210	8	119.0448	0.149	38	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:C-4:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]N[6]C)(H)	C[6](C[6]N[6]H)(N[6]C[6])(CCHH)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]N[6]C)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6])(CCHH){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.1933	0.167	4	119.1933	0.028	4	119.0448	0.149	38	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:C-4:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]N[6]C)(H)	C[6](C[6]N[6]H)(N[6]C[6])(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]N[6]C)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6])(CH3){1|Cu<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7670	0.000	1	119.0200	0.052	3	119.0448	0.149	38	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:C-4:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]N[6]C)(H)	C[6](C[6]N[6]H)(N[6]C[6])(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]N[6]C)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6])(CH3){1|Cu<5>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	119.1465	0.090	2	119.0200	0.052	3	119.0448	0.149	38	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:C-4:	C[6]-3:	C[6](N[6]C[6]Fe)(C[6]N[6]C)(H)	C[6](C[6]N[6]H)(N[6]C[6])(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Fe)(C[6]N[6]C)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6])(CH3){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6700	0.000	1	118.7800	0.024	2	119.0448	0.149	38	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:C-4:	C[6]-3:	C[6](N[6]C[6]Fe)(C[6]N[6]C)(H)	C[6](C[6]N[6]H)(N[6]C[6])(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Fe)(C[6]N[6]C)(H){2|C<3>}	C[6](C[6]N[6]H)(N[6]C[6])(CH3){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8900	0.000	1	118.7800	0.024	2	119.0448	0.149	38	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:C-4:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]N[6]C)(H)	C[6](C[6]N[6]H)(N[6]C[6])(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]N[6]C)(H){2|C<3>}	C[6](C[6]N[6]H)(N[6]C[6])(CH3){1|Ir<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.1290	0.000	1	119.1843	0.023	3	119.0448	0.149	38	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:C-4:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]N[6]C)(H)	C[6](C[6]N[6]H)(N[6]C[6])(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]N[6]C)(H){2|C<3>}	C[6](C[6]N[6]H)(N[6]C[6])(CH3){1|Ir<6>,2|C<3>}	H(C[6]C[6]N[6])	119.2120	0.204	2	119.1843	0.023	3	119.0448	0.149	38	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:C-4:	C[6]-3:	C[6](N[6]C[6]Mn)(C[6]N[6]C)(H)	C[6](C[6]N[6]H)(N[6]C[6])(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mn)(C[6]N[6]C)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6])(CH3){1|Mn<6>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	118.8340	0.000	1	118.8340	0.000	1	119.0448	0.149	38	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:C-4:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]N[6]C)(H)	C[6](C[6]N[6]H)(N[6]C[6])(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]N[6]C)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6])(CH3){1|Ni<6>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	119.1543	0.128	4	119.1352	0.057	6	119.0448	0.149	38	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:C-4:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]N[6]C)(H)	C[6](C[6]N[6]H)(N[6]C[6])(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]N[6]C)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6])(CH3){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7560	0.000	1	119.1352	0.057	6	119.0448	0.149	38	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:C-4:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]N[6]C)(H)	C[6](C[6]N[6]H)(N[6]C[6])(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]N[6]C)(H){2|C<3>}	C[6](C[6]N[6]H)(N[6]C[6])(CH3){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.4380	0.000	1	119.1352	0.057	6	119.0448	0.149	38	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:C-4:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]N[6]C)(H)	C[6](C[6]N[6]H)(N[6]C[6])(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]N[6]C)(H){1|C<3>,1|C<4>}	C[6](C[6]N[6]H)(N[6]C[6])(CH3){1|Pt<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.9450	0.000	1	118.9450	0.000	1	119.0448	0.149	38	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:C-4:	C[6]-3:	C[6](N[6]C[6]Re)(C[6]N[6]C)(H)	C[6](C[6]N[6]H)(N[6]C[6])(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Re)(C[6]N[6]C)(H){2|C<3>}	C[6](C[6]N[6]H)(N[6]C[6])(CH3){1|Re<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.0080	0.000	1	119.0080	0.000	1	119.0448	0.149	38	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:C-4:	C[6]-3:	C[6](N[6]C[6]Sn)(C[6]N[6]C)(H)	C[6](C[6]N[6]H)(N[6]C[6])(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Sn)(C[6]N[6]C)(H){2|C<3>}	C[6](C[6]N[6]H)(N[6]C[6])(CH3){1|Sn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.4530	0.626	2	119.4530	0.392	2	119.0448	0.149	38	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:C-4:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]N[6]C)(H)	C[6](C[6]N[6]H)(N[6]C[6])(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]N[6]C)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6])(CH3){1|Zn<4>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	119.3505	0.363	4	119.0614	0.516	5	119.0448	0.149	38	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:2:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-2:C-4:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]N[6]C)(H)	C[6](C[6]N[6]H)(N[6]C[6])(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]N[6]C)(H){2|C<3>}	C[6](C[6]N[6]H)(N[6]C[6])(CH3){1|Zn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.9050	0.000	1	119.0614	0.516	5	119.0448	0.149	38	119.5951	2.156	371	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	As[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](As[6]C[6]W)(C[6]C[6]H)(H)	C[6](C[6]As[6]H)(C[6]C[6]H)(H)	H(C[6]As[6]C[6])	C[6](As[6]C[6]W)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]As[6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|W<6>}	H(C[6]As[6]C[6])	118.3311	0.327	12	118.3311	0.107	12	118.3311	0.107	12	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	B[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](B[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]B[6]H)(C[6]C[6]C)(H)	H(C[6]B[6]C[6])	C[6](B[6]C[6]N[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,3|C<3>}	C[6](C[6]B[6]H)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]B[6]C[6])	120.9257	0.207	4	120.9257	0.043	4	119.4641	5.682	17	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	B[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](B[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]B[6]H)(C[6]C[6]H)(H)	H(C[6]B[6]C[6])	C[6](B[6]C[6]N[6])(C[6]C[6]H)(H){1|H<1>,4|C<3>}	C[6](C[6]B[6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]B[6]C[6])	120.0515	0.103	2	120.4390	0.456	3	119.4641	5.682	17	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	B[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](B[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]B[6]H)(C[6]C[6]H)(H)	H(C[6]B[6]C[6])	C[6](B[6]C[6]N[6])(C[6]C[6]H)(H){2|H<1>,3|C<3>}	C[6](C[6]B[6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]B[6]C[6])	121.2140	0.000	1	120.4390	0.456	3	119.4641	5.682	17	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	B[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](B[6]C[6]P)(C[6]C[6]H)(H)	C[6](C[6]B[6]H)(C[6]C[6]H)(H)	H(C[6]B[6]C[6])	C[6](B[6]C[6]P)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]B[6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<3>}	H(C[6]B[6]C[6])	115.4733	1.112	4	118.1924	9.214	8	119.4641	5.682	17	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	B[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](B[6]C[6]P)(C[6]C[6]H)(H)	C[6](C[6]B[6]H)(C[6]C[6]H)(H)	H(C[6]B[6]C[6])	C[6](B[6]C[6]P)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]B[6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<4>}	H(C[6]B[6]C[6])	120.9115	0.740	4	118.1924	9.214	8	119.4641	5.682	17	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	B[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](B[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]B[6]H)(C[6]C[6]H)(H)	H(C[6]B[6]C[6])	C[6](B[6]C[6a]N[6])(C[6]C[6]H)(H){1|Zr<15>,1|C<4>,1|H<1>,2|C<3>}	C[6](C[6]B[6]H)(C[6]C[6]H)(H){1|Zr<15>,1|C<3>,1|H<1>,1|N<3>}	H(C[6]B[6]C[6])	120.3330	0.000	1	120.1650	0.056	2	119.4641	5.682	17	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	B[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](B[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]B[6]H)(C[6]C[6]H)(H)	H(C[6]B[6]C[6])	C[6](B[6]C[6a]N[6])(C[6]C[6]H)(H){1|Zr<15>,1|C<4>,1|H<1>,2|C<3>}	C[6](C[6]B[6]H)(C[6]C[6]H)(H){1|Zr<15>,1|C<3>,1|H<2>,1|N<3>}	H(C[6]B[6]C[6])	119.9970	0.000	1	120.1650	0.056	2	119.4641	5.682	17	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[3x6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[3x6]C[4x6]C[6,6])(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,6]C[5])(C[6]C[3x6]H)(H)	H(C[6]C[3x6]C[6])	C[6](C[3x6]C[4x6]C[6,6])(C[6]C[5,6]H)(H){1|O<2>,2|C<3>,4|C<4>}	C[6](C[5,6]C[5,6]C[5])(C[6]C[3x6]H)(H){1|H<1>,1|O<1>,4|C<4>}	H(C[6]C[3x6]C[6])	119.4830	0.000	1	119.4830	0.000	1	119.4830	0.000	1	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[3x6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[3x6]C[3x6]N[3x6])(C[6]C[6]H)(H)	C[6](C[6]C[3x6]H)(C[6]C[6]H)(H)	H(C[6]C[3x6]C[6])	C[6](C[3x6]C[3x6]N[3x6])(C[6]C[6]H)(H){1|Nb<5>,1|C<3>,1|H<1>,3|C<4>}	C[6](C[6]C[3x6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[3x6]C[6])	120.0990	0.000	1	120.1177	0.123	7	120.3404	1.530	27	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[3x6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[3x6]C[3x6]N[3x6])(C[6]C[6]H)(H)	C[6](C[6]C[3x6]H)(C[6]C[6]H)(H)	H(C[6]C[3x6]C[6])	C[6](C[3x6]C[3x6]N[3x6])(C[6]C[6]H)(H){1|Nb<6>,1|C<3>,1|H<1>,3|C<4>}	C[6](C[6]C[3x6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[3x6]C[6])	120.6970	0.000	1	120.1177	0.123	7	120.3404	1.530	27	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[3x6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[3x6]C[3x6]N[3x6])(C[6]C[6]H)(H)	C[6](C[6]C[3x6]H)(C[6]C[6]H)(H)	H(C[6]C[3x6]C[6])	C[6](C[3x6]C[3x6]N[3x6])(C[6]C[6]H)(H){1|Nb<7>,1|C<3>,1|H<1>,3|C<4>}	C[6](C[6]C[3x6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[3x6]C[6])	119.9000	0.199	4	120.1177	0.123	7	120.3404	1.530	27	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[3x6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[3x6]C[3x6]N[3x6])(C[6]C[6]H)(H)	C[6](C[6]C[3x6]H)(C[6]C[6]H)(H)	H(C[6]C[3x6]C[6])	C[6](C[3x6]C[3x6]N[3x6])(C[6]C[6]H)(H){2|Ge<3>,1|C<3>,1|P<4>,2|H<1>}	C[6](C[6]C[3x6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[3x6]C[6])	120.4280	0.000	1	120.1177	0.123	7	120.3404	1.530	27	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[3x6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[3x6]C[4,6,6]C[3x6])(C[6]C[6]H)(H)	C[6](C[6]C[3x6]H)(C[6]N[6]C)(H)	H(C[6]C[3x6]C[6])	C[6](C[3x6]C[4,6,6]C[3x6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,4|C<4>}	C[6](C[6]C[3x6]H)(C[6]N[6]C)(H){1|Mn<5>,1|C<3>,1|C<4>}	H(C[6]C[3x6]C[6])	120.2545	0.113	4	120.2545	0.013	4	120.3404	1.530	27	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[3x6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[3x6]C[4,6,6]C[3x6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[3x6]H)(H)	H(C[6]C[3x6]C[6])	C[6](C[3x6]C[4,6,6]C[3x6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>,3|C<4>}	C[6](C[6]C[6]N[6])(C[6]C[3x6]H)(H){1|Mn<5>,1|C<4>,1|N<3>,2|C<3>}	H(C[6]C[3x6]C[6])	120.1520	0.541	3	120.2218	0.788	10	120.3404	1.530	27	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[3x6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[3x6]C[4,6,6]C[3x6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[3x6]H)(H)	H(C[6]C[3x6]C[6])	C[6](C[3x6]C[4,6,6]C[3x6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>,3|C<4>}	C[6](C[6]C[6]N[6])(C[6]C[3x6]H)(H){1|Mn<6>,1|C<4>,1|N<3>,2|C<3>}	H(C[6]C[3x6]C[6])	120.5545	0.018	2	120.2218	0.788	10	120.3404	1.530	27	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[3x6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[3x6]C[4,6,6]C[3x6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[3x6]H)(H)	H(C[6]C[3x6]C[6])	C[6](C[3x6]C[4,6,6]C[3x6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>,3|C<4>}	C[6](C[6]C[6]N[6])(C[6]C[3x6]H)(H){1|Re<6>,1|C<4>,1|N<3>,2|C<3>}	H(C[6]C[3x6]C[6])	120.1306	1.248	5	120.2218	0.788	10	120.3404	1.530	27	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[3x6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[3x6]C[5,3x6]C[3x6])(C[6]C[6]H)(H)	C[6](C[6]C[3x6]H)(C[6]C[6]H)(H)	H(C[6]C[3x6]C[6])	C[6](C[3x6]C[5,3x6]C[3x6])(C[6]C[6]H)(H){1|C<2>,1|H<1>,2|C<3>,2|C<4>}	C[6](C[6]C[3x6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>}	H(C[6]C[3x6]C[6])	125.6160	0.000	1	125.6160	0.000	1	120.3404	1.530	27	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[3x6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[3x6]C[5,3x6]C[6,6])(C[6]C[6]H)(H)	C[6](C[6]C[3x6]H)(C[6]C[5,6]O)(H)	H(C[6]C[3x6]C[6])	C[6](C[3x6]C[5,3x6]C[6,6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>,1|O<2>,3|C<4>}	C[6](C[6]C[3x6]H)(C[6]C[5,6]O)(H){1|H<1>,1|O<2>,2|C<4>}	H(C[6]C[3x6]C[6])	120.5140	0.000	1	120.5140	0.000	1	120.3404	1.530	27	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[3x6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[3x6]N[3x6]P[3x6])(C[6]C[6]H)(H)	C[6](C[6]C[3x6]H)(C[6]C[6]H)(H)	H(C[6]C[3x6]C[6])	C[6](C[3x6]N[3x6]P[3x6])(C[6]C[6]H)(H){1|As<3>,1|H<1>,3|C<3>}	C[6](C[6]C[3x6]H)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|P<3>}	H(C[6]C[3x6]C[6])	120.1710	0.038	3	120.1710	0.001	3	120.3404	1.530	27	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[3x6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[3x6]Si[6,6]C[5x6])(C[6]C[6]H)(H)	C[6](C[6]C[3x6]H)(C[6]C[6,6]H)(H)	H(C[6]C[3x6]C[6])	C[6](C[3x6]Si[6,6]C[5x6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,5|C<4>}	C[6](C[6]C[3x6]H)(C[6]C[6,6]H)(H){1|Si<4>,1|H<1>,2|C<4>}	H(C[6]C[3x6]C[6])	118.4870	0.000	1	118.4870	0.000	1	120.3404	1.530	27	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[3x6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[3x6]C[3x6]2)(C[6]C[6]O)(H)	C[6](C[6]C[3x6]H)(C[6]C[6]O)(O)	H(C[6]C[3x6]C[6])	C[6](C[3x6]C[3x6]2)(C[6]C[6]O)(H){1|C<4>,1|H<1>,1|O<1>,3|C<3>}	C[6](C[6]C[3x6]H)(C[6]C[6]O)(O){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[3x6]C[6])	120.1407	0.125	4	120.0099	1.437	8	119.8456	1.500	9	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[3x6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[3x6]C[3x6]2)(C[6]C[6]O)(H)	C[6](C[6]C[3x6]H)(C[6]C[6]O)(O)	H(C[6]C[3x6]C[6])	C[6](C[3x6]C[3x6]2)(C[6]C[6]O)(H){1|O<1>,2|C<4>,3|C<3>}	C[6](C[6]C[3x6]H)(C[6]C[6]O)(O){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[3x6]C[6])	119.8790	1.814	4	120.0099	1.437	8	119.8456	1.500	9	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[3x6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[3x6]C[3x6]C[6,6])(C[6]C[6]O)(H)	C[6](C[6]C[3x6]H)(C[6]C[6]O)(O)	H(C[6]C[3x6]C[6])	C[6](C[3x6]C[3x6]C[6,6])(C[6]C[6]O)(H){1|H<1>,1|N<3>,1|O<2>,2|C<3>,2|C<4>}	C[6](C[6]C[3x6]H)(C[6]C[6]O)(O){1|H<1>,2|C<4>}	H(C[6]C[3x6]C[6])	118.5310	0.000	1	118.5310	0.000	1	119.8456	1.500	9	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[4,6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[4,6]C[4,4]N[4,6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[4,6]H)(H)	H(C[6]C[4,6]C[6])	C[6](C[4,6]C[4,4]N[4,6])(C[6]C[6,6a]H)(H){2|Ge<3>,1|P<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[4,6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[4,6]C[6])	120.5370	0.006	2	120.5370	0.000	2	120.5370	0.000	2	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[4,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[4,6]C[4,6]C[4])(C[6]C[6]H)(H)	C[6](C[6]C[4,6]H)(C[6]C[6]H)(H)	H(C[6]C[4,6]C[6])	C[6](C[4,6]C[4,6]C[4])(C[6]C[6]H)(H){1|C<3>,2|C<4>,3|H<1>}	C[6](C[6]C[4,6]H)(C[6]C[6]H)(H){2|C<4>,2|H<1>}	H(C[6]C[4,6]C[6])	121.0430	0.000	1	121.0430	0.000	1	121.4003	0.298	15	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[4,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[4,6]N[4,6]C[4])(C[6]C[6]H)(H)	C[6](C[6]C[4,6]H)(C[6]C[6]H)(H)	H(C[6]C[4,6]C[6])	C[6](C[4,6]N[4,6]C[4])(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|P<4>,2|H<1>}	C[6](C[6]C[4,6]H)(C[6]C[6]H)(H){1|N<3>,2|C<4>}	H(C[6]C[4,6]C[6])	121.6195	0.083	2	121.6403	0.005	3	121.4003	0.298	15	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[4,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[4,6]N[4,6]C[4])(C[6]C[6]H)(H)	C[6](C[6]C[4,6]H)(C[6]C[6]H)(H)	H(C[6]C[4,6]C[6])	C[6](C[4,6]N[4,6]C[4])(C[6]C[6]H)(H){1|Si<4>,1|C<3>,3|H<1>}	C[6](C[6]C[4,6]H)(C[6]C[6]H)(H){1|N<3>,2|C<4>}	H(C[6]C[4,6]C[6])	121.6820	0.000	1	121.6403	0.005	3	121.4003	0.298	15	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[4,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[4,6]N[4,6]N[4])(C[6]C[6]H)(H)	C[6](C[6]C[4,6]H)(C[6]C[6]H)(H)	H(C[6]C[4,6]C[6])	C[6](C[4,6]N[4,6]N[4])(C[6]C[6]H)(H){1|Ge<3>,1|H<1>,2|C<3>}	C[6](C[6]C[4,6]H)(C[6]C[6]H)(H){1|C<4>,2|N<3>}	H(C[6]C[4,6]C[6])	121.6015	0.228	2	121.9530	0.118	5	121.4003	0.298	15	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[4,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[4,6]N[4,6]N[4])(C[6]C[6]H)(H)	C[6](C[6]C[4,6]H)(C[6]C[6]H)(H)	H(C[6]C[4,6]C[6])	C[6](C[4,6]N[4,6]N[4])(C[6]C[6]H)(H){1|Si<4>,1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[4,6]H)(C[6]C[6]H)(H){1|C<4>,2|N<3>}	H(C[6]C[4,6]C[6])	122.2600	0.000	1	121.9530	0.118	5	121.4003	0.298	15	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[4,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[4,6]N[4,6]N[4])(C[6]C[6]H)(H)	C[6](C[6]C[4,6]H)(C[6]C[6]H)(H)	H(C[6]C[4,6]C[6])	C[6](C[4,6]N[4,6]N[4])(C[6]C[6]H)(H){1|Si<4>,1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[4,6]H)(C[6]C[6]H)(H){3|N<3>}	H(C[6]C[4,6]C[6])	122.1510	0.044	2	121.9530	0.118	5	121.4003	0.298	15	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[4,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[4,6]N[4,6]S[4])(C[6]C[6]H)(H)	C[6](C[6]C[4,6]H)(C[6]C[6]H)(H)	H(C[6]C[4,6]C[6])	C[6](C[4,6]N[4,6]S[4])(C[6]C[6]H)(H){1|Si<5>,1|C<3>,1|H<1>}	C[6](C[6]C[4,6]H)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[4,6]C[6])	120.8683	0.172	4	120.8792	0.048	6	121.4003	0.298	15	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[4,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[4,6]N[4,6]S[4])(C[6]C[6]H)(H)	C[6](C[6]C[4,6]H)(C[6]C[6]H)(H)	H(C[6]C[4,6]C[6])	C[6](C[4,6]N[4,6]S[4])(C[6]C[6]H)(H){1|Si<6>,1|C<3>,1|H<1>}	C[6](C[6]C[4,6]H)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[4,6]C[6])	120.9010	0.385	2	120.8792	0.048	6	121.4003	0.298	15	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[4,6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[4,6]C[4,6]Si[4])(C[6]N[5,6]H)(H)	C[6](N[5,6]C[5,6]Si[5])(C[6]C[4,6]H)(H)	H(C[6]C[4,6]C[6])	C[6](C[4,6]C[4,6]Si[4])(C[6]N[5,6]H)(H){2|Si<4>,1|C<3>,2|C<4>}	C[6](N[5,6]C[5,6]Si[5])(C[6]C[4,6]H)(H){1|Si<4>,1|N<3>,2|C<3>,2|C<4>}	H(C[6]C[4,6]C[6])	118.7200	0.000	1	118.7200	0.000	1	118.7200	0.000	1	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6,6]C[5,5,6,6]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6,6]C[6])	C[6](C[5,6,6]C[5,5,6,6]C[5,6])(C[6]C[6]H)(H){1|H<1>,2|C<4>,3|C<3>}	C[6](C[6]C[5,6,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[5,6,6]C[6])	120.5710	0.000	1	120.5710	0.000	1	120.5710	0.000	1	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[3x6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5])(C[6]C[3x6]H)(H)	C[6](C[3x6]C[4x6]C[6,6])(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5])(C[6]C[3x6]H)(H){1|H<1>,1|O<1>,4|C<4>}	C[6](C[3x6]C[4x6]C[6,6])(C[6]C[5,6]H)(H){1|O<2>,2|C<3>,4|C<4>}	H(C[6]C[5,6]C[6])	120.3370	0.000	1	120.3370	0.000	1	120.3370	0.000	1	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5])(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,6]C[5])(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5])(C[6]C[5,6]H)(H){3|H<1>,4|C<4>}	C[6](C[5,6]C[5,6]C[5])(C[6]C[5,6]H)(H){3|H<1>,4|C<4>}	H(C[6]C[5,6]C[6])	120.4730	0.553	8	120.4730	0.305	8	120.2877	0.163	20	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6a]C[5,6])(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,6a]N[5,6])(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6a]C[5,6])(C[6]C[5,6]H)(H){1|C<4>,1|H<1>,1|N<3>,3|C<3>}	C[6](C[5,6]C[5,6a]N[5,6])(C[6]C[5,6]H)(H){1|C<4>,4|C<3>}	H(C[6]C[5,6]C[6])	119.9460	0.062	2	119.9957	0.008	6	120.2877	0.163	20	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6a]C[5,6])(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,6a]N[5,6])(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6a]C[5,6])(C[6]C[5,6]H)(H){1|C<4>,1|N<3>,4|C<3>}	C[6](C[5,6]C[5,6a]N[5,6])(C[6]C[5,6]H)(H){1|C<4>,4|C<3>}	H(C[6]C[5,6]C[6])	119.9897	0.090	3	119.9957	0.008	6	120.2877	0.163	20	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6a]C[5,6])(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,6a]N[5,6])(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6a]C[5,6])(C[6]C[5,6]H)(H){1|N<3>,2|C<4>,3|C<3>}	C[6](C[5,6]C[5,6a]N[5,6])(C[6]C[5,6]H)(H){1|C<4>,4|C<3>}	H(C[6]C[5,6]C[6])	120.1130	0.000	1	119.9957	0.008	6	120.2877	0.163	20	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6a]N[5,6])(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,6a]C[5,6])(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6a]N[5,6])(C[6]C[5,6]H)(H){1|C<4>,4|C<3>}	C[6](C[5,6]C[5,6a]C[5,6])(C[6]C[5,6]H)(H){1|C<4>,1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[5,6]C[6])	120.1275	0.043	2	120.3327	0.026	6	120.2877	0.163	20	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6a]N[5,6])(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,6a]C[5,6])(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6a]N[5,6])(C[6]C[5,6]H)(H){1|C<4>,4|C<3>}	C[6](C[5,6]C[5,6a]C[5,6])(C[6]C[5,6]H)(H){1|C<4>,1|N<3>,4|C<3>}	H(C[6]C[5,6]C[6])	120.4247	0.018	3	120.3327	0.026	6	120.2877	0.163	20	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6a]N[5,6])(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,6a]C[5,6])(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6a]N[5,6])(C[6]C[5,6]H)(H){1|C<4>,4|C<3>}	C[6](C[5,6]C[5,6a]C[5,6])(C[6]C[5,6]H)(H){1|N<3>,2|C<4>,3|C<3>}	H(C[6]C[5,6]C[6])	120.4670	0.000	1	120.3327	0.026	6	120.2877	0.163	20	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[5,6]C[5,6,6]C[5])(C[6]C[5,6]O)(H)	C[6](C[5,6]C[5,6,6]C[5])(C[6]C[5,6]H)(O)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6,6]C[5])(C[6]C[5,6]O)(H){1|C<4>,1|O<2>,2|H<1>,3|C<3>}	C[6](C[5,6]C[5,6,6]C[5])(C[6]C[5,6]H)(O){2|C<3>,2|C<4>,2|H<1>}	H(C[6]C[5,6]C[6])	118.5965	0.011	2	118.5965	0.000	2	118.5965	0.000	2	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]C[5])(C[6]C[5a,6]H)(H)	C[6](C[5a,6]N[5a,6]C[5a])(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]C[5])(C[6]C[5a,6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6](C[5a,6]N[5a,6]C[5a])(C[6]C[5,6]H)(H){1|H<1>,2|C<3>,2|N<3>}	H(C[6]C[5,6]C[6])	119.5085	0.339	2	119.5085	0.115	2	119.5085	0.115	2	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[5,6]C[5,6,6]O[5])(C[6]C[6,6]O)(H)	C[6](C[6,6]C[3x6]C[6])(C[6]C[5,6]H)(O)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6,6]O[5])(C[6]C[6,6]O)(H){1|C<3>,2|C<4>,2|O<2>}	C[6](C[6,6]C[3x6]C[6])(C[6]C[5,6]H)(O){1|O<2>,2|H<1>,3|C<4>}	H(C[6]C[5,6]C[6])	120.8150	0.000	1	120.8150	0.000	1	120.8150	0.000	1	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,5,6]C[5])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,5,6]C[5])(C[6]C[6,6a]H)(H){1|H<1>,2|C<4>,3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H){1|C<4>,1|H<1>,3|C<3>}	H(C[6]C[5,6]C[6])	120.2340	0.000	1	120.2340	0.000	1	120.5425	1.146	25	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]N[5,6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]N[5,6])(C[6]C[6,6a]H)(H){1|C<4>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[5,6]C[6])	119.5520	0.082	2	119.5520	0.007	2	120.5425	1.146	25	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6a]N[5,6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6a]N[5,6])(C[6]C[6,6a]H)(H){1|B<4>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[5,6]C[6])	120.1730	0.263	5	120.1730	0.069	5	120.5425	1.146	25	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,5]N[5,6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,5]N[5,6])(C[6]C[6,6a]H)(H){1|N<3>,2|B<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H){1|C<3>,1|C<4>,1|N<2>,2|N<3>}	H(C[6]C[5,6]C[6])	120.9710	0.000	1	120.9710	0.000	1	120.5425	1.146	25	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]2)(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]2)(C[6]C[6,6a]H)(H){1|P<2>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H){1|H<1>,2|C<3>,2|N<3>}	H(C[6]C[5,6]C[6])	123.8700	0.000	1	123.8700	0.000	1	120.5425	1.146	25	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]C[5])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]C[5])(C[6]C[6,6a]H)(H){1|C<4>,1|O<2>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[5,6]C[6])	120.4340	0.000	1	120.3684	0.198	5	120.5425	1.146	25	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]C[5])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]C[5])(C[6]C[6,6a]H)(H){1|In<5>,1|O<1>,1|O<2>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[5,6]C[6])	120.7015	0.545	2	120.3684	0.198	5	120.5425	1.146	25	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]C[5])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]C[5])(C[6]C[6,6a]H)(H){1|Se<2>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[5,6]C[6])	119.9870	0.000	1	120.3684	0.198	5	120.5425	1.146	25	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]C[5])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]C[5])(C[6]C[6,6a]H)(H){2|C<4>,3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H){1|N<3>,1|O<2>,3|C<3>}	H(C[6]C[5,6]C[6])	120.0180	0.000	1	120.3684	0.198	5	120.5425	1.146	25	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]N[5])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]N[5])(C[6]C[6,6a]H)(H){1|Ir<7>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H){1|C<3>,1|C<4>,1|N<2>,2|N<3>}	H(C[6]C[5,6]C[6])	120.7200	0.000	1	120.1300	0.392	4	120.5425	1.146	25	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]N[5])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]N[5])(C[6]C[6,6a]H)(H){1|Ir<8>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H){1|C<3>,1|C<4>,1|N<2>,2|N<3>}	H(C[6]C[5,6]C[6])	120.5700	0.000	1	120.1300	0.392	4	120.5425	1.146	25	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]N[5])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]N[5])(C[6]C[6,6a]H)(H){2|C<3>,2|C<4>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H){1|C<3>,1|C<4>,1|N<3>,2|N<2>}	H(C[6]C[5,6]C[6])	119.6150	0.324	2	120.1300	0.392	4	120.5425	1.146	25	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]O[5])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]O[5])(C[6]C[6,6a]H)(H){1|Si<5>,1|C<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H){1|H<1>,1|N<3>,1|O<2>,2|C<3>}	H(C[6]C[5,6]C[6])	123.4630	0.000	1	123.4630	0.000	1	120.5425	1.146	25	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]P[5])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]P[5])(C[6]C[6,6a]H)(H){1|N<3>,3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H){1|H<1>,1|N<3>,1|P<2>,2|C<3>}	H(C[6]C[5,6]C[6])	121.7110	0.000	1	121.7110	0.000	1	120.5425	1.146	25	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]P[5,6]C[5])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]P[5,6]C[5])(C[6]C[6,6a]H)(H){1|H<1>,1|O<1>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H){1|H<1>,1|P<4>,3|C<3>}	H(C[6]C[5,6]C[6])	120.0830	0.000	1	120.2458	0.057	4	120.5425	1.146	25	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]P[5,6]C[5])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]P[5,6]C[5])(C[6]C[6,6a]H)(H){1|H<1>,1|S<1>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H){1|H<1>,1|P<4>,3|C<3>}	H(C[6]C[5,6]C[6])	120.2090	0.000	1	120.2458	0.057	4	120.5425	1.146	25	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]P[5,6]C[5])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]P[5,6]C[5])(C[6]C[6,6a]H)(H){1|H<1>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H){1|H<1>,1|P<3>,3|C<3>}	H(C[6]C[5,6]C[6])	120.5950	0.000	1	120.2458	0.057	4	120.5425	1.146	25	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]P[5,6]C[5])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]P[5,6]C[5])(C[6]C[6,6a]H)(H){1|Se<1>,1|H<1>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H){1|H<1>,1|P<4>,3|C<3>}	H(C[6]C[5,6]C[6])	120.0960	0.000	1	120.2458	0.057	4	120.5425	1.146	25	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[5,6]C[4,5,6]N[5])(C[6]C[6,6a]O)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(O)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[4,5,6]N[5])(C[6]C[6,6a]O)(H){3|C<3>,3|C<4>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(O){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[5,6]C[6])	119.8260	0.000	1	119.8260	0.000	1	119.8260	0.000	1	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[3,5]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[3,5]C[5,6])(C[6]C[6]H)(H){1|C<2>,2|H<1>,3|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>}	H(C[6]C[5,6]C[6])	121.6130	0.000	1	121.6130	0.000	1	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]C[6a])(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,5,6]C[5])(C[6]C[6]H)(H){1|N<3>,1|O<1>,2|C<3>,2|C<4>}	C[6](C[6]C[5,6]C[6a])(C[6]C[5,6]H)(H){1|O<2>,2|C<4>,3|C<3>}	H(C[6]C[5,6]C[6])	120.7385	0.006	2	120.7385	0.000	2	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]N[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]N[5,6]H)(H){1|C<4>,2|C<3>}	H(C[6]C[5,6]C[6])	120.8760	0.000	1	120.8760	0.000	1	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,5]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,5]C[5,6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,4|C<3>}	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|C<4>}	H(C[6]C[5,6]C[6])	121.3970	0.000	1	121.1155	0.158	2	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,5]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,5]C[5,6])(C[6]C[6]H)(H){1|N<3>,1|N<4>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[5,6]C[6])	120.8340	0.000	1	121.1155	0.158	2	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,5]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]C[6a]N[6])(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,5]C[5,6])(C[6]C[6]H)(H){1|N<3>,5|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[5,6]H)(H){1|Ir<6>,1|C<4>,3|C<3>}	H(C[6]C[5,6]C[6])	121.3300	0.000	1	121.3300	0.000	1	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,5]N[5,6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,5]N[5,6])(C[6]C[6]H)(H){1|In<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[5,6]C[6])	120.4990	0.000	1	119.5048	0.647	4	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,5]N[5,6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,5]N[5,6])(C[6]C[6]H)(H){1|Si<4>,1|C<3>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[5,6]C[6])	119.1733	0.559	3	119.5048	0.647	4	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,5a]N[5,6])(C[6]C[6]H)(H)	C[6](C[6]C[3x3,4,3x5,14x6]C[6])(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,5a]N[5,6])(C[6]C[6]H)(H){1|B<4>,1|C<5>,1|S<2>,2|C<3>}	C[6](C[6]C[3x3,4,3x5,14x6]C[6])(C[6]C[5,6]H)(H){1|C<3>,1|H<1>,1|N<3>,4|B<6>}	H(C[6]C[5,6]C[6])	120.1880	0.000	1	120.1880	0.000	1	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,5a]N[5,6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]C)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,5a]N[5,6])(C[6]C[6]H)(H){1|B<4>,1|C<4>,1|S<2>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[5,6]C[6])	120.3760	0.000	1	120.3760	0.000	1	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,5a]N[5,6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,5a]N[5,6])(C[6]C[6]H)(H){1|B<4>,1|H<1>,1|S<2>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[5,6]C[6])	120.1580	0.000	1	120.7115	0.463	6	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,5a]N[5,6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,5a]N[5,6])(C[6]C[6]H)(H){1|In<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|N<3>,1|P<4>}	H(C[6]C[5,6]C[6])	120.8730	0.794	4	120.7115	0.463	6	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,5a]N[5,6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,5a]N[5,6])(C[6]C[6]H)(H){1|Si<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[5,6]C[6])	120.6190	0.000	1	120.7115	0.463	6	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6,6]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6,6]C[5,6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>,3|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<1>}	H(C[6]C[5,6]C[6])	121.2730	0.000	1	121.2730	0.000	1	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6,6]C[5,6a])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6,6]C[5,6a])(C[6]C[6]H)(H){1|Ru<11>,1|H<1>,2|C<3>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6,6]H)(H){1|Ru<11>,1|C<3>,2|C<4>}	H(C[6]C[5,6]C[6])	120.8230	0.000	1	120.8230	0.000	1	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6,6]C[5])(C[6]C[6]H)(H){1|O<2>,2|C<4>,4|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6,6]H)(H){4|C<4>}	H(C[6]C[5,6]C[6])	121.2650	0.000	1	121.2650	0.000	1	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6,6]N[5,6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6,6]N[5,6])(C[6]C[6]H)(H){1|Ge<3>,1|C<3>,1|H<1>,1|N<3>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[5,6]C[6])	120.3690	0.000	1	120.5415	0.060	2	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6,6]N[5,6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6,6]N[5,6])(C[6]C[6]H)(H){1|Ge<3>,1|C<3>,1|H<1>,1|N<4>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[5,6]C[6])	120.7140	0.000	1	120.5415	0.060	2	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6,6a]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]O)(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6,6a]C[5])(C[6]C[6]H)(H){1|C<4>,1|O<1>,3|C<3>}	C[6](C[6]C[6,6a]O)(C[6]C[5,6]H)(H){3|C<3>}	H(C[6]C[5,6]C[6])	120.2100	0.389	5	120.2100	0.151	5	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|C<4>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){2|C<3>}	H(C[6]C[5,6]C[6])	123.4220	0.000	1	120.5334	0.740	21	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|C<2>,1|C<4>,1|N<3>,3|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>}	H(C[6]C[5,6]C[6])	119.7580	0.000	1	120.5334	0.740	21	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|C<2>,1|H<1>,1|N<2>,1|O<2>,1|S<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){2|C<3>}	H(C[6]C[5,6]C[6])	121.2780	0.000	1	120.5334	0.740	21	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|C<2>,1|H<1>,2|C<3>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>}	H(C[6]C[5,6]C[6])	118.6580	0.000	1	120.5334	0.740	21	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<2>,3|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<1>}	H(C[6]C[5,6]C[6])	120.7850	0.236	4	120.5334	0.740	21	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|C<3>,2|C<4>,3|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<1>}	H(C[6]C[5,6]C[6])	120.7950	0.000	1	120.5334	0.740	21	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|N<3>,2|C<4>,4|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|H<1>,1|O<2>,2|C<4>}	H(C[6]C[5,6]C[6])	120.3493	0.189	6	120.5334	0.740	21	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|Os<8>,2|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.9770	0.000	1	120.5334	0.740	21	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|Ru<7>,1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ru<5>,1|Ru<7>,1|C<3>,1|C<4>}	H(C[6]C[5,6]C[6])	120.3480	0.365	2	120.5334	0.740	21	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|Se<4>,1|C<2>,1|H<1>,1|N<3>,1|O<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){2|C<3>}	H(C[6]C[5,6]C[6])	120.1490	0.000	1	120.5334	0.740	21	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|Si<4>,1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[5,6]C[6])	120.0150	0.000	1	120.5334	0.740	21	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|Si<4>,1|O<2>,2|C<3>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[5,6]C[6])	120.2170	0.000	1	120.5334	0.740	21	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]N[6]C)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]N[6]C)(H){1|Co<5>,1|C<3>,1|C<4>}	H(C[6]C[5,6]C[6])	120.2120	0.000	1	120.2120	0.000	1	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]N[6]Cl)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|Cl<1>,1|N<3>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]N[6]Cl)(H){1|Al<5>,1|C<3>,1|C<4>}	H(C[6]C[5,6]C[6])	120.9830	0.000	1	120.9830	0.000	1	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|B<3>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Ru<6>,2|C<3>}	H(C[6]C[5,6]C[6])	120.9650	0.300	2	120.9643	0.701	79	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>,3|H<1>}	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|C<4>}	H(C[6]C[5,6]C[6])	121.4600	0.116	2	120.9643	0.701	79	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Cu<4>,2|C<3>}	H(C[6]C[5,6]C[6])	120.8910	0.323	6	120.9643	0.701	79	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Rh<4>,2|C<3>}	H(C[6]C[5,6]C[6])	121.0080	0.277	2	120.9643	0.701	79	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Rh<6>,2|C<3>}	H(C[6]C[5,6]C[6])	121.2067	0.172	4	120.9643	0.701	79	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Ru<8>,2|C<3>}	H(C[6]C[5,6]C[6])	120.7807	0.189	6	120.9643	0.701	79	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Ru<8>,1|C<3>,1|C<4>}	H(C[6]C[5,6]C[6])	121.3785	0.040	2	120.9643	0.701	79	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|C<4>,2|N<3>,3|H<1>}	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|C<4>}	H(C[6]C[5,6]C[6])	120.8730	0.000	1	120.9643	0.701	79	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Ag<4>,2|C<3>}	H(C[6]C[5,6]C[6])	121.7785	0.067	2	120.9643	0.701	79	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|C<4>,2|C<3>}	H(C[6]C[5,6]C[6])	121.1440	0.221	2	120.9643	0.701	79	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Co<6>,2|C<3>}	H(C[6]C[5,6]C[6])	119.9008	2.204	8	120.9643	0.701	79	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[5,6]C[6])	120.9340	0.000	1	120.9643	0.701	79	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Ni<6>,2|C<3>}	H(C[6]C[5,6]C[6])	120.6660	0.906	3	120.9643	0.701	79	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Pd<4>,2|C<3>}	H(C[6]C[5,6]C[6])	121.4960	0.172	5	120.9643	0.701	79	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Ru<6>,2|C<3>}	H(C[6]C[5,6]C[6])	121.5260	0.000	1	120.9643	0.701	79	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Zn<6>,2|C<3>}	H(C[6]C[5,6]C[6])	121.4610	0.151	2	120.9643	0.701	79	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|C<4>}	H(C[6]C[5,6]C[6])	121.3245	0.278	2	120.9643	0.701	79	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|C<4>}	H(C[6]C[5,6]C[6])	121.2550	0.000	1	120.9643	0.701	79	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Cu<3>,2|C<3>}	H(C[6]C[5,6]C[6])	120.9305	0.121	2	120.9643	0.701	79	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Cu<4>,2|C<3>}	H(C[6]C[5,6]C[6])	121.2335	0.390	4	120.9643	0.701	79	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[5,6]C[6])	120.6490	0.000	1	120.9643	0.701	79	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Ni<6>,2|C<3>}	H(C[6]C[5,6]C[6])	121.0755	0.122	2	120.9643	0.701	79	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Rh<6>,2|C<3>}	H(C[6]C[5,6]C[6])	121.0683	0.309	4	120.9643	0.701	79	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Ru<6>,2|C<3>}	H(C[6]C[5,6]C[6])	120.6722	0.304	4	120.9643	0.701	79	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Zn<4>,2|C<3>}	H(C[6]C[5,6]C[6])	120.4975	0.081	2	120.9643	0.701	79	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|N<3>,2|C<3>,3|H<1>}	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|C<4>}	H(C[6]C[5,6]C[6])	121.0455	0.033	2	120.9643	0.701	79	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|N<3>,2|C<3>,3|H<1>}	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|C<4>}	H(C[6]C[5,6]C[6])	121.5780	0.099	2	120.9643	0.701	79	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|Pd<4>,1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|C<4>}	H(C[6]C[5,6]C[6])	121.2230	0.000	1	120.9643	0.701	79	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|Rh<4>,1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Rh<4>,1|C<3>,1|C<4>}	H(C[6]C[5,6]C[6])	120.7750	0.000	1	120.9643	0.701	79	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|Ru<8>,1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Ru<8>,1|C<3>,1|C<4>}	H(C[6]C[5,6]C[6])	121.1055	0.110	2	120.9643	0.701	79	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]N[6]O)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|C<4>,1|O<2>,2|H<1>,2|N<3>}	C[6](C[6]C[5,6]H)(C[6]N[6]O)(H){1|Cu<4>,1|C<3>,1|C<4>}	H(C[6]C[5,6]C[6])	120.2480	0.000	1	120.2480	0.000	1	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[6a]N[6])(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[5,6]H)(H){1|Pt<4>,4|C<3>}	H(C[6]C[5,6]C[6])	120.3725	0.103	2	120.7840	0.230	4	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[6a]N[6])(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|N<3>,2|H<1>,3|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[5,6]H)(H){1|Pt<4>,1|C<4>,3|C<3>}	H(C[6]C[5,6]C[6])	121.1955	0.028	2	120.7840	0.230	4	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]N[5,5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]C)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]N[5,5])(C[6]C[6]H)(H){1|Nb<6>,1|P<4>,3|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[5,6]C[6])	120.2450	0.000	1	120.2450	0.000	1	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]N[5,6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]C)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]N[5,6])(C[6]C[6]H)(H){1|In<6>,1|C<4>,1|N<3>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[5,6]C[6])	120.4103	0.143	6	120.4103	0.020	6	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]N[5,6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]N[5,6])(C[6]C[6]H)(H){1|Ga<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[5,6]C[6])	120.2930	0.066	2	120.5880	0.112	76	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]N[5,6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]N[5,6])(C[6]C[6]H)(H){1|Ga<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|N<3>,1|P<3>}	H(C[6]C[5,6]C[6])	120.5405	0.336	2	120.5880	0.112	76	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]N[5,6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]N[5,6])(C[6]C[6]H)(H){1|Ga<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|N<3>,2|C<3>}	H(C[6]C[5,6]C[6])	120.2220	0.164	2	120.5880	0.112	76	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]N[5,6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]N[5,6])(C[6]C[6]H)(H){1|Ga<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[5,6]C[6])	120.7862	0.176	4	120.5880	0.112	76	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]N[5,6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]N[5,6])(C[6]C[6]H)(H){1|Ga<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|N<3>,1|P<4>}	H(C[6]C[5,6]C[6])	121.2730	0.110	2	120.5880	0.112	76	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]N[5,6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]N[5,6])(C[6]C[6]H)(H){1|Ga<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[5,6]C[6])	120.5717	0.385	32	120.5880	0.112	76	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]N[5,6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]N[5,6])(C[6]C[6]H)(H){1|Ge<2>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[5,6]C[6])	120.4895	0.187	2	120.5880	0.112	76	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]N[5,6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]N[5,6])(C[6]C[6]H)(H){1|Ge<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[5,6]C[6])	120.7800	0.192	2	120.5880	0.112	76	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]N[5,6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]N[5,6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|P<6>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[5,6]C[6])	120.9620	0.195	2	120.5880	0.112	76	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]N[5,6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]N[5,6])(C[6]C[6]H)(H){1|In<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|N<3>,1|P<3>}	H(C[6]C[5,6]C[6])	120.5250	0.417	2	120.5880	0.112	76	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]N[5,6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]N[5,6])(C[6]C[6]H)(H){1|In<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[5,6]C[6])	120.4135	0.179	4	120.5880	0.112	76	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]N[5,6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]N[5,6])(C[6]C[6]H)(H){1|In<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|N<3>,1|P<4>}	H(C[6]C[5,6]C[6])	121.0810	0.000	1	120.5880	0.112	76	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]N[5,6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]N[5,6])(C[6]C[6]H)(H){1|Nb<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[5,6]C[6])	120.5380	0.031	2	120.5880	0.112	76	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]N[5,6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]N[5,6])(C[6]C[6]H)(H){1|Si<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[5,6]C[6])	120.7837	0.186	4	120.5880	0.112	76	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]N[5,6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]N[5,6])(C[6]C[6]H)(H){1|Si<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[5,6]C[6])	120.4717	0.201	13	120.5880	0.112	76	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]N[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]N[5])(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|C<4>,1|H<1>,1|S<2>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|N<3>}	H(C[6]C[5,6]C[6])	119.1110	0.000	1	120.7545	5.402	2	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]N[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]N[5])(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|N<3>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|N<3>}	H(C[6]C[5,6]C[6])	122.3980	0.000	1	120.7545	5.402	2	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]N[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]I)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]N[5])(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|C<4>,1|H<1>,1|I<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]I)(H){1|C<3>,1|N<3>}	H(C[6]C[5,6]C[6])	121.0060	0.000	1	121.0060	0.000	1	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]N[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]N[5])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<1>,1|O<2>}	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[5,6]C[6])	120.9980	0.000	1	120.9980	0.000	1	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]N[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]N[5])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>,1|P<4>}	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|N<2>}	H(C[6]C[5,6]C[6])	121.3180	0.056	3	121.5780	0.136	6	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]N[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]N[5])(C[6]C[6]H)(H){1|N<3>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[5,6]C[6])	121.8380	0.365	3	121.5780	0.136	6	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]O[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]O[5])(C[6]C[6]H)(H){1|O<2>,3|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|C<3>,1|O<2>,2|H<1>}	H(C[6]C[5,6]C[6])	121.9480	0.000	1	121.9480	0.000	1	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]S[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]S[5])(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|S<2>}	H(C[6]C[5,6]C[6])	127.4220	2.576	3	127.4220	6.634	3	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6a]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6a]C[5,6])(C[6]C[6]H)(H){1|B<4>,1|C<2>,1|H<1>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){2|C<3>}	H(C[6]C[5,6]C[6])	120.3530	0.000	1	121.2023	0.544	3	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6a]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6a]C[5,6])(C[6]C[6]H)(H){1|Os<6>,1|H<1>,2|C<3>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Os<5>,1|Os<6>,1|C<3>,1|C<4>}	H(C[6]C[5,6]C[6])	121.6270	0.081	2	121.2023	0.544	3	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6a]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]S[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6a]C[5,6])(C[6]C[6]H)(H){1|H<1>,1|S<2>,3|C<3>}	C[6](C[6]C[5,6]H)(C[6]S[6]H)(H){2|C<3>}	H(C[6]C[5,6]C[6])	119.6240	0.942	2	119.6240	0.887	2	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6a]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]Se[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6a]C[5,6])(C[6]C[6]H)(H){1|Se<2>,1|H<1>,3|C<3>}	C[6](C[6]C[5,6]H)(C[6]Se[6]H)(H){2|C<3>}	H(C[6]C[5,6]C[6])	114.8260	0.000	1	114.8260	0.000	1	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6a]N[5,6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]B)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6a]N[5,6])(C[6]C[6]H)(H){1|B<3>,1|B<4>,3|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]B)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[5,6]C[6])	120.5600	0.165	2	120.5600	0.027	2	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6a]N[5,6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]C)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6a]N[5,6])(C[6]C[6]H)(H){1|B<4>,4|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[5,6]C[6])	120.3090	0.000	1	120.3090	0.000	1	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6a]N[5,6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6a]N[5,6])(C[6]C[6]H)(H){1|B<4>,1|H<1>,3|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[5,6]C[6])	120.5078	0.180	10	120.5398	0.032	12	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6a]N[5,6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6a]N[5,6])(C[6]C[6]H)(H){1|B<4>,1|H<1>,3|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,2|N<3>}	H(C[6]C[5,6]C[6])	120.6710	0.000	1	120.5398	0.032	12	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6a]N[5,6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6a]N[5,6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,3|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[5,6]C[6])	120.7280	0.000	1	120.5398	0.032	12	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6a]N[5,6])(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6])(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6a]N[5,6])(C[6]C[6]H)(H){1|B<4>,4|C<3>}	C[6](C[6]C[6a]C[6])(C[6]C[5,6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[5,6]C[6])	120.2280	0.000	1	120.2280	0.000	1	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,5,6]C[5,5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)2(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,5,6]C[5,5])(C[6]C[6]H)(H){1|Ga<5>,1|C<3>,1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]C[5,6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[5,6]C[6])	120.9605	0.213	2	120.9385	0.021	6	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,5,6]C[5,5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)2(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,5,6]C[5,5])(C[6]C[6]H)(H){1|Ga<5>,1|C<3>,1|H<1>,2|N<3>}	C[6](C[6]C[5,6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[5,6]C[6])	120.9275	0.137	4	120.9385	0.021	6	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,5,6]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)2(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,5,6]C[5,6])(C[6]C[6]H)(H){1|Ga<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[5,6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[5,6]C[6])	120.8257	0.238	3	120.8026	0.053	16	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,5,6]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)2(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,5,6]C[5,6])(C[6]C[6]H)(H){1|Ga<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[5,6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[5,6]C[6])	120.8280	0.097	5	120.8026	0.053	16	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,5,6]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)2(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,5,6]C[5,6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|P<6>,2|C<3>}	C[6](C[6]C[5,6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[5,6]C[6])	120.7950	0.103	2	120.8026	0.053	16	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,5,6]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)2(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,5,6]C[5,6])(C[6]C[6]H)(H){1|In<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[5,6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[5,6]C[6])	120.4610	0.382	2	120.8026	0.053	16	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,5,6]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)2(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,5,6]C[5,6])(C[6]C[6]H)(H){1|In<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[5,6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[5,6]C[6])	120.9280	0.247	4	120.8026	0.053	16	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)2(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,5,6]C[5])(C[6]C[6]H)(H){1|C<3>,1|N<3>,1|S<3>,2|H<1>}	C[6](C[6]C[5,6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[5,6]C[6])	120.2540	0.000	1	120.4165	0.336	15	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)2(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,5,6]C[5])(C[6]C[6]H)(H){1|Ga<6>,1|C<3>,1|H<1>,1|O<1>,1|O<2>}	C[6](C[6]C[5,6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[5,6]C[6])	121.0220	0.182	2	120.4165	0.336	15	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)2(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,5,6]C[5])(C[6]C[6]H)(H){1|Ga<6>,1|C<3>,1|N<3>,3|H<1>}	C[6](C[6]C[5,6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[5,6]C[6])	120.8910	0.000	1	120.4165	0.336	15	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)2(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,5,6]C[5])(C[6]C[6]H)(H){1|Ga<6>,1|C<3>,1|N<4>,3|H<1>}	C[6](C[6]C[5,6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[5,6]C[6])	120.7610	0.000	1	120.4165	0.336	15	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)2(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|P<3>,2|C<3>}	C[6](C[6]C[5,6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[5,6]C[6])	119.5215	0.025	2	120.4165	0.336	15	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)2(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,5,6]C[5])(C[6]C[6]H)(H){1|In<7>,1|C<3>,1|H<1>,1|O<1>,1|O<2>}	C[6](C[6]C[5,6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[5,6]C[6])	120.4068	0.530	8	120.4165	0.336	15	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6,6]C[5])(C[6]C[6]H)(H){1|C<3>,2|C<4>,3|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6,6]H)(H){1|N<3>,2|C<4>}	H(C[6]C[5,6]C[6])	120.8640	0.000	1	120.8640	0.000	1	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]2)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]2)(C[6]C[6]H)(H){1|H<1>,1|P<2>,3|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	H(C[6]C[5,6]C[6])	120.9840	0.000	2	121.0847	0.030	3	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]2)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]2)(C[6]C[6]H)(H){1|H<1>,1|P<6>,3|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	H(C[6]C[5,6]C[6])	121.2860	0.000	1	121.0847	0.030	3	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]C)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|In<6>,1|O<1>,1|O<2>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[5,6]C[6])	120.5910	0.000	1	120.5910	0.000	1	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|B<3>,1|H<1>,3|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[5,6]C[6])	119.0690	0.000	1	120.4010	0.160	131	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|C<4>,1|O<2>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[5,6]C[6])	120.7887	0.148	4	120.4010	0.160	131	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|C<4>,3|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[5,6]C[6])	120.3190	0.000	1	120.4010	0.160	131	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>,1|N<3>,1|O<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[5,6]C[6])	121.2440	0.000	1	120.4010	0.160	131	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|N<3>,3|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|N<3>,2|C<4>}	H(C[6]C[5,6]C[6])	120.9535	0.153	2	120.4010	0.160	131	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|P<4>,3|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|N<3>,2|C<4>}	H(C[6]C[5,6]C[6])	120.6530	0.000	1	120.4010	0.160	131	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|B<4>,1|C<4>,1|H<1>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[5,6]C[6])	119.4780	0.000	1	120.4010	0.160	131	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|B<4>,1|H<1>,3|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[5,6]C[6])	120.5400	0.092	2	120.4010	0.160	131	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|B<4>,2|C<3>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[5,6]C[6])	120.1258	0.101	5	120.4010	0.160	131	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|B<6>,1|C<3>,1|C<5>,3|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[5,6]C[6])	120.4620	0.000	1	120.4010	0.160	131	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|B<6>,1|C<3>,1|C<6>,3|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[5,6]C[6])	120.2920	0.000	1	120.4010	0.160	131	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[5,6]C[6])	120.6390	0.000	1	120.4010	0.160	131	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|N<3>,2|C<3>}	H(C[6]C[5,6]C[6])	120.5190	0.000	1	120.4010	0.160	131	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>,3|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[5,6]C[6])	120.7260	0.000	1	120.4010	0.160	131	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[5,6]C[6])	120.4270	0.000	1	120.4010	0.160	131	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|C<3>,1|N<3>,1|P<2>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[5,6]C[6])	120.2600	0.000	1	120.4010	0.160	131	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|C<3>,1|N<3>,1|P<2>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|N<3>,2|C<3>}	H(C[6]C[5,6]C[6])	120.0280	0.219	2	120.4010	0.160	131	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|C<3>,1|N<3>,1|P<3>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[5,6]C[6])	119.6740	0.000	1	120.4010	0.160	131	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[5,6]C[6])	119.6830	0.000	1	120.4010	0.160	131	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|C<3>,2|H<1>,3|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[5,6]C[6])	120.1020	0.000	1	120.4010	0.160	131	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[5,6]C[6])	120.4687	0.344	15	120.4010	0.160	131	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<2>,3|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[5,6]C[6])	120.6640	0.000	1	120.4010	0.160	131	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|C<4>,1|H<1>,3|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[5,6]C[6])	120.6460	0.000	1	120.4010	0.160	131	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[5,6]C[6])	121.8120	0.000	1	120.4010	0.160	131	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|Ga<4>,1|B<4>,1|C<3>,1|P<4>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|N<3>,2|C<4>}	H(C[6]C[5,6]C[6])	119.9890	0.000	1	120.4010	0.160	131	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|Ga<4>,1|C<3>,1|C<4>,1|N<3>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[5,6]C[6])	120.5045	0.245	2	120.4010	0.160	131	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|Ga<4>,1|C<3>,1|H<1>,1|O<1>,1|O<2>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[5,6]C[6])	121.5730	0.000	1	120.4010	0.160	131	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|Ga<4>,1|C<3>,1|N<3>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[5,6]C[6])	120.2130	0.000	1	120.4010	0.160	131	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|Ga<4>,1|C<3>,1|P<4>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[5,6]C[6])	119.6220	0.000	1	120.4010	0.160	131	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|Ga<5>,1|C<3>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[5,6]C[6])	120.5060	0.000	1	120.4010	0.160	131	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|Ga<5>,1|C<3>,1|N<3>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[5,6]C[6])	120.1730	0.135	4	120.4010	0.160	131	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|Ga<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[5,6]C[6])	120.3860	0.000	1	120.4010	0.160	131	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|Ga<6>,1|C<3>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[5,6]C[6])	120.1605	0.646	2	120.4010	0.160	131	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|Ga<6>,1|C<3>,1|N<3>,3|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[5,6]C[6])	120.4300	0.000	1	120.4010	0.160	131	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|Ga<6>,1|C<3>,1|N<4>,3|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[5,6]C[6])	120.4490	0.141	5	120.4010	0.160	131	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|Ga<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[5,6]C[6])	120.5680	0.226	2	120.4010	0.160	131	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[5,6]C[6])	120.7332	0.095	4	120.4010	0.160	131	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[5,6]C[6])	120.1543	0.135	10	120.4010	0.160	131	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|O<1>,3|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[5,6]C[6])	120.7845	0.332	4	120.4010	0.160	131	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|O<2>,1|P<4>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[5,6]C[6])	120.0085	0.241	2	120.4010	0.160	131	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|O<2>,4|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[5,6]C[6])	120.6617	0.073	3	120.4010	0.160	131	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[5,6]C[6])	120.4970	0.000	1	120.4010	0.160	131	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|In<4>,1|C<3>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|N<3>,2|C<3>}	H(C[6]C[5,6]C[6])	120.7130	0.000	1	120.4010	0.160	131	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|In<5>,1|C<3>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[5,6]C[6])	120.5630	0.000	1	120.4010	0.160	131	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|In<6>,1|C<3>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[5,6]C[6])	120.3180	0.325	6	120.4010	0.160	131	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|In<6>,1|C<3>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|N<3>,2|C<3>}	H(C[6]C[5,6]C[6])	120.5575	0.086	2	120.4010	0.160	131	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|In<6>,1|C<3>,1|H<1>,1|O<1>,1|O<2>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|N<3>,2|C<3>}	H(C[6]C[5,6]C[6])	120.4803	0.036	3	120.4010	0.160	131	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|In<6>,1|C<3>,1|N<3>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[5,6]C[6])	120.5255	0.074	2	120.4010	0.160	131	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|In<6>,1|C<3>,1|N<4>,3|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[5,6]C[6])	120.5880	0.030	2	120.4010	0.160	131	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|In<6>,1|C<3>,1|O<2>,3|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[5,6]C[6])	120.3835	0.136	2	120.4010	0.160	131	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|In<7>,1|C<3>,1|H<1>,1|O<1>,1|O<2>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[5,6]C[6])	120.4760	0.000	1	120.4010	0.160	131	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|Se<2>,1|H<1>,1|N<2>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[5,6]C[6])	120.7070	0.000	1	120.4010	0.160	131	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|Se<2>,1|H<1>,3|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[5,6]C[6])	119.9240	0.085	2	120.4010	0.160	131	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|Si<4>,1|C<3>,1|N<3>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[5,6]C[6])	119.5545	0.026	2	120.4010	0.160	131	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|Si<4>,1|H<1>,1|O<2>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[5,6]C[6])	119.5300	0.000	1	120.4010	0.160	131	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|Si<5>,1|C<3>,1|C<4>,1|N<3>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[5,6]C[6])	120.3115	0.049	2	120.4010	0.160	131	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|Si<5>,1|C<3>,1|N<3>,3|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[5,6]C[6])	120.5263	0.211	8	120.4010	0.160	131	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){2|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[5,6]C[6])	120.5300	0.000	1	120.4010	0.160	131	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]N[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]C)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]N[5])(C[6]C[6]H)(H){2|C<3>,3|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]C)(H){1|H<1>,2|N<3>}	H(C[6]C[5,6]C[6])	120.9280	0.000	1	120.9280	0.000	1	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]N[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]F)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]N[5])(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|F<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]F)(H){1|H<1>,2|N<3>}	H(C[6]C[5,6]C[6])	120.2820	0.000	1	120.2820	0.000	1	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]N[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]N[5])(C[6]C[6]H)(H){1|C<4>,1|H<1>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[5,6]C[6])	120.3270	0.371	2	121.2338	4.444	15	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]N[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]N[5])(C[6]C[6]H)(H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	H(C[6]C[5,6]C[6])	123.5837	4.433	3	121.2338	4.444	15	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]N[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]N[5])(C[6]C[6]H)(H){1|Co<4>,1|H<1>,3|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	H(C[6]C[5,6]C[6])	120.5350	0.000	1	121.2338	4.444	15	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]N[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]N[5])(C[6]C[6]H)(H){1|Cu<4>,1|H<1>,1|S<2>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<4>,2|N<3>}	H(C[6]C[5,6]C[6])	121.0280	0.033	2	121.2338	4.444	15	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]N[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]N[5])(C[6]C[6]H)(H){1|Cu<4>,1|H<1>,3|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	H(C[6]C[5,6]C[6])	120.6380	0.000	1	121.2338	4.444	15	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]N[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]N[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[5,6]C[6])	120.0050	0.000	1	121.2338	4.444	15	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]N[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]N[5])(C[6]C[6]H)(H){1|In<6>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[5,6]C[6])	120.7690	0.000	1	121.2338	4.444	15	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]N[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]N[5])(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,3|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	H(C[6]C[5,6]C[6])	120.3160	0.000	1	121.2338	4.444	15	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]N[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]N[5])(C[6]C[6]H)(H){1|Pt<5>,1|H<1>,3|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	H(C[6]C[5,6]C[6])	121.0020	0.000	1	121.2338	4.444	15	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]N[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]N[5])(C[6]C[6]H)(H){1|Ru<6>,1|H<1>,3|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	H(C[6]C[5,6]C[6])	120.8905	0.890	2	121.2338	4.444	15	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]N[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]N)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]N[5])(C[6]C[6]H)(H){1|C<3>,1|C<4>,2|N<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]N)(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[5,6]C[6])	120.3740	0.000	1	120.3740	0.000	1	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]O[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]O[5])(C[6]C[6]H)(H){1|Si<4>,1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[5,6]C[6])	120.3070	0.000	1	120.8301	1.765	14	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]O[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]O[5])(C[6]C[6]H)(H){1|Si<5>,1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<4>,1|N<3>,1|O<2>}	H(C[6]C[5,6]C[6])	120.5555	0.168	2	120.8301	1.765	14	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]O[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]O[5])(C[6]C[6]H)(H){1|Si<5>,1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Cl<1>,1|N<3>,1|O<2>}	H(C[6]C[5,6]C[6])	120.4245	0.161	6	120.8301	1.765	14	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]O[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]O[5])(C[6]C[6]H)(H){1|Si<5>,1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[5,6]C[6])	120.4957	0.131	3	120.8301	1.765	14	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]O[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]O[5])(C[6]C[6]H)(H){1|Si<5>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[5,6]C[6])	123.0850	3.292	2	120.8301	1.765	14	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]O[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]Ir)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]O[5])(C[6]C[6]H)(H){1|Ir<8>,1|C<3>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]Ir)(H){1|O<2>,2|N<3>}	H(C[6]C[5,6]C[6])	121.6750	0.000	1	121.6750	0.000	1	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]O[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]N)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]O[5])(C[6]C[6]H)(H){1|Si<5>,1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]N)(H){1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[5,6]C[6])	120.2190	0.007	2	120.2190	0.000	2	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]P[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]P[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>,4|F<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|P<6>}	H(C[6]C[5,6]C[6])	120.1250	0.000	1	119.4747	0.391	6	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]P[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]P[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|P<2>}	H(C[6]C[5,6]C[6])	119.9940	0.000	2	119.4747	0.391	6	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]P[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]P[5])(C[6]C[6]H)(H){1|H<1>,1|P<2>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|P<2>}	H(C[6]C[5,6]C[6])	118.8710	0.000	1	119.4747	0.391	6	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]P[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]P[5])(C[6]C[6]H)(H){1|H<1>,1|P<3>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|P<2>}	H(C[6]C[5,6]C[6])	118.9320	0.195	2	119.4747	0.391	6	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]S[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]S[5])(C[6]C[6]H)(H){1|Ge<2>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[5,6]C[6])	119.7010	0.000	1	119.3400	0.261	2	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]S[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]S[5])(C[6]C[6]H)(H){1|In<6>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[5,6]C[6])	118.9790	0.000	1	119.3400	0.261	2	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]Se[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]Se[5])(C[6]C[6]H)(H){1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Se<2>,1|H<1>,1|N<3>}	H(C[6]C[5,6]C[6])	120.5290	0.000	1	120.5290	0.000	1	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]Si[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]Si[5])(C[6]C[6]H)(H){1|Ga<4>,1|C<3>,1|H<1>,3|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Si<4>,1|H<1>,1|N<3>}	H(C[6]C[5,6]C[6])	119.6997	0.267	3	119.7577	0.053	7	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]Si[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]Si[5])(C[6]C[6]H)(H){1|Ga<5>,1|C<3>,1|H<1>,3|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Si<4>,1|H<1>,1|N<3>}	H(C[6]C[5,6]C[6])	119.7050	0.311	2	119.7577	0.053	7	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]Si[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]Si[5])(C[6]C[6]H)(H){1|In<4>,1|C<3>,1|H<1>,3|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Si<4>,1|H<1>,1|N<3>}	H(C[6]C[5,6]C[6])	119.8975	0.155	2	119.7577	0.053	7	120.6438	0.953	479	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:I-1:	C[6]-3:	C[6](C[5,6]C[5,6a]C[5,6])(C[6]C[6]I)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(I)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6a]C[5,6])(C[6]C[6]I)(H){1|C<4>,1|O<1>,3|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]O)(I){1|H<1>,2|C<3>}	H(C[6]C[5,6]C[6])	120.4100	0.000	1	120.9095	0.499	2	120.9095	0.499	2	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:I-1:	C[6]-3:	C[6](C[5,6]C[5,6a]C[5,6])(C[6]C[6]I)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(I)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6a]C[5,6])(C[6]C[6]I)(H){1|O<2>,2|C<3>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]O)(I){2|C<3>,2|H<1>}	H(C[6]C[5,6]C[6])	121.4090	0.000	1	120.9095	0.499	2	120.9095	0.499	2	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[5,6]C[3,5,6]C[5])(C[6]C[6]O)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(O)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[3,5,6]C[5])(C[6]C[6]O)(H){1|C<3>,1|O<2>,2|C<4>,3|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(O){1|O<2>,2|C<4>}	H(C[6]C[5,6]C[6])	119.6250	0.000	1	119.6250	0.000	1	120.8069	1.217	18	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[5,6]C[5,5,6]C[5,6])(C[6]C[6]O)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(O)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,5,6]C[5,6])(C[6]C[6]O)(H){1|N<2>,1|O<2>,2|C<3>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]O)(O){1|C<3>,1|C<4>,1|O<2>}	H(C[6]C[5,6]C[6])	120.2960	0.000	1	120.3365	0.003	2	120.8069	1.217	18	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[5,6]C[5,5,6]C[5,6])(C[6]C[6]O)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(O)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,5,6]C[5,6])(C[6]C[6]O)(H){1|N<3>,1|O<1>,2|C<3>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]O)(O){1|C<3>,1|C<4>,1|O<2>}	H(C[6]C[5,6]C[6])	120.3770	0.000	1	120.3365	0.003	2	120.8069	1.217	18	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[5,6]C[5,5]C[5,6])(C[6]C[6]O)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]I)(O)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,5]C[5,6])(C[6]C[6]O)(H){1|I<1>,5|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]I)(O){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[5,6]C[6])	120.6160	0.000	1	120.6160	0.000	1	120.8069	1.217	18	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[5,6]C[5,6,6]C[5])(C[6]C[6]O)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(O)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6,6]C[5])(C[6]C[6]O)(H){1|C<4>,1|N<3>,2|C<3>,3|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(O){1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	119.5000	0.000	1	119.5000	0.000	1	120.8069	1.217	18	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[5,6]C[5,6,6]O[5])(C[6]C[6]O)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(O)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6,6]O[5])(C[6]C[6]O)(H){1|C<3>,1|O<2>,3|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]O)(O){1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[5,6]C[6])	120.4550	0.000	1	120.4550	0.000	1	120.8069	1.217	18	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]O)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(O)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|H<1>,1|N<2>,2|O<2>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(O){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[5,6]C[6])	121.0910	0.000	1	121.0910	0.000	1	120.8069	1.217	18	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]O)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(O)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]O)(H){1|N<3>,1|O<1>,2|C<3>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]O)(O){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[5,6]C[6])	120.3360	0.000	1	120.3135	0.001	2	120.8069	1.217	18	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]O)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(O)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]O)(H){1|N<3>,1|O<1>,2|C<3>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]O)(O){1|C<4>,2|C<3>}	H(C[6]C[5,6]C[6])	120.2910	0.000	1	120.3135	0.001	2	120.8069	1.217	18	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[5,6]C[5,6]N[5])(C[6]C[6]O)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(O)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]N[5])(C[6]C[6]O)(H){1|C<4>,1|O<1>,3|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]O)(O){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[5,6]C[6])	120.5590	0.000	1	120.5590	0.000	1	120.8069	1.217	18	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[5,6]C[5,6]O[5])(C[6]C[6]O)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]C)(O)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]O[5])(C[6]C[6]O)(H){1|C<3>,1|O<2>,3|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]C)(O){1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[5,6]C[6])	120.5010	0.000	1	120.9107	0.201	6	120.8069	1.217	18	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[5,6]C[5,6]O[5])(C[6]C[6]O)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]C)(O)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]O[5])(C[6]C[6]O)(H){1|C<4>,4|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]C)(O){1|C<4>,1|O<1>,1|O<2>}	H(C[6]C[5,6]C[6])	120.9926	0.449	5	120.9107	0.201	6	120.8069	1.217	18	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[5,6]C[5,6]O[5])(C[6]C[6]O)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(O)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]O[5])(C[6]C[6]O)(H){1|C<4>,1|O<2>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]O)(O){1|C<3>,1|C<4>,1|O<2>}	H(C[6]C[5,6]C[6])	121.2200	0.000	1	121.2200	0.000	1	120.8069	1.217	18	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[5,6]C[5,6]S[5])(C[6]C[6]O)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(O)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]S[5])(C[6]C[6]O)(H){1|C<2>,1|C<3>,1|O<2>,1|S<2>}	C[6](C[6]C[5,6]H)(C[6]C[6]O)(O){1|C<3>,1|S<2>}	H(C[6]C[5,6]C[6])	124.6940	0.000	1	124.6940	0.000	1	120.8069	1.217	18	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]2)(C[6]N[6]H)(H)	C[6](C[6]C[5,6]H)(N[6]C[6]C)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]2)(C[6]N[6]H)(H){1|C<4>,1|P<4>,3|C<3>}	C[6](C[6]C[5,6]H)(N[6]C[6]C)(H){1|H<1>,2|C<3>}	H(C[6]C[5,6]C[6])	120.9698	0.289	4	120.9698	0.083	4	120.9698	0.083	4	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:O-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5])(C[6]N[6]O)(H)	C[6](C[6]C[5,6]H)(N[6]C[6]C)(O)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5])(C[6]N[6]O)(H){1|C<3>,5|C<4>}	C[6](C[6]C[5,6]H)(N[6]C[6]C)(O){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[5,6]C[6])	119.4530	0.000	1	119.4530	0.000	1	119.4530	0.000	1	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5a,6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5a,6]N[5a,6]C[5a])(C[6]C[5,6]H)(H)	C[6](C[5,6]N[5,6]C[5])(C[6]C[5a,6]H)(H)	H(C[6]C[5a,6]C[6])	C[6](C[5a,6]N[5a,6]C[5a])(C[6]C[5,6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6](C[5,6]N[5,6]C[5])(C[6]C[5a,6]H)(H){1|H<1>,2|C<3>,2|N<3>}	H(C[6]C[5a,6]C[6])	119.7970	0.086	2	119.7970	0.007	2	119.7970	0.007	2	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5a,6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5a,6]C[5,5a]N[5a,6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5a,6]H)(H)	H(C[6]C[5a,6]C[6])	C[6](C[5a,6]C[5,5a]N[5a,6])(C[6]C[6,6a]H)(H){5|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5a,6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[5a,6]C[6])	120.0540	0.000	1	120.0540	0.000	1	120.2067	0.167	7	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5a,6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5a,6]C[5a,5a]N[5a,6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5a,6]H)(H)	H(C[6]C[5a,6]C[6])	C[6](C[5a,6]C[5a,5a]N[5a,6])(C[6]C[6,6a]H)(H){1|B<4>,1|N<2>,1|N<3>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5a,6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[5a,6]C[6])	120.8780	0.000	1	120.8780	0.000	1	120.2067	0.167	7	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5a,6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5a,6]N[5a,6]C[5a])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5a,6]H)(H)	H(C[6]C[5a,6]C[6])	C[6](C[5a,6]N[5a,6]C[5a])(C[6]C[6,6a]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5a,6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[5a,6]C[6])	120.2533	0.086	4	120.1030	0.118	5	120.2067	0.167	7	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5a,6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5a,6]N[5a,6]C[5a])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5a,6]H)(H)	H(C[6]C[5a,6]C[6])	C[6](C[5a,6]N[5a,6]C[5a])(C[6]C[6,6a]H)(H){1|H<1>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5a,6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[5a,6]C[6])	119.5020	0.000	1	120.1030	0.118	5	120.2067	0.167	7	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5a,6]C[5a,5a]N[5a,6])(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H)	H(C[6]C[5a,6]C[6])	C[6](C[5a,6]C[5a,5a]N[5a,6])(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[5a,6]C[6])	121.1955	0.135	2	121.7193	2.618	8	121.0314	0.986	196	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5a,6]C[5a,5a]N[5a,6])(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H)	H(C[6]C[5a,6]C[6])	C[6](C[5a,6]C[5a,5a]N[5a,6])(C[6]C[6]H)(H){1|B<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[5a,6]C[6])	121.8938	1.875	6	121.7193	2.618	8	121.0314	0.986	196	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H)	H(C[6]C[5a,6]C[6])	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H){1|C<2>,1|H<1>,1|S<2>,2|C<3>}	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H){2|C<3>}	H(C[6]C[5a,6]C[6])	123.7440	0.000	1	123.7440	0.000	1	121.0314	0.986	196	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H)	H(C[6]C[5a,6]C[6])	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>,2|N<3>}	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[5a,6]C[6])	120.9070	0.000	1	121.0755	0.243	107	121.0314	0.986	196	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H)	H(C[6]C[5a,6]C[6])	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H){1|C<3>,1|N<3>,1|N<4>,2|H<1>}	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H){1|Li<4>,2|C<3>}	H(C[6]C[5a,6]C[6])	121.0390	0.000	1	121.0755	0.243	107	121.0314	0.986	196	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H)	H(C[6]C[5a,6]C[6])	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H){1|C<3>,2|H<1>,2|N<3>}	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H){1|B<4>,2|C<3>}	H(C[6]C[5a,6]C[6])	121.0590	0.000	1	121.0755	0.243	107	121.0314	0.986	196	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H)	H(C[6]C[5a,6]C[6])	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H){1|C<3>,2|H<1>,2|N<3>}	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H){1|B<5>,2|C<3>}	H(C[6]C[5a,6]C[6])	120.8100	0.000	1	121.0755	0.243	107	121.0314	0.986	196	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H)	H(C[6]C[5a,6]C[6])	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H){1|C<3>,2|H<1>,2|N<3>}	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H){1|Cu<4>,2|C<3>}	H(C[6]C[5a,6]C[6])	120.9330	0.450	6	121.0755	0.243	107	121.0314	0.986	196	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H)	H(C[6]C[5a,6]C[6])	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H){1|C<3>,2|H<1>,2|N<3>}	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H){1|Cu<5>,2|C<3>}	H(C[6]C[5a,6]C[6])	120.9980	0.000	1	121.0755	0.243	107	121.0314	0.986	196	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H)	H(C[6]C[5a,6]C[6])	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H){1|C<3>,2|H<1>,2|N<3>}	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[5a,6]C[6])	121.2565	1.305	4	121.0755	0.243	107	121.0314	0.986	196	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H)	H(C[6]C[5a,6]C[6])	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H){1|C<3>,2|H<1>,2|N<3>}	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H){1|Ir<6>,2|C<3>}	H(C[6]C[5a,6]C[6])	120.8815	0.339	2	121.0755	0.243	107	121.0314	0.986	196	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H)	H(C[6]C[5a,6]C[6])	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H){1|C<3>,2|H<1>,2|N<3>}	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H){1|Ir<7>,2|C<3>}	H(C[6]C[5a,6]C[6])	121.0500	0.072	2	121.0755	0.243	107	121.0314	0.986	196	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H)	H(C[6]C[5a,6]C[6])	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H){1|C<3>,2|H<1>,2|N<3>}	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H){1|Li<4>,2|C<3>}	H(C[6]C[5a,6]C[6])	121.1481	0.066	7	121.0755	0.243	107	121.0314	0.986	196	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H)	H(C[6]C[5a,6]C[6])	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H){1|C<3>,2|H<1>,2|N<3>}	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H){1|Pd<4>,2|C<3>}	H(C[6]C[5a,6]C[6])	120.9376	0.574	14	121.0755	0.243	107	121.0314	0.986	196	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H)	H(C[6]C[5a,6]C[6])	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H){1|C<3>,2|H<1>,2|N<3>}	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H){1|Pt<4>,2|C<3>}	H(C[6]C[5a,6]C[6])	120.9280	0.330	21	121.0755	0.243	107	121.0314	0.986	196	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H)	H(C[6]C[5a,6]C[6])	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H){1|C<3>,2|H<1>,2|N<3>}	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H){1|Pt<5>,2|C<3>}	H(C[6]C[5a,6]C[6])	121.2110	0.187	2	121.0755	0.243	107	121.0314	0.986	196	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H)	H(C[6]C[5a,6]C[6])	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H){1|C<3>,2|H<1>,2|N<3>}	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H){1|Pt<6>,2|C<3>}	H(C[6]C[5a,6]C[6])	121.3430	0.170	2	121.0755	0.243	107	121.0314	0.986	196	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H)	H(C[6]C[5a,6]C[6])	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H){1|C<3>,2|H<1>,2|N<3>}	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H){1|Rh<4>,2|C<3>}	H(C[6]C[5a,6]C[6])	121.0757	0.396	3	121.0755	0.243	107	121.0314	0.986	196	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H)	H(C[6]C[5a,6]C[6])	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H){1|C<3>,2|H<1>,2|N<3>}	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H){1|Rh<5>,2|C<3>}	H(C[6]C[5a,6]C[6])	120.8265	0.456	2	121.0755	0.243	107	121.0314	0.986	196	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H)	H(C[6]C[5a,6]C[6])	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H){1|C<3>,2|H<1>,2|N<3>}	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H){1|Rh<7>,2|C<3>}	H(C[6]C[5a,6]C[6])	121.1614	0.130	10	121.0755	0.243	107	121.0314	0.986	196	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H)	H(C[6]C[5a,6]C[6])	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H){1|C<3>,2|H<1>,2|N<3>}	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H){1|Rh<8>,2|C<3>}	H(C[6]C[5a,6]C[6])	121.3053	0.060	3	121.0755	0.243	107	121.0314	0.986	196	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H)	H(C[6]C[5a,6]C[6])	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H){1|C<3>,2|H<1>,2|N<3>}	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H){1|Ru<7>,2|C<3>}	H(C[6]C[5a,6]C[6])	121.2813	0.837	14	121.0755	0.243	107	121.0314	0.986	196	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H)	H(C[6]C[5a,6]C[6])	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H){1|C<3>,2|H<1>,2|N<3>}	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H){1|Ru<8>,2|C<3>}	H(C[6]C[5a,6]C[6])	121.3448	0.238	4	121.0755	0.243	107	121.0314	0.986	196	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H)	H(C[6]C[5a,6]C[6])	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H){1|C<3>,2|H<1>,2|N<3>}	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H){1|Ru<9>,2|C<3>}	H(C[6]C[5a,6]C[6])	121.2483	0.174	3	121.0755	0.243	107	121.0314	0.986	196	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H)	H(C[6]C[5a,6]C[6])	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H){1|Rh<5>,2|C<3>}	H(C[6]C[5a,6]C[6])	120.8483	0.242	3	121.0755	0.243	107	121.0314	0.986	196	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5a,6]C[5a,6]N[5a])(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)(C[6]C[6]C)(H)	H(C[6]C[5a,6]C[6])	C[6](C[5a,6]C[5a,6]N[5a])(C[6]C[6]H)(H){1|C<4>,3|C<3>}	C[6](C[6]C[5a,6]H)(C[6]C[6]C)(H){1|C<3>,1|N<2>,1|O<1>}	H(C[6]C[5a,6]C[6])	117.6040	0.000	1	117.6040	0.000	1	121.0314	0.986	196	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5a,6]C[5a,6]N[5a])(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H)	H(C[6]C[5a,6]C[6])	C[6](C[5a,6]C[5a,6]N[5a])(C[6]C[6]H)(H){1|C<2>,2|C<3>,2|H<1>}	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H){1|C<3>,1|N<3>}	H(C[6]C[5a,6]C[6])	121.4220	0.000	1	122.1195	0.973	2	121.0314	0.986	196	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5a,6]C[5a,6]N[5a])(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H)	H(C[6]C[5a,6]C[6])	C[6](C[5a,6]C[5a,6]N[5a])(C[6]C[6]H)(H){1|Zn<5>,1|C<2>,1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H){1|C<3>,1|N<3>}	H(C[6]C[5a,6]C[6])	122.8170	0.000	1	122.1195	0.973	2	121.0314	0.986	196	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5a,6]C[5a,6]N[5a])(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)(C[6]C[6]O)(H)	H(C[6]C[5a,6]C[6])	C[6](C[5a,6]C[5a,6]N[5a])(C[6]C[6]H)(H){1|C<4>,1|O<1>,3|C<3>}	C[6](C[6]C[5a,6]H)(C[6]C[6]O)(H){1|N<3>,2|C<3>}	H(C[6]C[5a,6]C[6])	120.1150	0.181	2	120.1150	0.033	2	121.0314	0.986	196	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5a,6]C[5a,6]N[5a])(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H)	H(C[6]C[5a,6]C[6])	C[6](C[5a,6]C[5a,6]N[5a])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,2|N<3>}	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[5a,6]C[6])	121.7790	0.000	1	121.7790	0.000	1	121.0314	0.986	196	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5a,6]C[5a,6]O[5a])(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H)	H(C[6]C[5a,6]C[6])	C[6](C[5a,6]C[5a,6]O[5a])(C[6]C[6]H)(H){1|B<4>,1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|O<2>}	H(C[6]C[5a,6]C[6])	121.6370	0.000	1	121.6370	0.000	1	121.0314	0.986	196	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5a,6]C[5a,6a]C[5a,6])(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H)	H(C[6]C[5a,6]C[6])	C[6](C[5a,6]C[5a,6a]C[5a,6])(C[6]C[6]H)(H){1|C<2>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H){2|C<3>}	H(C[6]C[5a,6]C[6])	120.7220	0.000	1	120.7220	0.000	1	121.0314	0.986	196	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5a,6]C[5a,6a]C[5a,6])(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)(C[6]Se[6]H)(H)	H(C[6]C[5a,6]C[6])	C[6](C[5a,6]C[5a,6a]C[5a,6])(C[6]C[6]H)(H){1|Se<2>,1|H<1>,3|C<3>}	C[6](C[6]C[5a,6]H)(C[6]Se[6]H)(H){2|C<3>}	H(C[6]C[5a,6]C[6])	117.9210	0.000	1	117.9210	0.000	1	121.0314	0.986	196	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5a,6]C[5a,6a]N[5a,6])(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H)	H(C[6]C[5a,6]C[6])	C[6](C[5a,6]C[5a,6a]N[5a,6])(C[6]C[6]H)(H){1|B<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[5a,6]C[6])	122.2865	2.307	2	123.2280	5.321	3	121.0314	0.986	196	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5a,6]C[5a,6a]N[5a,6])(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H)	H(C[6]C[5a,6]C[6])	C[6](C[5a,6]C[5a,6a]N[5a,6])(C[6]C[6]H)(H){1|H<1>,1|N<2>,3|C<3>}	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[5a,6]C[6])	125.1110	0.000	1	123.2280	5.321	3	121.0314	0.986	196	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5a,6]N[5a,5a,6]C[5a,6a])(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)2(H)	H(C[6]C[5a,6]C[6])	C[6](C[5a,6]N[5a,5a,6]C[5a,6a])(C[6]C[6]H)(H){1|H<1>,4|C<3>}	C[6](C[6]C[5a,6]H)2(H){1|C<3>,1|N<2>,1|N<3>}	H(C[6]C[5a,6]C[6])	120.4250	0.000	1	120.6820	0.109	13	121.0314	0.986	196	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5a,6]N[5a,5a,6]C[5a,6a])(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)2(H)	H(C[6]C[5a,6]C[6])	C[6](C[5a,6]N[5a,5a,6]C[5a,6a])(C[6]C[6]H)(H){1|H<1>,4|C<3>}	C[6](C[6]C[5a,6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[5a,6]C[6])	120.7034	0.335	12	120.6820	0.109	13	121.0314	0.986	196	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5a,6]N[5a,5a,6]C[5a])(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)2(H)	H(C[6]C[5a,6]C[6])	C[6](C[5a,6]N[5a,5a,6]C[5a])(C[6]C[6]H)(H){1|B<3>,1|H<1>,3|C<3>}	C[6](C[6]C[5a,6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[5a,6]C[6])	120.5480	0.000	1	120.5197	0.044	18	121.0314	0.986	196	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5a,6]N[5a,5a,6]C[5a])(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)2(H)	H(C[6]C[5a,6]C[6])	C[6](C[5a,6]N[5a,5a,6]C[5a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,3|C<3>}	C[6](C[6]C[5a,6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[5a,6]C[6])	120.6050	0.000	1	120.5197	0.044	18	121.0314	0.986	196	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5a,6]N[5a,5a,6]C[5a])(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)2(H)	H(C[6]C[5a,6]C[6])	C[6](C[5a,6]N[5a,5a,6]C[5a])(C[6]C[6]H)(H){1|H<1>,4|C<3>}	C[6](C[6]C[5a,6]H)2(H){1|C<3>,1|N<2>,1|N<3>}	H(C[6]C[5a,6]C[6])	120.7860	0.000	1	120.5197	0.044	18	121.0314	0.986	196	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5a,6]N[5a,5a,6]C[5a])(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)2(H)	H(C[6]C[5a,6]C[6])	C[6](C[5a,6]N[5a,5a,6]C[5a])(C[6]C[6]H)(H){1|H<1>,4|C<3>}	C[6](C[6]C[5a,6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[5a,6]C[6])	120.4647	0.245	11	120.5197	0.044	18	121.0314	0.986	196	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5a,6]N[5a,5a,6]C[5a])(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)2(H)	H(C[6]C[5a,6]C[6])	C[6](C[5a,6]N[5a,5a,6]C[5a])(C[6]C[6]H)(H){1|N<2>,2|C<3>,2|H<1>}	C[6](C[6]C[5a,6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[5a,6]C[6])	120.6590	0.000	1	120.5197	0.044	18	121.0314	0.986	196	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5a,6]N[5a,5a,6]C[5a])(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)2(H)	H(C[6]C[5a,6]C[6])	C[6](C[5a,6]N[5a,5a,6]C[5a])(C[6]C[6]H)(H){1|Se<3>,1|C<3>,1|N<3>,2|H<1>}	C[6](C[6]C[5a,6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[5a,6]C[6])	120.4680	0.000	1	120.5197	0.044	18	121.0314	0.986	196	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5a,6]N[5a,5a,6]C[5a])(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)2(H)	H(C[6]C[5a,6]C[6])	C[6](C[5a,6]N[5a,5a,6]C[5a])(C[6]C[6]H)(H){2|H<1>,3|C<3>}	C[6](C[6]C[5a,6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[5a,6]C[6])	120.5885	0.042	2	120.5197	0.044	18	121.0314	0.986	196	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5a,6]N[5a,5a,6]N[5a])(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]C)(C[6]C[5a,6]H)(H)	H(C[6]C[5a,6]C[6])	C[6](C[5a,6]N[5a,5a,6]N[5a])(C[6]C[6]H)(H){1|C<4>,3|C<3>}	C[6](C[6]C[5a,6]C)(C[6]C[5a,6]H)(H){1|C<3>,1|N<2>,1|N<3>}	H(C[6]C[5a,6]C[6])	121.2130	0.000	1	121.2130	0.000	1	121.0314	0.986	196	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5a,6]N[5a,5a,6]N[5a])(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)2(H)	H(C[6]C[5a,6]C[6])	C[6](C[5a,6]N[5a,5a,6]N[5a])(C[6]C[6]H)(H){1|H<1>,3|C<3>}	C[6](C[6]C[5a,6]H)2(H){1|C<3>,1|N<2>,1|N<3>}	H(C[6]C[5a,6]C[6])	120.8770	0.187	2	120.8770	0.035	2	121.0314	0.986	196	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5a,6]N[5a,5a]N[5a,6])(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H)	H(C[6]C[5a,6]C[6])	C[6](C[5a,6]N[5a,5a]N[5a,6])(C[6]C[6]H)(H){1|B<4>,1|H<1>,3|C<3>}	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	H(C[6]C[5a,6]C[6])	121.2280	0.000	1	121.2280	0.000	1	121.0314	0.986	196	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5a,6]N[5a,6,6a]C[5a,6a])(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)(C[6]C[6,6a]H)(H)	H(C[6]C[5a,6]C[6])	C[6](C[5a,6]N[5a,6,6a]C[5a,6a])(C[6]C[6]H)(H){1|H<1>,4|C<3>}	C[6](C[6]C[5a,6]H)(C[6]C[6,6a]H)(H){1|N<3>,2|C<3>}	H(C[6]C[5a,6]C[6])	120.2640	0.000	1	120.2640	0.000	1	121.0314	0.986	196	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5a,6]N[5a,6]2)(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H)	H(C[6]C[5a,6]C[6])	C[6](C[5a,6]N[5a,6]2)(C[6]C[6]H)(H){1|B<4>,1|H<1>,3|C<3>}	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	H(C[6]C[5a,6]C[6])	125.1610	3.056	2	125.1610	9.340	2	121.0314	0.986	196	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5a,6]N[5a,6]C[5a])(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)(C[6]C[6]F)(H)	H(C[6]C[5a,6]C[6])	C[6](C[5a,6]N[5a,6]C[5a])(C[6]C[6]H)(H){1|F<1>,4|C<3>}	C[6](C[6]C[5a,6]H)(C[6]C[6]F)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[5a,6]C[6])	123.7510	0.000	1	123.7510	0.000	1	121.0314	0.986	196	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5a,6]N[5a,6]C[5a])(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H)	H(C[6]C[5a,6]C[6])	C[6](C[5a,6]N[5a,6]C[5a])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>,1|N<3>,1|S<2>}	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[5a,6]C[6])	120.7700	0.000	1	120.0405	0.113	13	121.0314	0.986	196	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5a,6]N[5a,6]C[5a])(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H)	H(C[6]C[5a,6]C[6])	C[6](C[5a,6]N[5a,6]C[5a])(C[6]C[6]H)(H){1|H<1>,4|C<3>}	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[5a,6]C[6])	119.9095	0.274	2	120.0405	0.113	13	121.0314	0.986	196	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5a,6]N[5a,6]C[5a])(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H)	H(C[6]C[5a,6]C[6])	C[6](C[5a,6]N[5a,6]C[5a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[5a,6]C[6])	120.0090	0.289	9	120.0405	0.113	13	121.0314	0.986	196	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5a,6]N[5a,6]C[5a])(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H)	H(C[6]C[5a,6]C[6])	C[6](C[5a,6]N[5a,6]C[5a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H){1|N<3>,2|C<3>}	H(C[6]C[5a,6]C[6])	119.8570	0.000	1	120.0405	0.113	13	121.0314	0.986	196	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5a,6]N[5a,6]N[5a])(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)(C[6]C[6]C)(H)	H(C[6]C[5a,6]C[6])	C[6](C[5a,6]N[5a,6]N[5a])(C[6]C[6]H)(H){1|C<4>,3|C<3>}	C[6](C[6]C[5a,6]H)(C[6]C[6]C)(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[5a,6]C[6])	120.4740	0.000	1	120.4740	0.000	1	121.0314	0.986	196	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5a,6]N[5a,6]N[5a])(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H)	H(C[6]C[5a,6]C[6])	C[6](C[5a,6]N[5a,6]N[5a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,3|C<3>}	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	H(C[6]C[5a,6]C[6])	121.8143	0.465	3	121.1455	0.919	11	121.0314	0.986	196	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5a,6]N[5a,6]N[5a])(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H)	H(C[6]C[5a,6]C[6])	C[6](C[5a,6]N[5a,6]N[5a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[5a,6]C[6])	121.0010	0.000	1	121.1455	0.919	11	121.0314	0.986	196	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5a,6]N[5a,6]N[5a])(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H)	H(C[6]C[5a,6]C[6])	C[6](C[5a,6]N[5a,6]N[5a])(C[6]C[6]H)(H){1|H<1>,1|S<2>,2|C<3>}	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[5a,6]C[6])	119.8960	0.000	1	121.1455	0.919	11	121.0314	0.986	196	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5a,6]N[5a,6]N[5a])(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H)	H(C[6]C[5a,6]C[6])	C[6](C[5a,6]N[5a,6]N[5a])(C[6]C[6]H)(H){1|H<1>,3|C<3>}	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[5a,6]C[6])	120.2085	0.493	2	121.1455	0.919	11	121.0314	0.986	196	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5a,6]N[5a,6]N[5a])(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H)	H(C[6]C[5a,6]C[6])	C[6](C[5a,6]N[5a,6]N[5a])(C[6]C[6]H)(H){2|H<1>,3|C<3>}	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	H(C[6]C[5a,6]C[6])	121.4610	1.070	4	121.1455	0.919	11	121.0314	0.986	196	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5a,6]N[5a,6a]N[5a,6])(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H)	H(C[6]C[5a,6]C[6])	C[6](C[5a,6]N[5a,6a]N[5a,6])(C[6]C[6]H)(H){1|B<4>,1|H<1>,3|C<3>}	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	H(C[6]C[5a,6]C[6])	121.3515	0.228	4	121.3515	0.052	4	121.0314	0.986	196	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[5a,6]C[5a,6]2)(C[6]N[6]H)(H)	C[6](C[6]C[5a,6]H)(N[6]C[6]H)(H)	H(C[6]C[5a,6]C[6])	C[6](C[5a,6]C[5a,6]2)(C[6]N[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[5a,6]H)(N[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[5a,6]C[6])	120.9000	0.000	1	120.9000	0.000	1	121.3896	0.430	23	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[5a,6]C[5a,6]C[5a])(C[6]N[6]H)(H)	C[6](C[6]C[5a,6]H)(N[6]C[6]C)(H)	H(C[6]C[5a,6]C[6])	C[6](C[5a,6]C[5a,6]C[5a])(C[6]N[6]H)(H){1|C<4>,1|H<1>,1|S<2>,2|C<3>}	C[6](C[6]C[5a,6]H)(N[6]C[6]C)(H){1|S<1>,2|C<3>}	H(C[6]C[5a,6]C[6])	120.8930	0.110	3	120.8930	0.012	3	121.3896	0.430	23	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[5a,6]C[5a,6]N[5a])(C[6]N[6]H)(H)	C[6](C[6]C[5a,6]H)(N[6]C[6]H)(H)	H(C[6]C[5a,6]C[6])	C[6](C[5a,6]C[5a,6]N[5a])(C[6]N[6]H)(H){2|H<1>,3|C<3>}	C[6](C[6]C[5a,6]H)(N[6]C[6]H)(H){1|N<3>,2|C<3>}	H(C[6]C[5a,6]C[6])	121.4920	0.000	1	121.4920	0.000	1	121.3896	0.430	23	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[5a,6]C[5a,6]O[5a])(C[6]N[6]H)(H)	C[6](C[6]C[5a,6]H)(N[6]C[6]Co)(H)	H(C[6]C[5a,6]C[6])	C[6](C[5a,6]C[5a,6]O[5a])(C[6]N[6]H)(H){1|Co<4>,3|C<3>}	C[6](C[6]C[5a,6]H)(N[6]C[6]Co)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[5a,6]C[6])	121.9920	0.000	1	121.9920	0.000	1	121.3896	0.430	23	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[5a,6]C[5a,6]O[5a])(C[6]N[6]H)(H)	C[6](C[6]C[5a,6]H)(N[6]C[6]Cu)(H)	H(C[6]C[5a,6]C[6])	C[6](C[5a,6]C[5a,6]O[5a])(C[6]N[6]H)(H){1|Cu<5>,3|C<3>}	C[6](C[6]C[5a,6]H)(N[6]C[6]Cu)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[5a,6]C[6])	122.1380	0.000	1	122.1380	0.000	1	121.3896	0.430	23	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[5a,6]C[5a,6]O[5a])(C[6]N[6]H)(H)	C[6](C[6]C[5a,6]H)(N[6]C[6]Ir)(H)	H(C[6]C[5a,6]C[6])	C[6](C[5a,6]C[5a,6]O[5a])(C[6]N[6]H)(H){1|Ir<6>,3|C<3>}	C[6](C[6]C[5a,6]H)(N[6]C[6]Ir)(H){1|O<2>,2|C<3>}	H(C[6]C[5a,6]C[6])	122.4093	0.031	3	122.4093	0.001	3	121.3896	0.430	23	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[5a,6]C[5a,6]O[5a])(C[6]N[6]H)(H)	C[6](C[6]C[5a,6]H)(N[6]C[6]Ni)(H)	H(C[6]C[5a,6]C[6])	C[6](C[5a,6]C[5a,6]O[5a])(C[6]N[6]H)(H){1|Ni<6>,3|C<3>}	C[6](C[6]C[5a,6]H)(N[6]C[6]Ni)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[5a,6]C[6])	122.1035	0.281	2	122.1035	0.079	2	121.3896	0.430	23	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[5a,6]C[5a,6]S[5a])(C[6]N[6]H)(H)	C[6](C[6]C[5a,6]H)(N[6]C[6]Ir)(H)	H(C[6]C[5a,6]C[6])	C[6](C[5a,6]C[5a,6]S[5a])(C[6]N[6]H)(H){1|Ir<6>,3|C<3>}	C[6](C[6]C[5a,6]H)(N[6]C[6]Ir)(H){1|S<2>,2|C<3>}	H(C[6]C[5a,6]C[6])	121.5615	0.145	2	121.5615	0.021	2	121.3896	0.430	23	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[5a,6]C[5a,6a]C[5a,6])(C[6]N[6]H)(H)	C[6](C[6]C[5a,6]H)(N[6]C[6]C)(H)	H(C[6]C[5a,6]C[6])	C[6](C[5a,6]C[5a,6a]C[5a,6])(C[6]N[6]H)(H){1|C<4>,1|S<2>,3|C<3>}	C[6](C[6]C[5a,6]H)(N[6]C[6]C)(H){1|H<1>,2|C<3>}	H(C[6]C[5a,6]C[6])	121.1880	0.000	1	121.1880	0.000	1	121.3896	0.430	23	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[5a,6]C[5a,6a]C[5a,6])(C[6]N[6]H)(H)	C[6](C[6]C[5a,6]H)(N[6]C[6]Ir)(H)	H(C[6]C[5a,6]C[6])	C[6](C[5a,6]C[5a,6a]C[5a,6])(C[6]N[6]H)(H){1|Ir<6>,1|N<3>,3|C<3>}	C[6](C[6]C[5a,6]H)(N[6]C[6]Ir)(H){3|C<3>}	H(C[6]C[5a,6]C[6])	120.9873	0.293	4	120.9873	0.086	4	121.3896	0.430	23	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[5a,6]C[5a,6a]C[5a,6])(C[6]N[6]H)(H)	C[6](C[6]C[5a,6]H)(N[6]C[6]Pd)(H)	H(C[6]C[5a,6]C[6])	C[6](C[5a,6]C[5a,6a]C[5a,6])(C[6]N[6]H)(H){1|Pd<4>,1|N<3>,3|C<3>}	C[6](C[6]C[5a,6]H)(N[6]C[6]Pd)(H){3|C<3>}	H(C[6]C[5a,6]C[6])	121.1300	0.000	1	121.1300	0.000	1	121.3896	0.430	23	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[5a,6]C[5a,6a]C[5a,6])(C[6]N[6]H)(H)	C[6](C[6]C[5a,6]H)(N[6]C[6]Re)(H)	H(C[6]C[5a,6]C[6])	C[6](C[5a,6]C[5a,6a]C[5a,6])(C[6]N[6]H)(H){1|Re<6>,1|N<3>,3|C<3>}	C[6](C[6]C[5a,6]H)(N[6]C[6]Re)(H){1|H<1>,2|C<3>}	H(C[6]C[5a,6]C[6])	120.3445	0.028	2	120.6447	0.271	3	121.3896	0.430	23	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[5a,6]C[5a,6a]C[5a,6])(C[6]N[6]H)(H)	C[6](C[6]C[5a,6]H)(N[6]C[6]Re)(H)	H(C[6]C[5a,6]C[6])	C[6](C[5a,6]C[5a,6a]C[5a,6])(C[6]N[6]H)(H){1|Re<6>,1|N<3>,3|C<3>}	C[6](C[6]C[5a,6]H)(N[6]C[6]Re)(H){3|C<3>}	H(C[6]C[5a,6]C[6])	121.2450	0.000	1	120.6447	0.271	3	121.3896	0.430	23	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[3x6]C[6])(C[6]C[6,6]H)(H)	C[6](C[6,6]C[3x6]C[6])(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[3x6]C[6])(C[6]C[6,6]H)(H){1|Fe<7>,1|C<3>,1|H<1>,4|C<4>}	C[6](C[6,6]C[3x6]C[6])(C[6]C[6,6]H)(H){1|H<1>,2|C<3>,3|C<4>}	H(C[6]C[6,6]C[6])	119.8490	0.000	1	119.3879	0.131	8	119.2997	0.253	18	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[3x6]C[6])(C[6]C[6,6]H)(H)	C[6](C[6,6]C[3x6]C[6])(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[3x6]C[6])(C[6]C[6,6]H)(H){1|Fe<7>,1|H<1>,5|C<4>}	C[6](C[6,6]C[3x6]C[6])(C[6]C[6,6]H)(H){1|Fe<7>,1|H<1>,5|C<4>}	H(C[6]C[6,6]C[6])	119.7220	0.075	2	119.3879	0.131	8	119.2997	0.253	18	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[3x6]C[6])(C[6]C[6,6]H)(H)	C[6](C[6,6]C[3x6]C[6])(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[3x6]C[6])(C[6]C[6,6]H)(H){1|H<1>,2|C<3>,3|C<4>}	C[6](C[6,6]C[3x6]C[6])(C[6]C[6,6]H)(H){1|Fe<7>,1|C<3>,1|H<1>,4|C<4>}	H(C[6]C[6,6]C[6])	119.3360	0.000	1	119.3879	0.131	8	119.2997	0.253	18	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[3x6]C[6])(C[6]C[6,6]H)(H)	C[6](C[6,6]C[3x6]C[6])(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[3x6]C[6])(C[6]C[6,6]H)(H){1|H<1>,2|C<4>,3|C<3>}	C[6](C[6,6]C[3x6]C[6])(C[6]C[6,6]H)(H){1|H<1>,2|C<4>,3|C<3>}	H(C[6]C[6,6]C[6])	119.1185	0.247	4	119.3879	0.131	8	119.2997	0.253	18	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6]2)(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6,6]H)(H){1|O<2>,6|C<4>}	C[6](C[6,6]C[6,6]2)(C[6]C[6,6]H)(H){1|H<1>,6|C<4>}	H(C[6]C[6,6]C[6])	119.6190	0.000	1	119.6190	0.000	1	119.2997	0.253	18	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6,6]H)(H){1|C<3>,1|O<2>,4|C<4>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]H)(H){1|H<1>,2|C<3>,3|C<4>}	H(C[6]C[6,6]C[6])	118.7760	0.000	1	118.9785	0.082	2	119.2997	0.253	18	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6,6]H)(H){2|H<1>,5|C<4>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]H)(H){2|H<1>,5|C<4>}	H(C[6]C[6,6]C[6])	119.1810	0.000	1	118.9785	0.082	2	119.2997	0.253	18	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]2)(C[6]C[6,6]H)(H)	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2)(C[6]C[6,6]H)(H){1|H<1>,6|C<4>}	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6,6]H)(H){1|O<2>,6|C<4>}	H(C[6]C[6,6]C[6])	120.7860	0.000	1	120.7860	0.000	1	119.2997	0.253	18	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]H)(H)	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]H)(H){1|H<1>,2|C<3>,3|C<4>}	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6,6]H)(H){1|C<3>,1|O<2>,4|C<4>}	H(C[6]C[6,6]C[6])	118.8770	0.000	1	118.8895	0.000	2	119.2997	0.253	18	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]H)(H)	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]H)(H){2|H<1>,5|C<4>}	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6,6]H)(H){2|H<1>,5|C<4>}	H(C[6]C[6,6]C[6])	118.9020	0.000	1	118.8895	0.000	2	119.2997	0.253	18	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]H)(H){1|C<3>,3|C<4>,3|H<1>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]H)(H){1|N<2>,2|C<3>,3|C<4>}	H(C[6]C[6,6]C[6])	119.2020	0.000	1	119.0378	0.039	4	119.2997	0.253	18	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]H)(H){1|N<2>,2|C<3>,3|C<4>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]H)(H){1|C<3>,3|C<4>,3|H<1>}	H(C[6]C[6,6]C[6])	119.1850	0.000	1	119.0378	0.039	4	119.2997	0.253	18	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]H)(H){1|Zr<7>,1|N<4>,2|H<1>,3|C<4>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]H)(H){1|Zr<7>,1|N<4>,2|H<1>,3|C<4>}	H(C[6]C[6,6]C[6])	118.8820	0.140	2	119.0378	0.039	4	119.2997	0.253	18	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6,6]O)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]H)(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6,6]O)(H){1|C<3>,1|H<1>,1|O<2>,4|C<4>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]H)(O){1|C<3>,1|H<1>,4|C<4>}	H(C[6]C[6,6]C[6])	117.6890	0.000	1	117.6890	0.000	1	117.6027	0.006	3	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6,6]C[6,6]2)(C[6]C[6,6]O)(H)	C[6](C[6,6]C[6,6]2)(C[6]C[6,6]H)(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2)(C[6]C[6,6]O)(H){1|C<3>,6|C<4>}	C[6](C[6,6]C[6,6]2)(C[6]C[6,6]H)(O){1|C<3>,5|C<4>}	H(C[6]C[6,6]C[6])	117.5330	0.000	1	117.5330	0.000	1	117.6027	0.006	3	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]O)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]H)(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]O)(H){1|C<3>,1|O<2>,5|C<4>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]H)(O){1|H<1>,1|O<2>,4|C<4>}	H(C[6]C[6,6]C[6])	117.5860	0.000	1	117.5860	0.000	1	117.6027	0.006	3	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[3x6]N[6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[3x6]N[6])(C[6]C[6,6a]H)(H){2|C<3>,3|C<4>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H){1|C<4>,1|H<1>,1|N<2>,2|C<3>}	H(C[6]C[6,6]C[6])	120.1360	0.000	1	120.1360	0.000	1	119.8380	0.509	34	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[5,6,6]C[6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[5,6,6a]C[6a])(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6,6]C[6])(C[6]C[6,6a]H)(H){1|C<4>,1|H<1>,4|C<3>}	C[6](C[6,6a]C[5,6,6a]C[6a])(C[6]C[6,6]H)(H){1|C<4>,1|H<1>,3|C<3>}	H(C[6]C[6,6]C[6])	119.3450	0.071	2	119.3450	0.005	2	119.8380	0.509	34	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]N[6,6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]N[6,6])(C[6]C[6,6a]H)(H){1|B<4>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6,6]C[6])	119.5930	0.134	2	119.5930	0.018	2	119.8380	0.509	34	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6a]N[6,6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]N[6,6])(C[6]C[6,6a]H)(H){1|B<4>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6,6]C[6])	119.8650	0.000	1	119.8650	0.000	1	119.8380	0.509	34	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6a]N[6,6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]N[6,6a])(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]N[6,6])(C[6]C[6,6a]H)(H){1|B<4>,1|N<3>,3|C<3>}	C[6](C[6,6a]C[6,6a]N[6,6a])(C[6]C[6,6]H)(H){1|B<4>,1|N<3>,3|C<3>}	H(C[6]C[6,6]C[6])	119.3400	0.000	1	119.3400	0.000	1	119.8380	0.509	34	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]C[6,6a]H)(H){1|B<4>,1|C<2>,1|N<2>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6,6]C[6])	120.0910	0.000	1	120.2666	1.253	10	119.8380	0.509	34	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]C[6,6a]H)(H){1|B<4>,1|H<1>,3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6,6]C[6])	120.2861	1.186	9	120.2666	1.253	10	119.8380	0.509	34	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]N[6,6]N[6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]N[6])(C[6]C[6,6a]H)(H){1|B<4>,3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H){1|C<3>,1|C<4>,1|N<3>,2|N<2>}	H(C[6]C[6,6]C[6])	119.8023	0.338	6	119.6829	0.144	17	119.8380	0.509	34	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]N[6,6]N[6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]N[6])(C[6]C[6,6a]H)(H){1|B<4>,3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H){1|C<3>,1|H<1>,1|N<2>,2|N<3>}	H(C[6]C[6,6]C[6])	120.1230	0.000	2	119.6829	0.144	17	119.8380	0.509	34	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]N[6,6]N[6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]N[6])(C[6]C[6,6a]H)(H){1|B<4>,3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H){1|C<3>,1|H<1>,1|N<3>,2|N<2>}	H(C[6]C[6,6]C[6])	119.6300	0.000	1	119.6829	0.144	17	119.8380	0.509	34	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]N[6,6]N[6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]N[6])(C[6]C[6,6a]H)(H){1|B<4>,3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6,6]C[6])	119.6177	0.093	7	119.6829	0.144	17	119.8380	0.509	34	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]N[6,6]N[6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]N[6])(C[6]C[6,6a]H)(H){2|C<3>,2|C<4>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H){1|C<3>,1|C<4>,1|N<3>,2|N<2>}	H(C[6]C[6,6]C[6])	118.5950	0.000	1	119.6829	0.144	17	119.8380	0.509	34	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6,6a]O)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6,6a]O)(H){3|C<3>,3|C<4>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(O){1|C<4>,1|O<2>,3|C<3>}	H(C[6]C[6,6]C[6])	118.5640	0.000	1	118.5640	0.000	1	118.4792	0.096	4	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6a]O)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6a]O)(H){1|O<1>,2|O<2>,3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(O){1|C<4>,1|H<1>,3|C<3>}	H(C[6]C[6,6]C[6])	118.6645	0.069	2	118.4510	0.139	3	118.4792	0.096	4	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6a]O)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6a]O)(H){2|C<3>,5|C<4>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(O){1|O<2>,2|C<3>,2|C<4>}	H(C[6]C[6,6]C[6])	118.0240	0.000	1	118.4510	0.139	3	118.4792	0.096	4	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[3,6]C[6,6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[3,6]C[6,6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>,1|O<2>,2|C<4>}	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|Cu<4>,1|C<3>,1|C<4>}	H(C[6]C[6,6]C[6])	120.2750	0.214	2	120.2750	0.046	2	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[3x6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6,6]O)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[3x6]C[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>,3|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6,6]O)(H){1|C<3>,3|C<4>}	H(C[6]C[6,6]C[6])	120.4995	0.200	2	120.4995	0.040	2	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[4x6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[3x6]O)(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[4x6]N[6])(C[6]C[6]H)(H){1|C<4>,1|O<1>,2|C<3>}	C[6](C[6]C[3x6]O)(C[6]C[6,6]H)(H){1|C<3>,1|C<4>,1|N<2>}	H(C[6]C[6,6]C[6])	119.0760	0.000	1	119.0760	0.000	1	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[5,5,6]C[6,6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,5,6]C[6,6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,3|N<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Co<7>,1|C<3>,1|C<4>}	H(C[6]C[6,6]C[6])	120.4360	0.290	4	120.4360	0.084	4	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[5,6,6]C[6,6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6,6]C[6,6])(C[6]C[6]H)(H){1|H<1>,6|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6,6]H)(H){1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6,6]C[6])	118.5380	0.000	1	118.6965	0.050	2	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[5,6,6]C[6,6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6,6]C[6,6])(C[6]C[6]H)(H){1|H<1>,6|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6,6]H)(H){1|C<3>,1|O<2>,2|C<4>}	H(C[6]C[6,6]C[6])	118.8550	0.000	1	118.6965	0.050	2	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[5,6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6,6]C[6])(C[6]C[6]H)(H){1|C<3>,2|C<4>,4|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6,6]H)(H){1|H<1>,1|N<3>,2|C<4>}	H(C[6]C[6,6]C[6])	119.2260	0.000	1	119.9815	0.366	6	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[5,6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6,6]C[6])(C[6]C[6]H)(H){1|C<4>,2|H<1>,3|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6,6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[6,6]C[6])	121.0620	0.000	1	119.9815	0.366	6	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[5,6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6,6]C[6])(C[6]C[6]H)(H){1|Ca<12>,1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6,6]H)(H){1|Ca<12>,1|C<3>,2|C<4>}	H(C[6]C[6,6]C[6])	119.9002	0.146	4	119.9815	0.366	6	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[5,6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]O)(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6,6]C[6])(C[6]C[6]H)(H){1|O<1>,2|H<1>,3|C<4>}	C[6](C[6]C[5,6]O)(C[6]C[6,6]H)(H){1|C<3>,1|C<4>,2|O<2>}	H(C[6]C[6,6]C[6])	118.1550	0.000	1	118.1550	0.000	1	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[5,6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[5,6]O)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6,6]C[6])(C[6]C[6]H)(H){1|N<3>,1|O<1>,2|C<4>,2|H<1>}	C[6](C[6]C[6,6]H)(C[6]N[5,6]O)(H){1|C<4>,2|C<3>}	H(C[6]C[6,6]C[6])	120.2890	0.000	1	120.2890	0.000	1	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,2|C<3>,2|O<2>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<1>}	H(C[6]C[6,6]C[6])	121.4825	0.948	2	120.7483	2.067	3	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,4|C<3>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<1>}	H(C[6]C[6,6]C[6])	119.2800	0.000	1	120.7483	2.067	3	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|O<2>,2|N<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6,6]C[6])	119.7020	0.000	1	119.7020	0.000	1	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[5a,6]N[6,6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5a,6]N[6,6])(C[6]C[6]H)(H){1|B<4>,1|H<1>,1|N<2>,2|C<3>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6,6]C[6])	120.0500	0.000	1	120.0075	0.004	2	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[5a,6]N[6,6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5a,6]N[6,6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|N<3>,2|C<3>}	H(C[6]C[6,6]C[6])	119.9650	0.000	1	120.0075	0.004	2	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]2)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2)(C[6]C[6]H)(H){1|H<1>,1|O<1>,4|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6,6]C[6])	118.2250	0.471	2	118.2250	0.222	2	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[5]N[6])(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,2|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6,6]H)(H){1|Fe<10>,1|Rh<4>,2|C<3>,2|C<4>}	H(C[6]C[6,6]C[6])	120.4520	0.048	2	120.1672	0.071	6	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[5]N[6])(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6,6]H)(H){1|Ru<5>,1|C<4>,3|C<3>}	H(C[6]C[6,6]C[6])	120.1060	0.000	1	120.1672	0.071	6	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[5]N[6])(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6,6]H)(H){1|Ru<5>,1|N<3>,1|S<2>,2|C<3>}	H(C[6]C[6,6]C[6])	120.1255	0.039	2	120.1672	0.071	6	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[5]N[6])(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6,6]H)(H){1|Ru<5>,1|S<3>,3|C<3>}	H(C[6]C[6,6]C[6])	119.7420	0.000	1	120.1672	0.071	6	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[5a]N[6])(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6,6]H)(H){1|Pd<4>,1|N<3>,3|C<3>}	H(C[6]C[6,6]C[6])	119.9180	0.000	1	120.3073	0.096	6	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[5a]N[6])(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6,6]H)(H){1|Ru<5>,1|N<3>,3|C<3>}	H(C[6]C[6,6]C[6])	120.2500	0.146	3	120.3073	0.096	6	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[5a]N[6])(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6,6]H)(H){1|Ru<5>,1|S<2>,3|C<3>}	H(C[6]C[6,6]C[6])	120.8300	0.000	1	120.3073	0.096	6	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[5a]N[6])(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6,6]H)(H){1|Ru<5>,4|C<3>}	H(C[6]C[6,6]C[6])	120.3460	0.000	1	120.3073	0.096	6	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){2|C<3>}	H(C[6]C[6,6]C[6])	130.5400	0.000	1	120.9426	5.605	22	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<2>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){2|C<3>}	H(C[6]C[6,6]C[6])	120.3880	0.000	1	120.9426	5.605	22	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<2>,1|N<3>,1|O<2>,2|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){2|C<3>}	H(C[6]C[6,6]C[6])	123.7820	0.000	1	120.9426	5.605	22	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>,2|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Ti<9>,1|O<2>,2|C<3>}	H(C[6]C[6,6]C[6])	120.1430	0.095	2	120.9426	5.605	22	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<5>,1|N<3>,2|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){2|Y<14>,1|O<3>,2|C<3>}	H(C[6]C[6,6]C[6])	120.0690	0.000	1	120.9426	5.605	22	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<5>,1|N<3>,2|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){2|Yb<14>,1|O<3>,2|C<3>}	H(C[6]C[6,6]C[6])	119.8130	0.000	1	120.9426	5.605	22	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<3>,3|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Li<4>,1|Li<5>,1|C<3>,1|C<4>}	H(C[6]C[6,6]C[6])	119.7200	0.000	1	120.9426	5.605	22	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<4>,2|C<3>,3|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<1>}	H(C[6]C[6,6]C[6])	119.7230	0.000	1	120.9426	5.605	22	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|Li<5>,1|C<3>,1|H<1>,1|O<3>,3|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Li<4>,1|Li<5>,2|C<4>}	H(C[6]C[6,6]C[6])	120.0240	0.000	1	120.9426	5.605	22	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|O<1>,2|C<3>}	H(C[6]C[6,6]C[6])	122.8980	0.000	1	120.9426	5.605	22	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|Os<8>,1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Os<8>,1|C<3>,1|C<4>}	H(C[6]C[6,6]C[6])	120.4600	0.337	2	120.9426	5.605	22	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|Rh<7>,1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<4>}	H(C[6]C[6,6]C[6])	119.6290	0.000	1	120.9426	5.605	22	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|Ti<12>,1|C<3>,1|C<4>,1|N<3>,2|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Ti<12>,1|C<3>,1|C<4>,1|O<2>}	H(C[6]C[6,6]C[6])	120.3982	0.503	5	120.9426	5.605	22	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|Ti<8>,1|C<3>,1|C<4>,1|N<3>,2|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Ti<8>,1|C<3>,1|C<4>,1|O<2>}	H(C[6]C[6,6]C[6])	120.6050	0.000	1	120.9426	5.605	22	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|Zr<11>,1|C<3>,1|C<4>,1|N<3>,3|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){3|C<4>}	H(C[6]C[6,6]C[6])	120.4640	0.000	1	120.9426	5.605	22	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|Zr<14>,1|C<5>,1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<4>}	H(C[6]C[6,6]C[6])	119.8860	0.000	1	120.9426	5.605	22	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,1|O<1>,4|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6,6]C[6])	118.4520	0.000	1	118.6620	0.088	2	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|O<1>,1|P<4>,3|C<3>}	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|H<1>,2|C<3>}	H(C[6]C[6,6]C[6])	118.8720	0.000	1	118.6620	0.088	2	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|Cu<5>,2|C<3>}	H(C[6]C[6,6]C[6])	123.7790	0.000	1	120.0988	0.366	73	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|C<5>,1|H<1>,1|N<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|H<1>,2|C<3>}	H(C[6]C[6,6]C[6])	119.3005	0.549	2	120.0988	0.366	73	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|Ru<6>,2|C<3>}	H(C[6]C[6,6]C[6])	120.5725	0.150	4	120.0988	0.366	73	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,2|N<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|B<5>,2|C<3>}	H(C[6]C[6,6]C[6])	120.3840	0.000	1	120.0988	0.366	73	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,2|N<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|Co<6>,2|C<3>}	H(C[6]C[6,6]C[6])	120.7880	0.181	2	120.0988	0.366	73	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,2|N<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|Cu<3>,2|C<3>}	H(C[6]C[6,6]C[6])	120.2557	0.072	3	120.0988	0.366	73	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,2|N<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|Cu<4>,2|C<3>}	H(C[6]C[6,6]C[6])	120.0565	0.262	2	120.0988	0.366	73	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,2|N<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|Cu<5>,2|C<3>}	H(C[6]C[6,6]C[6])	120.3030	0.065	5	120.0988	0.366	73	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,2|N<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|Fe<5>,2|C<3>}	H(C[6]C[6,6]C[6])	120.0395	0.176	2	120.0988	0.366	73	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,2|N<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|Fe<6>,2|C<3>}	H(C[6]C[6,6]C[6])	120.3980	0.000	1	120.0988	0.366	73	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,2|N<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|Rh<7>,2|C<3>}	H(C[6]C[6,6]C[6])	120.5790	0.000	1	120.0988	0.366	73	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>,2|C<4>}	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|Ti<9>,2|C<3>}	H(C[6]C[6,6]C[6])	120.2345	0.049	2	120.0988	0.366	73	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|N<3>,2|C<4>,2|H<1>}	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|Al<4>,1|C<3>,1|C<4>}	H(C[6]C[6,6]C[6])	119.7970	0.000	1	120.0988	0.366	73	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|N<3>,2|C<4>,2|H<1>}	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|Ni<5>,1|C<3>,1|C<4>}	H(C[6]C[6,6]C[6])	119.4960	0.088	2	120.0988	0.366	73	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|Pt<4>,2|C<3>}	H(C[6]C[6,6]C[6])	119.0230	0.000	1	120.0988	0.366	73	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|Co<5>,1|C<3>,1|C<4>}	H(C[6]C[6,6]C[6])	119.6080	0.000	1	120.0988	0.366	73	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|Fe<5>,1|C<3>,1|C<4>}	H(C[6]C[6,6]C[6])	119.6430	0.000	1	120.0988	0.366	73	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<4>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|Cu<5>,1|C<2>,1|C<3>}	H(C[6]C[6,6]C[6])	121.1600	0.000	1	120.0988	0.366	73	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|Dy<13>,1|Br<1>,1|C<3>,1|N<3>,2|C<4>}	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|Dy<13>,1|C<3>,1|C<4>}	H(C[6]C[6,6]C[6])	119.8665	0.132	2	120.0988	0.366	73	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|Co<4>,2|C<3>}	H(C[6]C[6,6]C[6])	119.7830	0.000	1	120.0988	0.366	73	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|Co<5>,2|C<3>}	H(C[6]C[6,6]C[6])	119.9943	0.095	3	120.0988	0.366	73	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|Co<6>,2|C<3>}	H(C[6]C[6,6]C[6])	120.1920	0.055	2	120.0988	0.366	73	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|Ni<3>,2|C<3>}	H(C[6]C[6,6]C[6])	120.1653	0.075	4	120.0988	0.366	73	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|Ni<4>,2|C<3>}	H(C[6]C[6,6]C[6])	120.0096	0.331	11	120.0988	0.366	73	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|Ni<5>,2|C<3>}	H(C[6]C[6,6]C[6])	120.2073	0.234	3	120.0988	0.366	73	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|Ni<6>,2|C<3>}	H(C[6]C[6,6]C[6])	119.9750	0.000	1	120.0988	0.366	73	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|Rh<5>,2|C<3>}	H(C[6]C[6,6]C[6])	120.3260	0.021	2	120.0988	0.366	73	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|N<3>,2|H<1>,3|C<4>}	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|Al<4>,1|C<3>,1|C<4>}	H(C[6]C[6,6]C[6])	119.5330	0.000	1	120.0988	0.366	73	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|N<3>,2|H<1>,3|C<4>}	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|Al<5>,1|C<3>,1|C<4>}	H(C[6]C[6,6]C[6])	119.7720	0.000	1	120.0988	0.366	73	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|N<3>,2|H<1>,3|C<4>}	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|Ir<6>,1|C<3>,1|C<4>}	H(C[6]C[6,6]C[6])	120.0820	0.000	1	120.0988	0.366	73	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|Ru<7>,1|H<1>,2|C<3>,2|N<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|Ru<7>,1|C<3>,1|C<4>}	H(C[6]C[6,6]C[6])	119.8520	0.000	1	120.0988	0.366	73	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|Ti<12>,1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|Ti<12>,1|C<3>,1|C<4>}	H(C[6]C[6,6]C[6])	119.6364	0.402	5	120.0988	0.366	73	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|Ti<8>,1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|Ti<8>,1|C<3>,1|C<4>}	H(C[6]C[6,6]C[6])	119.1610	0.000	1	120.0988	0.366	73	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){2|C<3>,2|H<1>,2|N<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|Ni<3>,1|C<3>,1|C<4>}	H(C[6]C[6,6]C[6])	119.9560	0.000	1	120.0988	0.366	73	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Cd<6>,1|C<2>,1|C<3>}	H(C[6]C[6,6]C[6])	115.8240	0.000	1	120.2004	0.824	119	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|N<3>,2|H<1>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Cu<5>,2|C<3>}	H(C[6]C[6,6]C[6])	120.6235	1.415	2	120.2004	0.824	119	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>,2|H<1>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Ni<4>,2|C<3>}	H(C[6]C[6,6]C[6])	120.0550	0.000	1	120.2004	0.824	119	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>,3|H<1>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Al<4>,1|C<3>,1|C<4>}	H(C[6]C[6,6]C[6])	119.9600	0.000	1	120.2004	0.824	119	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>,3|H<1>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6,6]C[6])	119.5090	0.000	1	120.2004	0.824	119	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>,3|H<1>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|C<4>}	H(C[6]C[6,6]C[6])	120.1220	0.233	9	120.2004	0.824	119	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>,3|H<1>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Mg<5>,1|C<3>,1|C<4>}	H(C[6]C[6,6]C[6])	119.3250	0.000	1	120.2004	0.824	119	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>,3|H<1>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Ni<5>,1|C<3>,1|C<4>}	H(C[6]C[6,6]C[6])	120.1160	0.211	5	120.2004	0.824	119	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>,3|H<1>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|C<4>}	H(C[6]C[6,6]C[6])	119.4760	0.982	4	120.2004	0.824	119	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>,3|H<1>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|C<4>}	H(C[6]C[6,6]C[6])	119.7520	0.171	3	120.2004	0.824	119	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>,3|H<1>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|C<4>}	H(C[6]C[6,6]C[6])	120.4165	0.334	2	120.2004	0.824	119	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>,3|H<1>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|C<4>}	H(C[6]C[6,6]C[6])	120.2070	0.000	1	120.2004	0.824	119	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|N<3>,2|C<4>,2|H<1>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6,6]C[6])	119.3380	0.000	1	120.2004	0.824	119	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|N<3>,2|C<4>,2|H<1>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|O<1>}	H(C[6]C[6,6]C[6])	120.7610	0.000	1	120.2004	0.824	119	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|N<3>,2|C<4>,2|H<1>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|C<3>,2|C<4>}	H(C[6]C[6,6]C[6])	120.1707	0.316	4	120.2004	0.824	119	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,2|H<1>,2|N<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Cu<3>,2|C<3>}	H(C[6]C[6,6]C[6])	120.5210	0.000	1	120.2004	0.824	119	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,2|H<1>,2|N<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Cu<4>,2|C<3>}	H(C[6]C[6,6]C[6])	120.4780	0.000	1	120.2004	0.824	119	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,2|H<1>,2|N<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Cu<5>,2|C<3>}	H(C[6]C[6,6]C[6])	119.6810	0.000	1	120.2004	0.824	119	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,2|H<1>,2|N<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Ir<8>,2|C<3>}	H(C[6]C[6,6]C[6])	120.1360	0.000	1	120.2004	0.824	119	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,2|H<1>,2|N<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Pd<4>,2|C<3>}	H(C[6]C[6,6]C[6])	119.6120	0.920	4	120.2004	0.824	119	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,2|H<1>,2|N<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Re<5>,2|C<3>}	H(C[6]C[6,6]C[6])	120.6040	0.000	1	120.2004	0.824	119	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,2|H<1>,2|N<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Rh<5>,2|C<3>}	H(C[6]C[6,6]C[6])	120.3094	0.472	5	120.2004	0.824	119	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,2|H<1>,2|N<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Rh<6>,2|C<3>}	H(C[6]C[6,6]C[6])	120.6160	0.000	1	120.2004	0.824	119	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,2|H<1>,2|N<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Ru<5>,2|C<3>}	H(C[6]C[6,6]C[6])	120.4098	0.295	18	120.2004	0.824	119	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,2|H<1>,2|N<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Ru<8>,2|C<3>}	H(C[6]C[6,6]C[6])	121.1170	0.000	1	120.2004	0.824	119	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Ru<6>,2|C<3>}	H(C[6]C[6,6]C[6])	123.7730	0.000	1	120.2004	0.824	119	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>,2|C<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Co<6>,2|C<3>}	H(C[6]C[6,6]C[6])	120.3223	0.145	3	120.2004	0.824	119	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>,2|C<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6,6]C[6])	120.2004	0.139	5	120.2004	0.824	119	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>,2|C<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Hg<6>,2|C<3>}	H(C[6]C[6,6]C[6])	120.7380	0.632	4	120.2004	0.824	119	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>,2|C<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Ir<8>,2|C<3>}	H(C[6]C[6,6]C[6])	120.5690	0.000	1	120.2004	0.824	119	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>,2|C<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Mn<6>,2|C<3>}	H(C[6]C[6,6]C[6])	119.9200	0.813	4	120.2004	0.824	119	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>,2|C<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Mn<7>,2|C<3>}	H(C[6]C[6,6]C[6])	120.6350	0.000	1	120.2004	0.824	119	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>,2|C<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Os<9>,2|C<3>}	H(C[6]C[6,6]C[6])	120.9910	0.000	1	120.2004	0.824	119	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>,2|C<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Pt<4>,2|C<3>}	H(C[6]C[6,6]C[6])	120.6570	0.420	2	120.2004	0.824	119	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>,2|C<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Re<6>,2|C<3>}	H(C[6]C[6,6]C[6])	120.2240	1.266	2	120.2004	0.824	119	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>,2|C<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Rh<8>,2|C<3>}	H(C[6]C[6,6]C[6])	120.6530	0.000	1	120.2004	0.824	119	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>,2|C<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Ru<6>,2|C<3>}	H(C[6]C[6,6]C[6])	120.7140	0.000	1	120.2004	0.824	119	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>,2|C<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Ru<9>,2|C<3>}	H(C[6]C[6,6]C[6])	120.8210	0.000	1	120.2004	0.824	119	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>,2|C<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Zn<6>,2|C<3>}	H(C[6]C[6,6]C[6])	120.3185	0.606	6	120.2004	0.824	119	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Cu<5>,1|C<2>,1|C<3>}	H(C[6]C[6,6]C[6])	119.8050	1.532	2	120.2004	0.824	119	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Ru<6>,2|C<3>}	H(C[6]C[6,6]C[6])	124.5640	0.000	1	120.2004	0.824	119	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Zn<6>,2|C<3>}	H(C[6]C[6,6]C[6])	117.1580	0.000	1	120.2004	0.824	119	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|N<3>,2|C<4>,3|H<1>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Al<4>,1|C<3>,1|C<4>}	H(C[6]C[6,6]C[6])	119.4310	0.000	1	120.2004	0.824	119	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|N<3>,2|C<4>,3|H<1>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Al<5>,1|C<3>,1|C<4>}	H(C[6]C[6,6]C[6])	119.8810	0.000	1	120.2004	0.824	119	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|N<3>,2|C<4>,3|H<1>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|O<1>}	H(C[6]C[6,6]C[6])	119.6600	0.236	2	120.2004	0.824	119	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|N<3>,2|C<4>,3|H<1>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|C<4>}	H(C[6]C[6,6]C[6])	119.9350	0.000	1	120.2004	0.824	119	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|N<3>,2|C<4>,3|H<1>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Mg<5>,1|C<3>,1|C<4>}	H(C[6]C[6,6]C[6])	120.0495	0.390	2	120.2004	0.824	119	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|N<3>,2|C<4>,3|H<1>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|C<4>}	H(C[6]C[6,6]C[6])	119.9610	0.842	3	120.2004	0.824	119	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|Ru<7>,1|C<3>,2|H<1>,2|N<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Ru<7>,1|C<3>,1|C<4>}	H(C[6]C[6,6]C[6])	120.4380	0.000	1	120.2004	0.824	119	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]N)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<2>,2|N<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]N)(H){1|Cu<3>,2|C<3>}	H(C[6]C[6,6]C[6])	119.2820	0.000	1	120.1599	1.142	8	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]N)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,3|N<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]N)(H){1|Co<6>,2|C<3>}	H(C[6]C[6,6]C[6])	119.5270	0.129	2	120.1599	1.142	8	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]N)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,3|N<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]N)(H){1|Cu<3>,2|C<3>}	H(C[6]C[6,6]C[6])	120.1395	0.094	2	120.1599	1.142	8	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]N)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,3|N<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]N)(H){1|Cu<4>,2|C<3>}	H(C[6]C[6,6]C[6])	119.9650	0.000	1	120.1599	1.142	8	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]N)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|N<2>,1|N<3>,2|C<4>,2|H<1>}	C[6](C[6]C[6,6]H)(C[6]N[6]N)(H){1|Li<4>,1|C<3>,1|C<4>}	H(C[6]C[6,6]C[6])	121.3495	1.877	2	120.1599	1.142	8	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]O)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>,1|N<3>,1|O<1>}	C[6](C[6]C[6,6]H)(C[6]N[6]O)(H){2|C<3>}	H(C[6]C[6,6]C[6])	119.8335	0.060	4	119.8516	0.141	8	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]O)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>,2|N<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]O)(H){1|Cu<4>,2|C<3>}	H(C[6]C[6,6]C[6])	120.1225	0.032	2	119.8516	0.141	8	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]O)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>,2|N<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]O)(H){1|Pt<4>,2|C<3>}	H(C[6]C[6,6]C[6])	120.2160	0.000	1	119.8516	0.141	8	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]O)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|N<3>,1|O<1>,2|C<4>,2|H<1>}	C[6](C[6]C[6,6]H)(C[6]N[6]O)(H){1|C<3>,2|C<4>}	H(C[6]C[6,6]C[6])	119.0180	0.000	1	119.8516	0.141	8	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,2|H<1>,2|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6,6]H)(H){1|Ru<5>,1|C<4>,1|N<3>,2|C<3>}	H(C[6]C[6,6]C[6])	118.8470	0.000	1	120.1116	0.200	12	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6,6]H)(H){1|Cu<3>,1|N<3>,3|C<3>}	H(C[6]C[6,6]C[6])	120.1640	0.000	1	120.1116	0.200	12	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6,6]H)(H){1|Cu<4>,1|N<3>,3|C<3>}	H(C[6]C[6,6]C[6])	120.3800	0.000	1	120.1116	0.200	12	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6,6]H)(H){1|Pd<3>,1|N<3>,3|C<3>}	H(C[6]C[6,6]C[6])	120.0730	0.153	2	120.1116	0.200	12	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6,6]H)(H){1|Pd<4>,1|N<3>,3|C<3>}	H(C[6]C[6,6]C[6])	120.2780	0.000	1	120.1116	0.200	12	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6,6]H)(H){1|Re<5>,1|N<3>,3|C<3>}	H(C[6]C[6,6]C[6])	120.4950	0.000	1	120.1116	0.200	12	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6,6]H)(H){1|Rh<5>,1|C<4>,3|C<3>}	H(C[6]C[6,6]C[6])	119.8060	0.000	1	120.1116	0.200	12	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6,6]H)(H){1|Ru<5>,1|N<3>,3|C<3>}	H(C[6]C[6,6]C[6])	120.3058	0.163	4	120.1116	0.200	12	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6a]N[6])(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6a]N[6])(C[6]C[6,6]H)(H){1|Ni<4>,1|C<4>,3|C<3>}	H(C[6]C[6,6]C[6])	119.9243	0.257	3	119.6889	0.075	7	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6a]N[6])(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6a]N[6])(C[6]C[6,6]H)(H){1|Pd<4>,1|C<4>,3|C<3>}	H(C[6]C[6,6]C[6])	119.5313	0.102	3	119.6889	0.075	7	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6a]N[6])(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){2|N<3>,3|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6,6]H)(H){1|Rh<5>,4|C<3>}	H(C[6]C[6,6]C[6])	119.4550	0.000	1	119.6889	0.075	7	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]N[5]N[6])(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,3|N<3>}	C[6](C[6]N[5]N[6])(C[6]C[6,6]H)(H){1|Ni<6>,1|N<3>,3|C<3>}	H(C[6]C[6,6]C[6])	120.1557	0.483	3	120.1557	0.234	3	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]N[6,6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]C)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]N[6,6])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6,6]C[6])	120.2075	0.146	2	120.2075	0.021	2	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]N[6,6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]N[6,6])(C[6]C[6]H)(H){1|C<3>,2|H<1>,3|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<4>,1|N<3>,1|O<2>}	H(C[6]C[6,6]C[6])	120.1975	0.650	2	120.7359	2.301	26	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]N[6,6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]N[6,6])(C[6]C[6]H)(H){1|C<3>,2|H<1>,3|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<4>,1|N<3>,1|S<1>}	H(C[6]C[6,6]C[6])	125.6710	0.000	1	120.7359	2.301	26	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]N[6,6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]N[6,6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6,6]C[6])	120.6783	1.244	20	120.7359	2.301	26	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]N[6,6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]N[6,6])(C[6]C[6]H)(H){1|Ge<3>,1|C<3>,1|H<1>,1|N<3>,2|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6,6]C[6])	119.6350	0.165	2	120.7359	2.301	26	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]N[6,6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]N[6,6])(C[6]C[6]H)(H){1|Rh<9>,1|H<1>,2|C<3>,2|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6,6]C[6])	120.2320	0.000	1	120.7359	2.301	26	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]N[6])(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|N<2>,2|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|N<3>}	H(C[6]C[6,6]C[6])	120.4740	0.000	1	120.4740	0.000	1	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]N[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<1>,1|O<2>}	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6,6]C[6])	119.8410	0.000	1	119.4908	0.155	5	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]N[6])(C[6]C[6]H)(H){1|C<4>,1|O<1>,2|C<3>}	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6,6]C[6])	119.1475	0.404	2	119.4908	0.155	5	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]N[6])(C[6]C[6]H)(H){1|C<4>,2|C<3>,2|O<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6,6]C[6])	119.6590	0.208	2	119.4908	0.155	5	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]N[6])(C[6]C[6]H)(H){1|Yb<12>,1|C<3>,1|H<1>,2|N<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|N<3>}	H(C[6]C[6,6]C[6])	120.7010	0.035	2	120.5162	0.051	4	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]N[6])(C[6]C[6]H)(H){1|Yb<13>,1|C<3>,1|H<1>,2|N<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Pd<6>,1|C<3>,1|N<3>}	H(C[6]C[6,6]C[6])	120.3315	0.124	2	120.5162	0.051	4	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]N[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6,6]H)(H){1|Ru<6>,2|C<3>,2|N<3>}	H(C[6]C[6,6]C[6])	120.2010	0.196	3	120.2010	0.038	3	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]O[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]C)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]O[6])(C[6]C[6]H)(H){1|C<4>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6]H)(C[6]C[6]C)(H){1|C<3>,1|O<1>,1|O<2>}	H(C[6]C[6,6]C[6])	119.7480	0.000	1	119.7480	0.000	1	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]O[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]O[6])(C[6]C[6]H)(H){1|C<3>,1|N<3>,2|C<4>}	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|C<3>,1|C<4>,1|O<2>}	H(C[6]C[6,6]C[6])	121.0105	0.256	4	121.0105	0.066	4	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]O[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]O[6])(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|O<2>}	H(C[6]C[6,6]C[6])	120.7590	0.000	1	120.7590	0.000	1	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6a]C[6,6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]S)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]C[6,6])(C[6]C[6]H)(H){1|H<1>,1|S<4>,2|C<3>,2|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]S)(H){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6,6]C[6])	119.2080	0.584	2	119.2080	0.341	2	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6a]C[6,6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]C[6,6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Mn<6>,2|C<3>}	H(C[6]C[6,6]C[6])	120.1080	0.000	1	120.1080	0.000	1	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6a]N[3x6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)2(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]N[3x6])(C[6]C[6]H)(H){1|B<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6,6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6,6]C[6])	120.3718	1.067	12	120.3529	0.967	14	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6a]N[3x6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)2(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]N[3x6])(C[6]C[6]H)(H){1|H<1>,1|P<3>,3|C<3>}	C[6](C[6]C[6,6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6,6]C[6])	120.2400	0.116	2	120.3529	0.967	14	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6a]N[6,6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]C)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]N[6,6])(C[6]C[6]H)(H){1|B<4>,1|C<4>,3|C<3>}	C[6](C[6]C[6,6]H)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6,6]C[6])	119.7630	0.000	1	119.7630	0.000	1	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6a]N[6,6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]N[6,6])(C[6]C[6]H)(H){1|B<4>,1|H<1>,1|N<2>,2|C<3>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6,6]C[6])	119.7330	0.065	2	119.9065	0.992	25	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6a]N[6,6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]N[6,6])(C[6]C[6]H)(H){1|B<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6,6]C[6])	119.8280	0.045	2	119.9065	0.992	25	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6a]N[6,6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]N[6,6])(C[6]C[6]H)(H){1|B<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6,6]C[6])	120.0629	1.347	13	119.9065	0.992	25	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6a]N[6,6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]N[6,6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6,6]C[6])	119.6020	0.213	3	119.9065	0.992	25	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6a]N[6,6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]N[6,6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|N<3>,2|C<3>}	H(C[6]C[6,6]C[6])	120.1710	0.070	3	119.9065	0.992	25	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6a]N[6,6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]N[6,6])(C[6]C[6]H)(H){1|H<1>,4|C<3>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6,6]C[6])	119.2020	0.218	2	119.9065	0.992	25	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]N[3x6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)2(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[3x6]N[6])(C[6]C[6]H)(H){1|B<4>,1|H<1>,2|C<3>}	C[6](C[6]C[6,6]H)2(H){1|N<3>,2|N<2>}	H(C[6]C[6,6]C[6])	120.3102	0.194	8	120.3102	0.038	8	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]N[5,6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[5,6,6]C[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,4|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6,6]H)(H){1|N<3>,2|C<4>}	H(C[6]C[6,6]C[6])	120.1150	0.000	1	120.1150	0.000	1	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]N[5a,6]N[6,6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[5a,6]N[6,6])(C[6]C[6]H)(H){1|B<4>,1|H<1>,1|N<2>,2|C<3>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	H(C[6]C[6,6]C[6])	120.7920	0.000	1	119.8855	1.643	2	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]N[5a,6]N[6,6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[5a,6]N[6,6])(C[6]C[6]H)(H){1|H<1>,4|C<3>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	H(C[6]C[6,6]C[6])	118.9790	0.000	1	119.8855	1.643	2	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H){1|B<4>,1|C<2>,1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6,6]C[6])	120.1450	0.054	2	119.7405	0.166	74	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H){1|B<4>,1|C<2>,1|H<1>,2|C<3>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6,6]C[6])	119.7967	0.233	10	119.7405	0.166	74	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|C<4>,1|H<1>,1|N<2>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6,6]C[6])	121.8250	0.000	1	119.7405	0.166	74	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|C<4>,3|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6,6]C[6])	119.7261	0.109	9	119.7405	0.166	74	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>,1|N<3>,1|O<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6,6]C[6])	120.3710	0.000	1	119.7405	0.166	74	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H){1|B<4>,1|H<1>,1|N<2>,2|C<3>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6,6]C[6])	119.8825	0.110	2	119.7405	0.166	74	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H){1|B<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6,6]C[6])	119.4480	0.226	15	119.7405	0.166	74	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H){1|B<4>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6,6]C[6])	119.6866	0.199	16	119.7405	0.166	74	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H){1|B<4>,2|C<3>,3|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6,6]C[6])	120.5700	0.000	1	119.7405	0.166	74	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>,3|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6,6]C[6])	119.9895	0.129	2	119.7405	0.166	74	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<3>,3|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6,6]C[6])	118.6270	0.000	1	119.7405	0.166	74	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H){1|C<4>,1|O<2>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6,6]C[6])	119.5370	0.000	1	119.7405	0.166	74	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6,6]C[6])	119.4100	0.000	1	119.7405	0.166	74	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H){1|Ga<4>,2|C<3>,3|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6,6]C[6])	119.9015	0.226	2	119.7405	0.166	74	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H){1|Ga<5>,2|C<3>,3|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6,6]C[6])	120.1445	0.108	2	119.7405	0.166	74	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H){1|Ge<4>,1|Si<4>,1|H<1>,2|C<3>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6,6]C[6])	119.5965	0.308	4	119.7405	0.166	74	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H){1|In<6>,2|C<3>,3|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6,6]C[6])	120.2780	0.199	2	119.7405	0.166	74	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H){1|N<2>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6,6]C[6])	119.4980	0.000	1	119.7405	0.166	74	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H){1|Nb<6>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6,6]C[6])	119.6830	0.000	1	119.7405	0.166	74	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6])(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H){1|B<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6a]C[6])(C[6]C[6,6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6,6]C[6])	119.5450	0.000	1	119.5450	0.000	1	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(H){1|B<4>,1|H<1>,2|C<3>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Cl<1>,1|N<2>,1|N<3>}	H(C[6]C[6,6]C[6])	119.4400	0.000	1	120.1041	1.533	27	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(H){1|B<4>,1|H<1>,2|C<3>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6,6]C[6])	119.9055	0.229	13	120.1041	1.533	27	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(H){1|B<4>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	H(C[6]C[6,6]C[6])	119.8465	0.323	2	120.1041	1.533	27	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6,6]C[6])	125.1520	0.000	1	120.1041	1.533	27	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,4|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|N<4>}	H(C[6]C[6,6]C[6])	120.2030	0.000	1	120.1041	1.533	27	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	H(C[6]C[6,6]C[6])	121.5705	2.122	2	120.1041	1.533	27	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,2|C<3>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6,6]C[6])	119.5540	0.165	2	120.1041	1.533	27	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(H){1|Ge<3>,1|H<1>,2|C<3>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6,6]C[6])	119.1130	0.150	3	120.1041	1.533	27	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(H){1|In<6>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	H(C[6]C[6,6]C[6])	119.9815	0.313	2	120.1041	1.533	27	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]N[6,6]O[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]O[6])(C[6]C[6]H)(H){1|B<4>,1|H<1>,2|C<3>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6,6]C[6])	120.9480	0.000	1	120.9480	0.000	1	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]N[6,6]S[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]S[6])(C[6]C[6]H)(H){1|H<1>,3|C<3>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[6,6]C[6])	119.2250	0.000	1	119.2250	0.000	1	120.1194	0.973	498	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6,6]C[5,6,6]C[6,6a])(C[6]C[6]O)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6,6]C[6,6a])(C[6]C[6]O)(H){1|H<1>,1|N<3>,4|C<3>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(O){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6,6]C[6])	118.7920	0.000	1	118.7920	0.000	1	118.2972	1.076	82	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6]O)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6]O)(H){1|H<1>,1|N<2>,2|C<3>,2|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(O){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6,6]C[6])	118.7550	0.000	1	118.7550	0.000	1	118.2972	1.076	82	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6,6]C[6,6]2)(C[6]C[6]O)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]C)(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2)(C[6]C[6]O)(H){1|C<3>,1|O<2>,5|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]C)(O){1|H<1>,2|C<4>}	H(C[6]C[6,6]C[6])	118.4010	0.000	1	118.1413	0.051	3	118.2972	1.076	82	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6,6]C[6,6]2)(C[6]C[6]O)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]C)(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2)(C[6]C[6]O)(H){2|C<2>,2|C<3>,3|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]C)(O){1|H<1>,2|C<4>}	H(C[6]C[6,6]C[6])	118.0115	0.042	2	118.1413	0.051	3	118.2972	1.076	82	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6,6]C[6,6]2)(C[6]C[6]O)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2)(C[6]C[6]O)(H){1|O<2>,2|C<3>,3|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]O)(O){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6,6]C[6])	119.0780	0.000	1	119.0780	0.000	1	118.2972	1.076	82	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]Br)(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){1|Br<1>,1|C<3>,2|H<1>,3|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]Br)(O){1|H<1>,2|C<4>}	H(C[6]C[6,6]C[6])	118.4050	0.102	2	118.4050	0.010	2	118.2972	1.076	82	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]C)(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){1|C<3>,2|H<1>,4|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]C)(O){1|H<1>,1|O<2>,2|C<4>}	H(C[6]C[6,6]C[6])	117.7350	0.000	1	117.9670	0.135	3	118.2972	1.076	82	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]C)(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){1|H<1>,1|O<2>,2|C<3>,3|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]C)(O){1|H<1>,2|C<4>}	H(C[6]C[6,6]C[6])	118.0830	0.434	2	117.9670	0.135	3	118.2972	1.076	82	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|O<1>,3|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(O){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6,6]C[6])	119.1770	0.000	1	118.2780	1.385	60	118.2972	1.076	82	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){1|C<3>,1|O<2>,2|C<4>,3|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(O){1|H<1>,2|C<4>}	H(C[6]C[6,6]C[6])	118.9130	0.000	1	118.2780	1.385	60	118.2972	1.076	82	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){1|C<3>,3|C<4>,3|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(O){1|H<1>,2|C<4>}	H(C[6]C[6,6]C[6])	118.2219	1.372	43	118.2780	1.385	60	118.2972	1.076	82	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(O){1|H<1>,2|C<3>}	H(C[6]C[6,6]C[6])	118.4415	0.156	2	118.2780	1.385	60	118.2972	1.076	82	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){1|C<4>,1|O<2>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(O){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6,6]C[6])	118.4720	0.000	1	118.2780	1.385	60	118.2972	1.076	82	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){1|F<1>,1|H<1>,2|C<4>,3|C<3>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(O){1|H<1>,2|C<4>}	H(C[6]C[6,6]C[6])	118.0768	0.220	6	118.2780	1.385	60	118.2972	1.076	82	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){1|H<1>,1|N<2>,2|C<3>,2|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(O){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6,6]C[6])	118.2740	0.158	2	118.2780	1.385	60	118.2972	1.076	82	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){1|H<1>,2|C<3>,3|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(O){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6,6]C[6])	118.7160	0.000	1	118.2780	1.385	60	118.2972	1.076	82	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){2|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(O){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6,6]C[6])	118.6435	0.148	2	118.2780	1.385	60	118.2972	1.076	82	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){2|C<3>,2|C<4>,3|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(O){1|H<1>,2|C<4>}	H(C[6]C[6,6]C[6])	118.6820	0.000	1	118.2780	1.385	60	118.2972	1.076	82	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){1|C<3>,1|H<1>,2|O<2>,3|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]O)(O){1|H<1>,2|C<4>}	H(C[6]C[6,6]C[6])	118.3560	0.000	1	118.2528	0.024	5	118.2972	1.076	82	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){1|C<3>,1|O<2>,2|H<1>,3|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]O)(O){1|H<1>,2|C<4>}	H(C[6]C[6,6]C[6])	118.2270	0.167	4	118.2528	0.024	5	118.2972	1.076	82	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6,6]C[6,6]O[6])(C[6]C[6]O)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]O[6])(C[6]C[6]O)(H){1|C<4>,1|H<1>,2|C<3>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(O){1|C<3>,2|O<2>}	H(C[6]C[6,6]C[6])	119.8090	0.000	1	119.8090	0.000	1	118.2972	1.076	82	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6,6]C[6,6]P[6])(C[6]C[6]O)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]P[6])(C[6]C[6]O)(H){1|H<1>,1|O<1>,4|C<3>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(O){1|C<3>,1|H<1>,1|P<4>}	H(C[6]C[6,6]C[6])	119.0910	0.000	1	119.0910	0.000	1	118.2972	1.076	82	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6,6]C[6,6a]C[6,6])(C[6]C[6]O)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]C[6,6])(C[6]C[6]O)(H){1|C<4>,1|O<2>,4|C<3>}	C[6](C[6]C[6,6]H)(C[6]C[6]O)(O){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6,6]C[6])	117.9407	0.127	4	117.9407	0.016	4	118.2972	1.076	82	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	N[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]N[5a,6]H)(H)	C[6](N[5a,6]C[5a,6]C[5a])(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]N[5a,6]H)(H){1|O<1>,4|C<3>}	C[6](N[5a,6]C[5a,6]C[5a])(C[6]C[6,6]H)(H){1|C<4>,1|N<2>,3|C<3>}	H(C[6]C[6,6]C[6])	120.0110	0.000	1	120.0110	0.000	1	120.0110	0.000	1	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6,6a]C[6])(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Ru)(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6,6a]C[6])(C[6]N[6]H)(H){1|Ru<9>,1|H<1>,3|C<3>}	C[6](N[6]C[6,6a]Ru)(C[6]C[6,6]H)(H){3|C<3>}	H(C[6]C[6,6]C[6])	119.8300	0.030	2	119.8300	0.001	2	119.8300	0.001	2	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[4,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[4,6]H)(H)	C[6](C[4,6]C[4,4]N[4,6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[4,6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[4,6]C[4,4]N[4,6])(C[6]C[6,6a]H)(H){2|Ge<3>,1|P<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.1400	0.000	1	119.1400	0.000	1	119.1400	0.000	1	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,5,6]C[5])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H){1|C<4>,1|H<1>,3|C<3>}	C[6](C[5,6]C[5,5,6]C[5])(C[6]C[6,6a]H)(H){1|H<1>,2|C<4>,3|C<3>}	H(C[6]C[6,6a]C[6])	118.3910	0.000	1	118.3910	0.000	1	119.0642	1.088	24	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,6]N[5,6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[5,6]C[5,6]N[5,6])(C[6]C[6,6a]H)(H){1|C<4>,4|C<3>}	H(C[6]C[6,6a]C[6])	119.0010	0.065	2	119.0010	0.004	2	119.0642	1.088	24	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,6a]N[5,6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[5,6]C[5,6a]N[5,6])(C[6]C[6,6a]H)(H){1|B<4>,4|C<3>}	H(C[6]C[6,6a]C[6])	119.6020	0.092	4	119.6020	0.008	4	119.0642	1.088	24	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H)	C[6](C[5,6]N[5,5]N[5,6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H){1|C<3>,1|C<4>,1|N<2>,2|N<3>}	C[6](C[5,6]N[5,5]N[5,6])(C[6]C[6,6a]H)(H){1|N<3>,2|B<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.2430	0.000	1	119.2430	0.000	1	119.0642	1.088	24	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H)	C[6](C[5,6]N[5,6]2)(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6](C[5,6]N[5,6]2)(C[6]C[6,6a]H)(H){1|P<2>,4|C<3>}	H(C[6]C[6,6a]C[6])	119.6740	0.000	1	119.6740	0.000	1	119.0642	1.088	24	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H)	C[6](C[5,6]N[5,6]C[5])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5,6]N[5,6]C[5])(C[6]C[6,6a]H)(H){1|C<4>,1|O<2>,4|C<3>}	H(C[6]C[6,6a]C[6])	119.7520	0.000	1	119.9894	0.243	5	119.0642	1.088	24	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H)	C[6](C[5,6]N[5,6]C[5])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[5,6]N[5,6]C[5])(C[6]C[6,6a]H)(H){1|In<5>,1|O<1>,1|O<2>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.4865	0.179	2	119.9894	0.243	5	119.0642	1.088	24	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H)	C[6](C[5,6]N[5,6]C[5])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[5,6]N[5,6]C[5])(C[6]C[6,6a]H)(H){1|Se<2>,4|C<3>}	H(C[6]C[6,6a]C[6])	119.8380	0.000	1	119.9894	0.243	5	119.0642	1.088	24	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H)	C[6](C[5,6]N[5,6]C[5])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H){1|N<3>,1|O<2>,3|C<3>}	C[6](C[5,6]N[5,6]C[5])(C[6]C[6,6a]H)(H){2|C<4>,3|C<3>}	H(C[6]C[6,6a]C[6])	119.3840	0.000	1	119.9894	0.243	5	119.0642	1.088	24	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H)	C[6](C[5,6]N[5,6]N[5])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H){1|C<3>,1|C<4>,1|N<2>,2|N<3>}	C[6](C[5,6]N[5,6]N[5])(C[6]C[6,6a]H)(H){1|Ir<7>,4|C<3>}	H(C[6]C[6,6a]C[6])	119.3950	0.000	1	119.2493	0.026	4	119.0642	1.088	24	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H)	C[6](C[5,6]N[5,6]N[5])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H){1|C<3>,1|C<4>,1|N<2>,2|N<3>}	C[6](C[5,6]N[5,6]N[5])(C[6]C[6,6a]H)(H){1|Ir<8>,4|C<3>}	H(C[6]C[6,6a]C[6])	119.2570	0.000	1	119.2493	0.026	4	119.0642	1.088	24	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H)	C[6](C[5,6]N[5,6]N[5])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H){1|C<3>,1|C<4>,1|N<3>,2|N<2>}	C[6](C[5,6]N[5,6]N[5])(C[6]C[6,6a]H)(H){2|C<3>,2|C<4>}	H(C[6]C[6,6a]C[6])	119.1725	0.210	2	119.2493	0.026	4	119.0642	1.088	24	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H)	C[6](C[5,6]N[5,6]O[5])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H){1|H<1>,1|N<3>,1|O<2>,2|C<3>}	C[6](C[5,6]N[5,6]O[5])(C[6]C[6,6a]H)(H){1|Si<5>,1|C<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	118.7760	0.000	1	118.7760	0.000	1	119.0642	1.088	24	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H)	C[6](C[5,6]N[5,6]P[5])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H){1|H<1>,1|N<3>,1|P<2>,2|C<3>}	C[6](C[5,6]N[5,6]P[5])(C[6]C[6,6a]H)(H){1|N<3>,3|C<3>}	H(C[6]C[6,6a]C[6])	119.9070	0.000	1	119.9070	0.000	1	119.0642	1.088	24	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H)	C[6](C[5,6]P[5,6]C[5])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H){1|H<1>,1|P<3>,3|C<3>}	C[6](C[5,6]P[5,6]C[5])(C[6]C[6,6a]H)(H){1|H<1>,4|C<3>}	H(C[6]C[6,6a]C[6])	116.4680	0.000	1	117.0487	0.158	4	119.0642	1.088	24	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H)	C[6](C[5,6]P[5,6]C[5])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H){1|H<1>,1|P<4>,3|C<3>}	C[6](C[5,6]P[5,6]C[5])(C[6]C[6,6a]H)(H){1|H<1>,1|O<1>,4|C<3>}	H(C[6]C[6,6a]C[6])	117.1480	0.000	1	117.0487	0.158	4	119.0642	1.088	24	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H)	C[6](C[5,6]P[5,6]C[5])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H){1|H<1>,1|P<4>,3|C<3>}	C[6](C[5,6]P[5,6]C[5])(C[6]C[6,6a]H)(H){1|H<1>,1|S<1>,4|C<3>}	H(C[6]C[6,6a]C[6])	117.2110	0.000	1	117.0487	0.158	4	119.0642	1.088	24	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H)	C[6](C[5,6]P[5,6]C[5])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H){1|H<1>,1|P<4>,3|C<3>}	C[6](C[5,6]P[5,6]C[5])(C[6]C[6,6a]H)(H){1|Se<1>,1|H<1>,4|C<3>}	H(C[6]C[6,6a]C[6])	117.3680	0.000	1	117.0487	0.158	4	119.0642	1.088	24	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5a,6]H)(H)	C[6](C[5a,6]C[5,5a]N[5a,6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5a,6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[5a,6]C[5,5a]N[5a,6])(C[6]C[6,6a]H)(H){5|C<3>}	H(C[6]C[6,6a]C[6])	119.6270	0.000	1	119.6270	0.000	1	119.4934	0.050	9	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5a,6]H)(H)	C[6](C[5a,6]C[5a,5a]N[5a,6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5a,6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[5a,6]C[5a,5a]N[5a,6])(C[6]C[6,6a]H)(H){1|B<4>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.5300	0.000	1	119.5300	0.000	1	119.4934	0.050	9	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5a,6]H)(H)	C[6](C[5a,6]N[5a,6]C[5a])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5a,6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[5a,6]N[5a,6]C[5a])(C[6]C[6,6a]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6,6a]C[6])	119.3885	0.244	4	119.4862	0.092	5	119.4934	0.050	9	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5a,6]H)(H)	C[6](C[5a,6]N[5a,6]C[5a])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5a,6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[5a,6]N[5a,6]C[5a])(C[6]C[6,6a]H)(H){1|H<1>,4|C<3>}	H(C[6]C[6,6a]C[6])	119.8770	0.000	1	119.4862	0.092	5	119.4934	0.050	9	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5a,6]H)(H)	C[6](C[5a,6]N[5a,6]N[5a])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5a,6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	C[6](C[5a,6]N[5a,6]N[5a])(C[6]C[6,6a]H)(H){4|C<3>}	H(C[6]C[6,6a]C[6])	119.4265	0.067	2	119.4265	0.005	2	119.4934	0.050	9	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[5,6,6a]C[6a])(C[6]C[6,6]H)(H)	C[6](C[6,6]C[5,6,6]C[6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[5,6,6a]C[6a])(C[6]C[6,6]H)(H){1|C<4>,1|H<1>,3|C<3>}	C[6](C[6,6]C[5,6,6]C[6])(C[6]C[6,6a]H)(H){1|C<4>,1|H<1>,4|C<3>}	H(C[6]C[6,6a]C[6])	119.0860	0.049	2	119.0860	0.002	2	119.8969	0.403	34	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H)	C[6](C[6,6]C[3x6]N[6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H){1|C<4>,1|H<1>,1|N<2>,2|C<3>}	C[6](C[6,6]C[3x6]N[6])(C[6]C[6,6a]H)(H){2|C<3>,3|C<4>}	H(C[6]C[6,6a]C[6])	118.7810	0.000	1	118.7810	0.000	1	119.8969	0.403	34	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6]N[6,6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6,6]C[6,6]N[6,6])(C[6]C[6,6a]H)(H){1|B<4>,4|C<3>}	H(C[6]C[6,6a]C[6])	119.4895	0.186	2	119.4895	0.035	2	119.8969	0.403	34	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6a]N[6,6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6,6]C[6,6a]N[6,6])(C[6]C[6,6a]H)(H){1|B<4>,4|C<3>}	H(C[6]C[6,6a]C[6])	119.6220	0.000	1	119.6220	0.000	1	119.8969	0.403	34	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H)	C[6](C[6,6]N[6,6]C[6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6,6]N[6,6]C[6])(C[6]C[6,6a]H)(H){1|B<4>,1|C<2>,1|N<2>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.9510	0.000	1	120.3493	0.811	10	119.8969	0.403	34	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H)	C[6](C[6,6]N[6,6]C[6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6,6]N[6,6]C[6])(C[6]C[6,6a]H)(H){1|B<4>,1|H<1>,3|C<3>}	H(C[6]C[6,6a]C[6])	120.3936	0.944	9	120.3493	0.811	10	119.8969	0.403	34	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H)	C[6](C[6,6]N[6,6]N[6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H){1|C<3>,1|C<4>,1|N<3>,2|N<2>}	C[6](C[6,6]N[6,6]N[6])(C[6]C[6,6a]H)(H){1|B<4>,3|C<3>}	H(C[6]C[6,6a]C[6])	119.7923	0.285	6	119.8282	0.039	17	119.8969	0.403	34	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H)	C[6](C[6,6]N[6,6]N[6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H){1|C<3>,1|C<4>,1|N<3>,2|N<2>}	C[6](C[6,6]N[6,6]N[6])(C[6]C[6,6a]H)(H){2|C<3>,2|C<4>}	H(C[6]C[6,6a]C[6])	119.7550	0.000	1	119.8282	0.039	17	119.8969	0.403	34	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H)	C[6](C[6,6]N[6,6]N[6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H){1|C<3>,1|H<1>,1|N<2>,2|N<3>}	C[6](C[6,6]N[6,6]N[6])(C[6]C[6,6a]H)(H){1|B<4>,3|C<3>}	H(C[6]C[6,6a]C[6])	119.7430	0.000	2	119.8282	0.039	17	119.8969	0.403	34	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H)	C[6](C[6,6]N[6,6]N[6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H){1|C<3>,1|H<1>,1|N<3>,2|N<2>}	C[6](C[6,6]N[6,6]N[6])(C[6]C[6,6a]H)(H){1|B<4>,3|C<3>}	H(C[6]C[6,6a]C[6])	119.8720	0.000	1	119.8282	0.039	17	119.8969	0.403	34	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H)	C[6](C[6,6]N[6,6]N[6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	C[6](C[6,6]N[6,6]N[6])(C[6]C[6,6a]H)(H){1|B<4>,3|C<3>}	H(C[6]C[6,6a]C[6])	119.8876	0.166	7	119.8282	0.039	17	119.8969	0.403	34	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]N[6,6a])(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6a]N[6,6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]N[6,6a])(C[6]C[6,6]H)(H){1|B<4>,1|N<3>,3|C<3>}	C[6](C[6,6]C[6,6a]N[6,6])(C[6]C[6,6a]H)(H){1|B<4>,1|N<3>,3|C<3>}	H(C[6]C[6,6a]C[6])	120.3680	0.000	1	120.3680	0.000	1	119.8969	0.403	34	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]Br)(H)	C[6](C[6]C[6,6a]H)(C[6]C[5,6]O)(Br)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]Br)(H){1|C<4>,1|H<1>,1|O<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[5,6]O)(Br){1|C<4>,1|O<2>,2|C<3>}	H(C[6]C[6,6a]C[6])	118.7430	0.356	7	118.6822	0.111	9	119.6043	1.013	18	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]Br)(H)	C[6](C[6]C[6,6a]H)(C[6]C[5,6]O)(Br)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]Br)(H){1|C<4>,1|H<1>,1|O<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[5,6]O)(Br){4|C<3>}	H(C[6]C[6,6a]C[6])	118.4695	0.088	2	118.6822	0.111	9	119.6043	1.013	18	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]Br)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(Br)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]Br)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(Br){1|Cu<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.5263	0.361	9	120.5263	0.130	9	119.6043	1.013	18	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]Cl)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(Cl)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]Cl)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(Cl){1|Zn<5>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.3730	0.000	1	120.3730	0.000	1	120.3730	0.000	1	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[5,6,6a]C[6,6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[5,6,6a]C[6,6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|C<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.6180	0.000	1	119.6180	0.000	1	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[5,6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[5,5,6]O)(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[5,6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<1>,2|C<3>}	C[6](C[6]C[5,5,6]O)(C[6]C[6,6a]H)(H){1|C<4>,1|O<2>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.1305	0.083	2	119.1305	0.007	2	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[5,6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[5,6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[5,6]C)(H){1|Ga<5>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.7143	0.132	7	119.7806	0.050	8	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[5,6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[5,6,6a]C[6a])(C[6]C[6]H)(H){1|Cl<1>,1|C<4>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[5,6]C)(H){1|Ga<5>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.2450	0.000	1	119.7806	0.050	8	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[5,6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[5,6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H){1|Ga<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.1880	0.000	1	119.8923	0.299	66	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[5,6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[5,6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H){1|Ga<5>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.0985	0.028	2	119.8923	0.299	66	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[5,6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[5,6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H){1|Ga<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.8591	0.671	11	119.8923	0.299	66	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[5,6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[5,6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H){1|Ge<2>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.3060	0.000	1	119.8923	0.299	66	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[5,6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[5,6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H){1|Ge<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.7185	0.098	2	119.8923	0.299	66	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[5,6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[5,6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H){1|In<5>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.2460	0.000	1	119.8923	0.299	66	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[5,6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[5,6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H){1|In<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.6122	0.548	28	119.8923	0.299	66	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[5,6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[5,6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H){1|Nb<7>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.6700	0.314	2	119.8923	0.299	66	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[5,6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[5,6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H){1|Si<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.3102	0.208	18	119.8923	0.299	66	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[5,6a]C[6,6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[5,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Co<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.2640	0.000	1	120.2325	0.184	42	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[5,6a]C[6,6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[5,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Cu<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.1653	0.498	6	120.2325	0.184	42	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[5,6a]C[6,6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[5,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Cu<5>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.3047	0.255	6	120.2325	0.184	42	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[5,6a]C[6,6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[5,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Fe<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.2905	0.518	15	120.2325	0.184	42	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[5,6a]C[6,6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[5,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.6850	0.000	1	120.2325	0.184	42	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[5,6a]C[6,6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[5,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ru<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.2355	0.312	2	120.2325	0.184	42	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[5,6a]C[6,6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[5,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Pt<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.9627	0.386	3	120.2325	0.184	42	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[5,6a]C[6,6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[5,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Cu<5>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.1340	0.085	2	120.2325	0.184	42	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[5,6a]C[6,6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[5,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.8615	0.012	2	120.2325	0.184	42	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[5,6a]C[6,6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[5,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ru<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.5140	0.530	2	120.2325	0.184	42	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[5,6a]C[6,6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[5,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ru<9>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.6310	0.404	2	120.2325	0.184	42	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[5,6a]N[6,6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[5,6a]N[6,6a])(C[6]C[6]H)(H){1|H<1>,4|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6,6a]C[6])	119.3750	0.000	1	119.3750	0.000	1	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[5a,6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[5a,6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[5a,6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[5a,6]C)(H){1|B<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.8800	0.000	1	119.8800	0.000	1	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[5a,6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[5a,6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[5a,6,6a]C[6a])(C[6]C[6]H)(H){1|Br<1>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[5a,6]H)(H){1|B<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.2020	0.000	1	120.3226	0.968	45	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[5a,6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[5a,6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[5a,6,6a]C[6a])(C[6]C[6]H)(H){1|Cl<1>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[5a,6]H)(H){1|B<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.7230	0.000	1	120.3226	0.968	45	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[5a,6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[5a,6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[5a,6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|I<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[5a,6]H)(H){1|B<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	118.5540	2.008	2	120.3226	0.968	45	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[5a,6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[5a,6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[5a,6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[5a,6]H)(H){1|B<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.4265	0.888	41	120.3226	0.968	45	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Cd<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.3870	0.000	1	120.5242	0.251	77	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Co<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.3000	0.000	1	120.5242	0.251	77	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Cu<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.6233	0.166	3	120.5242	0.251	77	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Cu<5>,2|C<3>}	H(C[6]C[6,6a]C[6])	122.1330	2.008	2	120.5242	0.251	77	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Cu<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.4410	0.068	2	120.5242	0.251	77	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Fe<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.5641	0.204	20	120.5242	0.251	77	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.7865	0.122	2	120.5242	0.251	77	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Hg<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.4390	0.000	1	120.5242	0.251	77	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ir<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.2560	0.310	5	120.5242	0.251	77	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Mn<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.3770	0.184	5	120.5242	0.251	77	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ni<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.4100	0.260	2	120.5242	0.251	77	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ru<9>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.1150	0.000	1	120.5242	0.251	77	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Cd<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.1350	0.000	1	120.5242	0.251	77	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Co<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.1690	0.000	1	120.5242	0.251	77	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Cu<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.5690	0.143	3	120.5242	0.251	77	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Cu<5>,2|C<3>}	H(C[6]C[6,6a]C[6])	121.8405	0.187	2	120.5242	0.251	77	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Fe<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.5976	0.162	9	120.5242	0.251	77	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.5480	0.065	2	120.5242	0.251	77	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Hg<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.7020	0.000	1	120.5242	0.251	77	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ir<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.5602	0.265	5	120.5242	0.251	77	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Mn<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.5092	0.153	5	120.5242	0.251	77	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ni<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.3395	0.015	2	120.5242	0.251	77	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ru<9>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.3660	0.000	1	120.5242	0.251	77	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6,6]O)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6,6]O)(H){1|O<2>,3|C<3>}	H(C[6]C[6,6a]C[6])	119.1045	0.173	2	119.1045	0.030	2	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6,6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6,6]C)(H){1|C<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.6370	0.000	1	119.6370	0.000	1	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6,6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6,6a]C[6a])(C[6]C[6]H)(H){1|Cl<1>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6,6]H)(H){3|C<3>}	H(C[6]C[6,6a]C[6])	119.9910	0.000	1	120.2063	0.363	15	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6,6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6,6]H)(H){1|B<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.3455	0.667	2	120.2063	0.363	15	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6,6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6,6]H)(H){1|C<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.3293	0.681	9	120.2063	0.363	15	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6,6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6,6]H)(H){1|Ga<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.8190	0.495	2	120.2063	0.363	15	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6,6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6,6]H)(H){1|O<2>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.8110	0.000	1	120.2063	0.363	15	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6,6a]O)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|O<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6,6a]O)(H){3|C<3>}	H(C[6]C[6,6a]C[6])	119.0887	0.334	7	119.0429	0.092	9	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6,6a]O)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a,6a]C[6a])(C[6]C[6]H)(H){1|O<1>,4|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6,6a]O)(H){3|C<3>}	H(C[6]C[6,6a]C[6])	118.8825	0.063	2	119.0429	0.092	9	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6,6a]H)(H){3|C<3>}	H(C[6]C[6,6a]C[6])	119.9100	0.000	1	119.9100	0.000	1	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a,6a]N[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6,6a]O)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a,6a]N[6a])(C[6]C[6]H)(H){1|O<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6,6a]O)(H){1|N<2>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.0905	1.923	2	120.0905	3.696	2	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]2)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]2)(C[6]C[6]H)(H){1|N<3>,4|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H){1|Ir<6>,1|N<3>,3|C<3>}	H(C[6]C[6,6a]C[6])	120.1030	0.028	2	120.1030	0.001	2	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]2)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]2)(C[6]C[6]H)(H){1|C<4>,1|N<3>,1|O<2>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Ru<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.3195	0.554	2	120.3195	0.307	2	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]2)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]2)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|C<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.5540	0.178	2	120.1596	0.193	9	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]2)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]2)(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|C<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.8163	0.341	3	120.1596	0.193	9	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]2)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]2)(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Cu<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.4785	0.579	2	120.1596	0.193	9	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]2)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]2)(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ni<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.9610	0.018	2	120.1596	0.193	9	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]C[5])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,3|C<3>}	C[6](C[6]C[5,6]C[5])(C[6]C[6,6a]H)(H){1|N<3>,2|N<2>,3|C<3>}	H(C[6]C[6,6a]C[6])	118.7740	0.000	1	118.7740	0.000	1	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]C[6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,3|C<3>}	C[6](C[6]C[5,6]C[6])(C[6]C[6,6a]H)(H){1|N<3>,5|C<3>}	H(C[6]C[6,6a]C[6])	118.9570	0.000	1	118.9570	0.000	1	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[5]C[6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,3|C<3>}	C[6](C[6]C[5]C[6])(C[6]C[6,6a]H)(H){1|O<1>,2|C<3>,2|S<2>}	H(C[6]C[6,6a]C[6])	119.1950	0.000	1	119.1950	0.000	1	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H){1|Co<6>,1|H<1>,1|N<4>,1|O<2>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.6200	0.000	1	119.7989	0.166	32	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H){1|Fe<10>,1|Pd<4>,2|C<3>,2|C<4>}	H(C[6]C[6,6a]C[6])	119.1720	0.000	1	119.7989	0.166	32	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H){1|Ni<6>,1|H<1>,1|N<4>,1|O<2>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.8030	0.000	1	119.7989	0.166	32	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H){1|Zn<5>,1|H<1>,1|N<4>,1|O<2>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.6010	0.000	1	119.7989	0.166	32	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H){1|Ir<8>,1|N<3>,1|O<2>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.2265	0.180	2	119.7989	0.166	32	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H){1|Pd<4>,1|C<4>,1|N<3>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.7700	0.000	1	119.7989	0.166	32	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H){1|Co<4>,1|N<3>,1|O<2>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.8520	0.096	2	119.7989	0.166	32	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H){1|Cr<6>,1|N<3>,1|O<2>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.9590	0.000	1	119.7989	0.166	32	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H){1|Cr<6>,2|C<3>,2|N<3>}	H(C[6]C[6,6a]C[6])	119.8250	0.000	1	119.7989	0.166	32	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H){1|Cu<4>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.8593	0.486	3	119.7989	0.166	32	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H){1|Cu<4>,1|N<3>,1|O<2>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.0525	0.288	2	119.7989	0.166	32	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H){1|Cu<4>,2|C<3>,2|N<3>}	H(C[6]C[6,6a]C[6])	120.0670	0.000	1	119.7989	0.166	32	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H){1|Fe<6>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.5675	0.050	2	119.7989	0.166	32	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H){1|Fe<6>,2|C<3>,2|N<3>}	H(C[6]C[6,6a]C[6])	119.5380	0.000	1	119.7989	0.166	32	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H){1|H<1>,4|C<3>}	H(C[6]C[6,6a]C[6])	119.0900	0.000	1	119.7989	0.166	32	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H){1|Ir<6>,2|C<3>,2|N<3>}	H(C[6]C[6,6a]C[6])	119.6875	0.453	2	119.7989	0.166	32	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H){1|Mn<6>,1|N<3>,1|O<2>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.5440	0.000	1	119.7989	0.166	32	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H){1|Ni<6>,2|C<3>,2|N<3>}	H(C[6]C[6,6a]C[6])	119.2450	0.677	2	119.7989	0.166	32	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H){1|Pd<4>,1|N<3>,1|O<2>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.4310	0.000	1	119.7989	0.166	32	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H){1|Zn<4>,1|N<3>,1|S<2>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.2890	0.000	1	119.7989	0.166	32	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H){1|Zn<5>,2|C<3>,2|N<3>}	H(C[6]C[6,6a]C[6])	119.9395	0.373	2	119.7989	0.166	32	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H){1|Zn<6>,2|C<3>,2|N<3>}	H(C[6]C[6,6a]C[6])	119.5690	0.099	2	119.7989	0.166	32	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[5]O[6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|O<2>,3|C<3>}	C[6](C[6]C[5]O[6])(C[6]C[6,6a]H)(H){4|C<3>}	H(C[6]C[6,6a]C[6])	119.7480	0.000	1	119.7480	0.000	1	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[5a]N[6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6,6a]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6,6a]C[6])	119.5780	0.000	1	119.8515	0.121	13	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[5a]N[6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6,6a]H)(H){1|Cu<4>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.6140	0.346	3	119.8515	0.121	13	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[5a]N[6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6,6a]H)(H){1|Cu<4>,1|N<3>,3|C<3>}	H(C[6]C[6,6a]C[6])	120.3280	0.000	1	119.8515	0.121	13	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[5a]N[6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6,6a]H)(H){1|Fe<6>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.7908	0.345	5	119.8515	0.121	13	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[5a]N[6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6,6a]H)(H){1|Ir<6>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.0350	0.000	1	119.8515	0.121	13	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[5a]N[6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6,6a]H)(H){1|N<2>,1|O<1>,1|O<2>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.1660	0.127	2	119.8515	0.121	13	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[5,6]N)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<2>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[5,6]N)(H){4|C<3>}	H(C[6]C[6,6a]C[6])	118.1580	0.000	1	118.1580	0.000	1	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[5,6]O)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[5,6]O)(H){1|C<4>,1|N<3>,2|C<3>}	H(C[6]C[6,6a]C[6])	118.5070	0.000	1	118.2525	0.070	13	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[5,6]O)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[5,6]O)(H){1|C<4>,3|C<3>}	H(C[6]C[6,6a]C[6])	118.4400	0.104	4	118.2525	0.070	13	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[5,6]O)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[5,6]O)(H){1|O<2>,3|C<3>}	H(C[6]C[6,6a]C[6])	118.0790	0.000	1	118.2525	0.070	13	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[5,6]O)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[5,6]O)(H){4|C<3>}	H(C[6]C[6,6a]C[6])	118.1337	0.280	7	118.2525	0.070	13	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6,6]O)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6,6]O)(H){1|C<4>,3|C<3>}	H(C[6]C[6,6a]C[6])	119.8630	0.000	1	119.8630	0.000	1	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]Br)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Br<1>,1|C<2>,1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]Br)(H){2|C<3>}	H(C[6]C[6,6a]C[6])	127.5910	0.000	1	127.5910	0.000	1	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|C<4>}	C[6](C[6]C[6,6a]H)(C[6]C[6]C)(H){1|Li<3>,1|Li<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.9500	0.044	2	119.7627	0.048	7	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,4|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]C)(H){1|O<1>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.6878	0.217	5	119.7627	0.048	7	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Br<1>,1|C<2>,1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H){2|C<3>}	H(C[6]C[6,6a]C[6])	119.8420	0.000	1	119.8593	3.024	16	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<2>,1|C<4>,1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H){2|C<3>}	H(C[6]C[6,6a]C[6])	119.9260	0.000	1	119.8593	3.024	16	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<2>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H){2|C<3>}	H(C[6]C[6,6a]C[6])	120.9348	3.081	4	119.8593	3.024	16	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H){1|Ag<5>,1|H<1>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.1755	0.162	2	119.8593	3.024	16	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H){1|H<1>,3|C<3>}	H(C[6]C[6,6a]C[6])	119.5065	0.069	2	119.8593	3.024	16	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H){2|C<3>,2|H<1>}	H(C[6]C[6,6a]C[6])	116.6010	0.000	1	119.8593	3.024	16	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H){2|Li<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.7860	0.000	1	119.8593	3.024	16	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){2|H<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H){1|O<1>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.1225	0.209	4	119.8593	3.024	16	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]N)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]N)(H){1|Pd<4>,3|C<3>}	H(C[6]C[6,6a]C[6])	118.2350	0.000	1	118.8337	0.279	3	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]N)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]N)(H){1|O<1>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.1330	0.141	2	118.8337	0.279	3	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H){1|Re<6>,1|H<1>,1|N<3>,1|N<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.1820	0.000	1	119.7809	1.255	82	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H){1|Ir<7>,1|N<3>,3|C<3>}	H(C[6]C[6,6a]C[6])	119.2480	0.000	1	119.7809	1.255	82	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H){1|Ru<6>,1|N<3>,3|C<3>}	H(C[6]C[6,6a]C[6])	120.3223	0.895	6	119.7809	1.255	82	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H){1|Ag<4>,4|C<3>}	H(C[6]C[6,6a]C[6])	118.7400	0.000	1	119.7809	1.255	82	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H){1|Au<4>,4|C<3>}	H(C[6]C[6,6a]C[6])	110.6780	0.000	1	119.7809	1.255	82	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H){1|Co<4>,1|N<3>,3|C<3>}	H(C[6]C[6,6a]C[6])	120.0708	0.177	4	119.7809	1.255	82	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H){1|Cu<4>,1|N<3>,3|C<3>}	H(C[6]C[6,6a]C[6])	119.7556	0.096	7	119.7809	1.255	82	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H){1|Cu<5>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.8350	0.000	1	119.7809	1.255	82	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H){1|Cu<5>,1|N<3>,3|C<3>}	H(C[6]C[6,6a]C[6])	119.8785	0.193	4	119.7809	1.255	82	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H){1|Cu<6>,1|N<3>,3|C<3>}	H(C[6]C[6,6a]C[6])	120.0158	0.085	5	119.7809	1.255	82	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H){1|Fe<4>,1|N<3>,3|C<3>}	H(C[6]C[6,6a]C[6])	119.9615	0.036	2	119.7809	1.255	82	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H){1|Fe<6>,1|N<3>,3|C<3>}	H(C[6]C[6,6a]C[6])	119.7395	0.212	6	119.7809	1.255	82	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H){1|H<1>,4|C<3>}	H(C[6]C[6,6a]C[6])	119.2320	0.132	2	119.7809	1.255	82	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H){1|Ir<6>,1|N<3>,3|C<3>}	H(C[6]C[6,6a]C[6])	119.5764	0.297	8	119.7809	1.255	82	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H){1|Ir<7>,1|N<3>,3|C<3>}	H(C[6]C[6,6a]C[6])	119.3370	0.550	3	119.7809	1.255	82	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H){1|Mn<5>,1|N<3>,3|C<3>}	H(C[6]C[6,6a]C[6])	120.4035	0.284	2	119.7809	1.255	82	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H){1|Mn<6>,1|N<3>,3|C<3>}	H(C[6]C[6,6a]C[6])	120.1110	0.000	1	119.7809	1.255	82	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H){1|Mo<6>,1|N<3>,3|C<3>}	H(C[6]C[6,6a]C[6])	120.0228	0.123	4	119.7809	1.255	82	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H){1|Pt<4>,1|N<3>,3|C<3>}	H(C[6]C[6,6a]C[6])	120.2800	0.247	3	119.7809	1.255	82	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H){1|Pu<11>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.8190	0.203	4	119.7809	1.255	82	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H){1|Re<6>,1|N<3>,3|C<3>}	H(C[6]C[6,6a]C[6])	119.9030	0.251	7	119.7809	1.255	82	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H){1|Ru<8>,1|N<3>,3|C<3>}	H(C[6]C[6,6a]C[6])	120.1740	0.214	2	119.7809	1.255	82	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H){1|Zn<4>,1|N<3>,3|C<3>}	H(C[6]C[6,6a]C[6])	119.7188	0.194	5	119.7809	1.255	82	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H){1|Zn<6>,1|N<3>,3|C<3>}	H(C[6]C[6,6a]C[6])	121.2080	0.420	2	119.7809	1.255	82	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<2>,1|C<4>,1|O<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(H){1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6,6a]C[6])	118.3950	0.154	2	119.0367	0.915	148	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(H){1|C<4>,1|O<2>,2|C<3>}	H(C[6]C[6,6a]C[6])	118.1070	0.000	1	119.0367	0.915	148	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(H){1|C<4>,3|C<3>}	H(C[6]C[6,6a]C[6])	118.0450	0.000	1	119.0367	0.915	148	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(H){1|Cl<1>,3|C<3>}	H(C[6]C[6,6a]C[6])	118.1860	0.000	1	119.0367	0.915	148	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(H){2|C<3>,2|C<4>}	H(C[6]C[6,6a]C[6])	118.1180	0.000	1	119.0367	0.915	148	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(H){2|C<3>,2|O<2>}	H(C[6]C[6,6a]C[6])	117.8980	0.000	1	119.0367	0.915	148	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|O<1>,1|O<2>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(H){1|H<1>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.2180	0.163	2	119.0367	0.915	148	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|O<1>,1|O<2>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(H){3|C<3>}	H(C[6]C[6,6a]C[6])	119.2070	0.000	1	119.0367	0.915	148	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|O<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(H){1|C<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.5000	0.000	1	119.0367	0.915	148	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|O<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(H){1|N<2>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.2946	1.242	53	119.0367	0.915	148	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|O<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(H){1|O<1>,2|C<3>}	H(C[6]C[6,6a]C[6])	118.0320	0.000	1	119.0367	0.915	148	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|O<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(H){3|C<3>}	H(C[6]C[6,6a]C[6])	118.9495	0.715	76	119.0367	0.915	148	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|O<1>,2|C<3>,2|C<4>}	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(H){1|C<4>,1|O<2>,2|C<3>}	H(C[6]C[6,6a]C[6])	118.3435	0.183	2	119.0367	0.915	148	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|O<1>,4|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(H){1|O<1>,2|C<3>}	H(C[6]C[6,6a]C[6])	118.2085	0.084	2	119.0367	0.915	148	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|O<1>,4|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(H){3|C<3>}	H(C[6]C[6,6a]C[6])	118.8720	0.000	1	119.0367	0.915	148	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|O<2>,2|C<3>,2|O<1>}	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(H){1|H<1>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.1820	0.167	2	119.0367	0.915	148	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]P)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|O<1>,1|P<3>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]P)(H){1|O<1>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.7250	0.000	1	119.7250	0.000	1	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<2>,2|N<3>}	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H){1|Ru<5>,4|C<3>}	H(C[6]C[6,6a]C[6])	119.9980	0.000	1	119.4771	0.146	35	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<2>,2|N<3>}	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H){1|Ru<6>,4|C<3>}	H(C[6]C[6,6a]C[6])	119.4790	0.000	1	119.4771	0.146	35	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<2>,2|N<3>}	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H){1|W<6>,4|C<3>}	H(C[6]C[6,6a]C[6])	120.0150	0.000	1	119.4771	0.146	35	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>,2|N<3>}	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H){1|Ru<9>,1|N<3>,3|C<3>}	H(C[6]C[6,6a]C[6])	119.8260	0.000	1	119.4771	0.146	35	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H){1|Cd<5>,1|N<3>,3|C<3>}	H(C[6]C[6,6a]C[6])	119.2103	0.077	3	119.4771	0.146	35	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H){1|Cd<6>,1|N<3>,3|C<3>}	H(C[6]C[6,6a]C[6])	119.4057	0.227	4	119.4771	0.146	35	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H){1|Cu<3>,1|N<2>,3|C<3>}	H(C[6]C[6,6a]C[6])	119.6510	0.000	1	119.4771	0.146	35	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H){1|Cu<3>,4|C<3>}	H(C[6]C[6,6a]C[6])	119.7223	0.373	4	119.4771	0.146	35	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H){1|Cu<4>,4|C<3>}	H(C[6]C[6,6a]C[6])	119.6973	0.446	3	119.4771	0.146	35	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H){1|Cu<5>,1|N<3>,3|C<3>}	H(C[6]C[6,6a]C[6])	119.3820	0.045	3	119.4771	0.146	35	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H){1|Cu<6>,1|N<3>,3|C<3>}	H(C[6]C[6,6a]C[6])	119.5730	0.028	2	119.4771	0.146	35	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H){1|Ni<6>,1|N<3>,3|C<3>}	H(C[6]C[6,6a]C[6])	119.4110	0.000	1	119.4771	0.146	35	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H){1|Pd<4>,4|C<3>}	H(C[6]C[6,6a]C[6])	119.7105	0.660	2	119.4771	0.146	35	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H){1|Rh<8>,4|C<3>}	H(C[6]C[6,6a]C[6])	119.5200	0.150	2	119.4771	0.146	35	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H){1|Ru<6>,4|C<3>}	H(C[6]C[6,6a]C[6])	118.9407	0.496	3	119.4771	0.146	35	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H){1|Zn<4>,1|N<3>,3|C<3>}	H(C[6]C[6,6a]C[6])	119.3940	0.000	1	119.4771	0.146	35	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H){1|Zn<6>,1|N<3>,3|C<3>}	H(C[6]C[6,6a]C[6])	119.0565	0.561	2	119.4771	0.146	35	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]2)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]2)(H){1|Cd<5>,4|C<3>}	H(C[6]C[6,6a]C[6])	120.0740	0.000	1	119.8633	0.045	3	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]2)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]2)(H){1|Cd<6>,4|C<3>}	H(C[6]C[6,6a]C[6])	119.6500	0.000	1	119.8633	0.045	3	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]2)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]2)(H){1|Cu<5>,4|C<3>}	H(C[6]C[6,6a]C[6])	119.8660	0.000	1	119.8633	0.045	3	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<2>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|C<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.6120	0.000	1	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<2>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Cu<5>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.1770	0.000	1	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<2>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|H<1>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.8320	0.421	2	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<2>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Ni<5>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.8810	0.000	1	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<2>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Pt<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.4190	0.000	1	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|H<1>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.9440	0.000	1	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Pt<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.0330	0.000	1	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Ru<5>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.5250	0.000	1	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<1>,2|N<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Mn<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.7740	0.000	1	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<1>,2|N<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Pb<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.6590	0.000	1	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Ag<3>,2|C<3>}	H(C[6]C[6,6a]C[6])	122.8045	3.169	2	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Ag<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.9370	0.119	4	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Al<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.9440	0.223	4	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Al<5>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.0019	0.209	16	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Bi<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.8163	0.174	3	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|C<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.8420	0.000	1	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Ca<8>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.9318	0.270	4	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Cd<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.6323	0.251	3	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Cd<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.5913	1.372	15	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Co<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.1505	0.367	13	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Co<5>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.9256	0.450	11	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Co<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.1725	0.345	10	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Co<7>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.2115	0.165	2	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Cr<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.1800	0.000	1	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Cu<3>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.9348	0.244	19	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Cu<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.1763	0.586	205	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Cu<5>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.9844	0.737	27	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Cu<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.8755	0.245	8	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Fe<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.0058	0.189	5	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Fe<5>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.4527	0.246	10	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Fe<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.1045	0.371	37	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|H<1>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.6861	0.594	35	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Hg<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.4262	0.271	4	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Hg<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.1440	0.000	1	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Ir<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.4125	0.240	4	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Li<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.3967	1.147	4	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Li<5>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.7260	0.000	1	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Mn<5>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.8603	0.394	4	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Mn<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.2343	0.385	18	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Mn<7>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.9865	0.086	2	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Mn<8>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.0945	0.030	2	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Mo<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	122.2770	0.928	2	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Mo<8>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.3666	0.113	9	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Mo<9>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.5145	0.039	2	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Ni<3>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.2695	0.510	2	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Ni<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.4689	0.392	17	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Ni<5>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.0415	0.302	6	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Ni<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.9037	0.418	12	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Ni<7>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.1260	0.107	3	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Pb<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.7557	0.051	3	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Pd<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.9976	0.650	20	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Pd<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.9720	0.120	2	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Pt<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.1246	0.327	14	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Pt<5>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.3730	0.000	1	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Pt<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.1007	0.424	7	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Re<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.2255	0.399	23	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Rh<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.6127	0.196	3	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Rh<5>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.4590	0.000	1	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Rh<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.2440	0.000	1	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Rh<8>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.9470	0.726	4	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Ru<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.7457	0.532	24	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Ru<8>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.7290	0.000	1	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Ru<9>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.2013	0.200	3	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Sn<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.8150	0.281	2	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Sn<5>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.7930	0.326	4	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Sn<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.4554	0.728	5	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Zn<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.7612	0.389	16	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Zn<5>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.5234	1.729	15	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Zn<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.1117	0.235	14	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|I<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Ir<8>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.9120	0.000	1	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|N<2>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|H<1>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.0640	0.000	1	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|N<3>,1|S<4>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Ba<11>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.3710	0.000	1	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Cl<1>,1|C<4>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Al<5>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.1172	0.283	4	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Cl<1>,1|C<4>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Fe<5>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.0315	0.170	6	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Cl<1>,1|C<4>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Pt<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.0950	0.112	3	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Cl<1>,1|C<4>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Zn<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.9960	0.000	1	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|H<1>,2|C<3>}	H(C[6]C[6,6a]C[6])	118.8830	0.000	1	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Ir<7>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.3520	0.000	1	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Ag<3>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.0110	0.000	1	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Ag<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.5475	0.285	2	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Al<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.0193	0.105	7	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Al<5>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.7025	0.078	2	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Bi<5>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.8895	0.170	2	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|C<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.5951	0.761	29	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Cd<5>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.5130	0.331	3	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Cd<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.6103	0.200	6	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Cd<8>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.2247	0.067	3	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Co<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.6960	0.000	1	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Co<5>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.5045	0.350	4	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Co<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.8530	0.112	3	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Cu<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.8935	0.397	10	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Cu<5>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.0376	0.598	7	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Cu<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.1440	0.000	1	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Fe<5>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.9900	0.403	2	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Fe<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.4575	0.975	14	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|H<1>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.9202	0.786	30	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Hg<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.0172	0.272	5	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Ir<7>,2|C<3>}	H(C[6]C[6,6a]C[6])	121.5600	0.000	1	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Ir<8>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.3650	0.000	1	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Mg<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.7530	0.284	2	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Mg<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.7920	0.000	1	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Mn<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.0738	0.558	35	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Ni<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.0565	0.405	2	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Ni<5>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.0486	0.148	5	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Ni<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.1403	0.152	4	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|O<1>,2|C<3>}	H(C[6]C[6,6a]C[6])	121.8050	0.000	1	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Os<7>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.5980	0.000	1	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Pd<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.8620	0.717	9	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Pt<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.0973	0.244	3	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Re<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.3170	0.341	2	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Ru<10>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.0483	0.183	6	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Ru<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.4090	0.000	1	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Ru<9>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.1559	0.173	7	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Sn<5>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.8625	0.127	2	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Sn<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.0130	0.032	3	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Zn<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.4894	0.413	7	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Zn<5>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.7400	1.102	21	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Zn<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.1751	0.217	8	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Ru<5>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.1930	0.000	1	120.1082	0.442	976	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]Cl)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Cl<1>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]Cl)(H){1|Co<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.7105	0.016	2	119.7069	0.128	7	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]Cl)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Cl<1>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]Cl)(H){1|Re<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.4040	0.000	1	119.7069	0.128	7	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]Cl)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Cl<1>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]Cl)(H){1|Zn<5>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.5307	0.228	4	119.7069	0.128	7	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Br<1>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Fe<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.1065	0.210	2	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Br<1>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ir<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.8825	0.201	4	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Br<1>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Mn<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.3760	0.000	1	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Br<1>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ru<9>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.2200	0.000	1	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>,2|N<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Cd<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.8050	0.000	1	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>,2|N<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Mn<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	123.6020	0.000	1	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<3>,1|N<2>,1|N<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Fe<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.3270	0.153	2	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<3>,1|N<2>,1|N<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Fe<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.3840	0.000	1	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<3>,1|N<2>,1|N<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.6654	0.212	7	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<3>,1|N<2>,1|N<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ir<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.7263	0.383	3	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<3>,1|N<2>,1|N<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ir<7>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.5070	0.000	1	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<3>,1|N<2>,1|N<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Pd<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.0102	0.270	5	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<3>,1|N<2>,1|N<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Pt<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	125.5650	0.000	1	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<3>,1|N<2>,1|N<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Rh<5>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.7770	0.000	1	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<3>,1|N<2>,1|N<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ru<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.3875	0.440	4	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<3>,1|N<2>,1|N<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Zn<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.3220	0.212	2	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<3>,2|H<1>,2|N<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Pd<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.7040	0.054	2	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Co<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.6096	0.328	12	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Cu<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.5875	0.821	2	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Cu<5>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.8016	0.118	8	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Fe<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.0850	0.049	5	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.5252	0.079	5	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ni<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.8346	0.200	5	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Pt<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.0290	0.004	2	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ru<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	118.6770	2.034	2	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Zn<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.8237	0.170	6	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Cl<1>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Cu<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.6020	0.000	1	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Cl<1>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.4583	0.109	3	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Cl<1>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Os<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.9430	0.000	1	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Cl<1>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Pd<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.9480	0.000	1	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Cl<1>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Pt<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.2480	0.198	3	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Cl<1>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Re<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.4760	0.132	2	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Cl<1>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Rh<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.8560	0.000	1	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Cl<1>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Sn<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.0340	0.058	2	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Cl<1>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Zn<5>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.2830	0.000	1	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|F<1>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ir<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.2835	0.238	4	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|I<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ni<5>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.2980	0.000	1	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|I<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Pt<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.9377	0.504	3	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ir<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.0620	0.188	2	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ru<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.5380	0.000	1	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<2>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.8670	0.000	1	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<2>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Mn<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.0025	0.009	2	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<2>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Pd<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.9928	1.102	12	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|S<2>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Re<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.9680	0.211	2	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|S<4>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ag<3>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.3540	0.000	1	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|S<4>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6,6a]C[6])	118.1730	1.629	2	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|S<4>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Mg<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.2030	0.000	1	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|S<4>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ni<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.2120	0.089	2	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|S<4>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Pt<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.9875	0.057	2	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Fe<5>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.3060	0.300	2	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ir<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.6160	0.084	3	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Mn<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.1900	0.000	1	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Zn<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.0680	0.505	6	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Zn<5>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.2920	0.000	1	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|C<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.0107	0.049	3	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Co<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.4320	0.433	2	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Cu<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.0590	0.000	1	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.3866	0.402	5	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ir<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.7665	1.128	2	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ir<8>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.9840	0.000	1	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Os<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.1710	0.000	1	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Pt<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.3203	0.177	3	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Re<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.0980	0.070	4	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ru<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.0480	0.000	1	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Zn<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.8095	0.677	2	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ag<3>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.7655	0.122	4	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ag<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.9973	0.503	12	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ag<5>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.0805	0.228	2	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Al<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.6997	0.160	3	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Al<5>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.9013	0.293	3	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Al<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.8637	0.221	7	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Au<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.0690	0.000	1	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Au<5>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.7930	0.000	1	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|B<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.1778	0.181	4	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ba<8>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.3543	0.556	8	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Bi<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.8658	0.444	6	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|C<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.0730	0.747	49	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ca<7>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.2262	0.184	4	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ca<8>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.9965	0.085	4	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Cd<5>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.0228	0.246	5	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Cd<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.9268	0.301	95	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Cd<7>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.0828	0.216	19	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Cd<8>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.8870	0.199	3	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Cm<8>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.7770	0.076	2	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Co<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.5128	1.228	13	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Co<5>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.2185	0.276	8	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Co<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.1769	0.749	326	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Co<7>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.2148	0.210	26	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Co<8>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.1625	0.276	2	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Cr<5>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.3540	0.000	1	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Cr<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.0245	0.454	58	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Cr<8>,2|C<3>}	H(C[6]C[6,6a]C[6])	121.6540	2.573	7	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Cu<3>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.2523	0.617	15	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Cu<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.1994	0.979	197	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Cu<5>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.2496	0.872	342	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Cu<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.9342	0.707	33	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Eu<13>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.8785	0.203	4	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Eu<8>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.2543	0.121	10	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Fe<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.8160	0.023	2	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Fe<5>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.5596	1.776	7	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Fe<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.2169	0.776	480	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Fe<7>,2|C<3>}	H(C[6]C[6,6a]C[6])	121.4930	3.422	2	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Fe<8>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.5790	0.000	1	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.7982	0.970	191	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|In<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.1190	0.515	2	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ir<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.2048	0.444	36	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ir<7>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.1575	0.200	4	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ir<8>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.9856	0.580	11	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Li<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.9264	0.302	5	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Mg<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.1372	0.145	11	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Mn<5>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.3156	0.319	10	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Mn<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.1411	0.869	309	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Mn<7>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.0752	0.279	18	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Mo<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.3392	0.406	24	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Mo<8>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.3470	0.188	2	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|N<2>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.9270	0.000	1	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ni<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.2347	0.833	31	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ni<5>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.3222	0.724	6	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ni<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.9653	0.694	375	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ni<7>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.1526	0.551	8	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|O<1>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.3216	0.797	20	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|O<2>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.5203	0.246	4	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Os<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.1680	0.000	1	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Os<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.1877	0.695	45	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Os<7>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.0090	0.000	1	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Os<9>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.3318	0.312	6	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Pd<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.1266	0.324	144	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Pd<5>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.5001	2.175	17	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Pd<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.9199	0.252	7	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Pd<7>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.2915	0.045	2	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Pt<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.3343	0.612	145	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Pt<5>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.0223	0.519	21	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Pt<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.8403	1.056	26	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Re<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.2213	0.424	120	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Rh<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.0545	0.255	6	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Rh<5>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.4773	0.237	7	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Rh<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.2803	0.210	7	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Rh<7>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.4410	0.000	1	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Rh<8>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.1175	0.248	6	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ru<5>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.1063	0.101	4	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ru<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.2528	0.627	131	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ru<7>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.9550	0.000	1	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ru<8>,2|C<3>}	H(C[6]C[6,6a]C[6])	123.5270	2.158	3	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ru<9>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.1779	0.165	8	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Sb<5>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.0140	0.051	2	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Sb<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.0775	0.224	4	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Si<5>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.5500	0.000	1	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Sm<11>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.0752	0.180	4	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Sm<13>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.1412	0.345	4	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Sm<9>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.6058	0.803	4	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Sn<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.2970	0.040	2	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Sn<5>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.9192	0.175	5	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Sn<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.0290	0.796	30	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Sn<7>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.0580	0.000	1	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Sr<7>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.1040	0.038	2	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Sr<8>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.9510	0.259	2	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|U<10>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.5730	0.158	2	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|V<5>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.9285	0.263	4	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|V<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.1760	0.000	1	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|V<8>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.1045	0.214	2	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|V<9>,2|C<3>}	H(C[6]C[6,6a]C[6])	121.5110	3.268	2	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|W<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.0729	0.164	8	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Zn<3>,2|C<3>}	H(C[6]C[6,6a]C[6])	121.7565	1.076	2	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Zn<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.3351	0.913	17	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Zn<5>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.0357	0.299	81	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Zn<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.0995	0.712	110	120.1345	0.593	4008	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]Ir)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Ir<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]Ir)(H){1|H<1>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.4800	0.458	2	119.4800	0.210	2	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]N)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>,2|N<2>}	C[6](C[6]C[6,6a]H)(C[6]N[6]N)(H){1|Cu<3>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.3300	0.000	1	119.8037	0.122	22	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]N)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]N)(H){1|Co<5>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.9130	0.000	1	119.8037	0.122	22	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]N)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]N)(H){1|Cu<5>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.9620	0.000	1	119.8037	0.122	22	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]N)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]N)(H){1|Pt<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.2220	0.130	4	119.8037	0.122	22	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]N)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]N)(H){1|Ru<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.8800	0.000	1	119.8037	0.122	22	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]N)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]N)(H){1|Cd<5>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.4740	0.000	1	119.8037	0.122	22	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]N)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]N)(H){1|Cd<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.7940	0.000	1	119.8037	0.122	22	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]N)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]N)(H){1|Co<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.4940	0.000	1	119.8037	0.122	22	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]N)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]N)(H){1|Co<7>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.4692	0.130	5	119.8037	0.122	22	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]N)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]N)(H){1|H<1>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.3390	0.018	2	119.8037	0.122	22	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]N)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]N)(H){1|Ni<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.7480	0.000	1	119.8037	0.122	22	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]N)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]N)(H){1|Ni<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.9200	0.000	1	119.8037	0.122	22	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]N)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]N)(H){1|O<1>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.1420	0.000	1	119.8037	0.122	22	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]N)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]N)(H){1|Pt<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.1130	0.000	1	119.8037	0.122	22	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]O)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|O<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]O)(H){2|C<3>}	H(C[6]C[6,6a]C[6])	119.4920	0.000	1	119.6818	0.609	23	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]O)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<2>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]O)(H){1|Cd<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.4290	0.243	2	119.6818	0.609	23	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]O)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<2>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]O)(H){1|Co<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.3170	0.132	2	119.6818	0.609	23	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]O)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<2>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]O)(H){1|Cu<3>,2|C<3>}	H(C[6]C[6,6a]C[6])	121.3190	1.741	2	119.6818	0.609	23	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]O)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<2>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]O)(H){1|Cu<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.0300	0.963	3	119.6818	0.609	23	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]O)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<2>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]O)(H){1|Cu<5>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.0695	0.259	4	119.6818	0.609	23	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]O)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<2>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]O)(H){1|Mn<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.8990	0.000	1	119.6818	0.609	23	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]O)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<2>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]O)(H){1|Ni<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.5345	0.456	2	119.6818	0.609	23	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]O)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<2>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]O)(H){1|Ru<9>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.8460	0.000	1	119.6818	0.609	23	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]O)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<2>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]O)(H){1|Zn<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.5756	0.223	5	119.6818	0.609	23	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]Os)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Os<7>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]Os)(H){1|H<1>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.4310	0.276	2	119.4310	0.076	2	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]S)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|S<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]S)(H){1|H<1>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.3884	0.195	8	119.3884	0.038	8	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]Zr)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Zr<13>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]Zr)(H){2|C<3>}	H(C[6]C[6,6a]C[6])	119.9120	0.000	1	119.9120	0.000	1	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]O[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|O<2>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]O[6]C)(H){2|C<3>}	H(C[6]C[6,6a]C[6])	119.4785	0.561	4	119.4785	0.315	4	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]O[6]S)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|O<2>,1|S<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]O[6]S)(H){2|C<3>}	H(C[6]C[6,6a]C[6])	119.0723	1.994	3	119.2880	2.836	4	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]O[6]S)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|O<2>,1|S<2>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]O[6]S)(H){2|C<3>}	H(C[6]C[6,6a]C[6])	119.9350	0.000	1	119.2880	2.836	4	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]S[6]S)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|S<1>,1|S<2>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]S[6]S)(H){2|C<3>}	H(C[6]C[6,6a]C[6])	119.4400	0.000	1	119.4400	0.000	1	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]Si[6]O)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Si<4>,1|H<1>,1|O<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]Si[6]O)(H){2|C<3>,2|C<4>}	H(C[6]C[6,6a]C[6])	115.5090	0.000	1	115.5090	0.000	1	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H){1|Ir<6>,4|C<3>}	H(C[6]C[6,6a]C[6])	120.2235	0.329	2	120.0880	0.231	137	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H){1|Ag<4>,4|C<3>}	H(C[6]C[6,6a]C[6])	120.6720	0.000	1	120.0880	0.231	137	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H){1|Au<4>,4|C<3>}	H(C[6]C[6,6a]C[6])	118.3570	0.000	1	120.0880	0.231	137	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H){1|Co<4>,4|C<3>}	H(C[6]C[6,6a]C[6])	120.1355	0.423	6	120.0880	0.231	137	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H){1|Cr<6>,4|C<3>}	H(C[6]C[6,6a]C[6])	119.9650	0.146	3	120.0880	0.231	137	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H){1|Cu<3>,4|C<3>}	H(C[6]C[6,6a]C[6])	120.1753	0.237	3	120.0880	0.231	137	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H){1|Cu<4>,4|C<3>}	H(C[6]C[6,6a]C[6])	120.1347	0.197	29	120.0880	0.231	137	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H){1|Fe<6>,4|C<3>}	H(C[6]C[6,6a]C[6])	120.1705	0.206	4	120.0880	0.231	137	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H){1|H<1>,1|N<2>,3|C<3>}	H(C[6]C[6,6a]C[6])	120.7325	1.923	2	120.0880	0.231	137	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H){1|H<1>,4|C<3>}	H(C[6]C[6,6a]C[6])	119.5100	0.386	5	120.0880	0.231	137	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H){1|Ir<4>,4|C<3>}	H(C[6]C[6,6a]C[6])	119.5640	0.060	3	120.0880	0.231	137	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H){1|Ir<5>,4|C<3>}	H(C[6]C[6,6a]C[6])	119.8525	0.057	2	120.0880	0.231	137	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H){1|Ir<6>,4|C<3>}	H(C[6]C[6,6a]C[6])	120.1879	0.445	33	120.0880	0.231	137	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H){1|Ir<7>,4|C<3>}	H(C[6]C[6,6a]C[6])	120.0710	0.081	2	120.0880	0.231	137	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H){1|Ir<8>,4|C<3>}	H(C[6]C[6,6a]C[6])	119.7930	0.000	1	120.0880	0.231	137	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H){1|N<2>,1|O<1>,3|C<3>}	H(C[6]C[6,6a]C[6])	120.1170	0.000	1	120.0880	0.231	137	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H){1|Ni<3>,4|C<3>}	H(C[6]C[6,6a]C[6])	120.5494	0.085	7	120.0880	0.231	137	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H){1|Ni<4>,4|C<3>}	H(C[6]C[6,6a]C[6])	119.9740	0.000	1	120.0880	0.231	137	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H){1|O<1>,4|C<3>}	H(C[6]C[6,6a]C[6])	120.0050	0.207	3	120.0880	0.231	137	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H){1|Pd<4>,4|C<3>}	H(C[6]C[6,6a]C[6])	119.8680	0.304	2	120.0880	0.231	137	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H){1|Pt<4>,4|C<3>}	H(C[6]C[6,6a]C[6])	120.0236	0.183	9	120.0880	0.231	137	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H){1|Re<6>,4|C<3>}	H(C[6]C[6,6a]C[6])	120.2610	0.383	2	120.0880	0.231	137	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H){1|Ru<6>,4|C<3>}	H(C[6]C[6,6a]C[6])	120.5920	1.151	4	120.0880	0.231	137	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H){1|Zn<4>,4|C<3>}	H(C[6]C[6,6a]C[6])	119.8240	0.096	3	120.0880	0.231	137	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H){1|Zn<5>,4|C<3>}	H(C[6]C[6,6a]C[6])	119.4130	0.432	5	120.0880	0.231	137	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H){1|Zn<6>,1|N<2>,3|C<3>}	H(C[6]C[6,6a]C[6])	119.8275	0.477	2	120.0880	0.231	137	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H){1|H<1>,1|N<2>,3|C<3>}	H(C[6]C[6,6a]C[6])	120.2310	0.000	1	120.0880	0.231	137	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]N[6a]N[6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6](C[6]N[6a]N[6])(C[6]C[6,6a]H)(H){1|Cd<6>,4|C<3>}	H(C[6]C[6,6a]C[6])	120.2720	0.000	1	120.2720	0.000	1	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]N[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]N[6a])(C[6]C[6]H)(H){1|C<2>,1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H){1|C<3>,1|N<2>}	H(C[6]C[6,6a]C[6])	118.6200	0.000	1	118.6200	0.000	1	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]N[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]N[6a])(C[6]C[6]H)(H){1|N<3>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H){1|Cu<5>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.0180	0.000	1	120.0138	0.057	5	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]N[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]N[6a])(C[6]C[6]H)(H){1|N<3>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H){1|Ru<6>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.1395	0.231	2	120.0138	0.057	5	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]N[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]N[6a])(C[6]C[6]H)(H){1|N<3>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H){1|Zn<4>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.1210	0.000	1	120.0138	0.057	5	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]N[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]N[6a])(C[6]C[6]H)(H){1|N<3>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H){1|Zn<5>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.6510	0.000	1	120.0138	0.057	5	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]N[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]N[6a])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|N<2>}	H(C[6]C[6,6a]C[6])	121.0697	0.077	3	120.5204	0.130	13	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]N[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]N[6a])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Pd<6>,1|C<3>,1|N<2>}	H(C[6]C[6,6a]C[6])	120.3200	0.033	2	120.5204	0.130	13	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]N[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]N[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Al<6>,1|C<3>,1|N<2>}	H(C[6]C[6,6a]C[6])	120.1070	0.145	3	120.5204	0.130	13	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]N[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]N[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Cr<8>,1|C<3>,1|N<2>}	H(C[6]C[6,6a]C[6])	120.5005	0.006	2	120.5204	0.130	13	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]N[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]N[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Rh<5>,1|C<3>,1|N<2>}	H(C[6]C[6,6a]C[6])	120.4720	0.000	1	120.5204	0.130	13	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]N[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]N[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Rh<8>,1|C<3>,1|N<2>}	H(C[6]C[6,6a]C[6])	120.5210	0.000	1	120.5204	0.130	13	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]N[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]N[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Zr<10>,1|C<3>,1|N<2>}	H(C[6]C[6,6a]C[6])	120.6010	0.000	1	120.5204	0.130	13	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H){1|N<3>,4|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H){1|Re<6>,1|N<3>,3|C<3>}	H(C[6]C[6,6a]C[6])	119.7250	0.152	6	119.7150	0.017	8	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H){1|N<3>,4|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H){1|Zn<5>,1|N<3>,3|C<3>}	H(C[6]C[6,6a]C[6])	119.6850	0.020	2	119.7150	0.017	8	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H){1|C<4>,1|N<3>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Cu<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.8785	0.192	6	119.8785	0.037	6	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ag<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.6490	0.186	4	120.3303	0.210	161	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Bi<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.2215	0.311	4	120.3303	0.210	161	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Cd<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.4860	0.110	2	120.3303	0.210	161	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Co<5>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.1885	0.045	2	120.3303	0.210	161	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Co<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.3803	0.216	16	120.3303	0.210	161	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Co<7>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.2475	0.107	2	120.3303	0.210	161	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Cr<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.3165	0.111	4	120.3303	0.210	161	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Cu<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.4259	0.153	12	120.3303	0.210	161	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Cu<5>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.3591	0.185	10	120.3303	0.210	161	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Eu<13>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.7097	0.164	3	120.3303	0.210	161	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Fe<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.4287	0.236	14	120.3303	0.210	161	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.0477	0.208	6	120.3303	0.210	161	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ir<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.3220	0.193	4	120.3303	0.210	161	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ir<8>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.5050	0.171	4	120.3303	0.210	161	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Mn<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.4582	1.361	5	120.3303	0.210	161	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ni<5>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.7945	0.279	2	120.3303	0.210	161	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ni<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.5122	0.213	4	120.3303	0.210	161	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Os<9>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.2870	1.250	2	120.3303	0.210	161	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Pd<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.1770	0.134	2	120.3303	0.210	161	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Re<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.3661	0.357	9	120.3303	0.210	161	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Rh<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.0540	0.325	4	120.3303	0.210	161	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Rh<5>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.2867	0.335	4	120.3303	0.210	161	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Rh<8>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.2905	0.089	4	120.3303	0.210	161	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ru<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.6445	0.392	17	120.3303	0.210	161	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ru<9>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.0590	0.055	2	120.3303	0.210	161	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Sn<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.2130	0.000	1	120.3303	0.210	161	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Zn<5>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.5660	0.151	2	120.3303	0.210	161	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Zn<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.4783	0.366	4	120.3303	0.210	161	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Al<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	117.9560	0.000	1	120.3303	0.210	161	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|C<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.6030	0.045	2	120.3303	0.210	161	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Cu<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.9305	0.004	2	120.3303	0.210	161	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.3700	0.578	2	120.3303	0.210	161	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ir<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.2090	0.000	1	120.3303	0.210	161	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Pt<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.2720	0.727	4	120.3303	0.210	161	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]O[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H){1|O<2>,4|C<3>}	C[6](C[6]C[6,6a]H)(C[6]O[6]C)(H){2|C<3>}	H(C[6]C[6,6a]C[6])	119.5960	0.078	2	119.5960	0.006	2	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6a,6a]N[6,6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6a,6a]N[6,6a])(C[6]C[6]H)(H){1|B<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6,6a]C[6])	119.7600	0.000	1	119.6135	0.043	2	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6a,6a]N[6,6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6a,6a]N[6,6a])(C[6]C[6]H)(H){1|B<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6,6a]C[6])	119.4670	0.000	1	119.6135	0.043	2	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]N[5a,6,6a]C[6a,6a])(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]N[5a,6,6a]C[6a,6a])(C[6]C[6]H)(H){1|H<1>,4|C<3>}	C[6](C[6]C[5a,6]H)(C[6]C[6,6a]H)(H){1|N<3>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.7080	0.000	1	119.7080	0.000	1	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]N[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]N[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]C)(H){1|N<3>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.7290	0.000	1	120.0630	0.223	2	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]N[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]N[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,4|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]C)(H){1|C<3>,1|N<3>,1|O<2>}	H(C[6]C[6,6a]C[6])	120.3970	0.000	1	120.0630	0.223	2	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]N[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]N[6,6a]C[6a])(C[6]C[6]H)(H){1|C<2>,1|H<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6,6a]C[6])	119.4490	0.000	1	119.4559	0.133	10	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]N[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]N[6,6a]C[6a])(C[6]C[6]H)(H){1|Ge<3>,1|Si<4>,1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6,6a]C[6])	119.5600	0.000	1	119.4559	0.133	10	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]N[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]N[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6,6a]C[6])	119.7640	0.000	1	119.4559	0.133	10	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]N[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]N[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6,6a]C[6])	119.2590	0.000	1	119.4559	0.133	10	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]N[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]N[6,6a]C[6a])(C[6]C[6]H)(H){1|Ru<7>,2|H<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H){1|Ru<7>,1|C<3>,1|N<4>}	H(C[6]C[6,6a]C[6])	120.2010	0.000	1	119.4559	0.133	10	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]N[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]N[6,6a]C[6a])(C[6]C[6]H)(H){2|H<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6,6a]C[6])	119.2652	0.282	5	119.4559	0.133	10	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]N[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]N[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,4|C<3>}	C[6](C[6]C[6a]C[6])(C[6]C[6,6a]H)(H){1|N<3>,4|C<3>}	H(C[6]C[6,6a]C[6])	119.5857	0.220	3	119.5857	0.048	3	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]N[6,6a]N[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]N[6,6a]N[6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6,6a]C[6])	121.1080	0.000	1	120.3473	0.609	3	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]N[6,6a]N[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]N[6,6a]N[6a])(C[6]C[6]H)(H){1|H<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6,6a]C[6])	119.5490	0.000	1	120.3473	0.609	3	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]N[6,6a]N[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]N[6,6a]N[6a])(C[6]C[6]H)(H){2|H<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	H(C[6]C[6,6a]C[6])	120.3850	0.000	1	120.3473	0.609	3	120.0835	0.611	6060	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]O)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]C)(O)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]O)(H){1|H<1>,4|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]C)(O){1|H<1>,2|C<3>}	H(C[6]C[6,6a]C[6])	122.0000	0.000	1	122.0000	0.000	1	120.8563	0.560	6	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]O[6a])(C[6]C[6]O)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(O)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]O[6a])(C[6]C[6]O)(H){1|H<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(O){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6,6a]C[6])	120.6213	0.641	4	120.6276	0.308	5	120.8563	0.560	6	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]O[6a])(C[6]C[6]O)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(O)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]O[6a])(C[6]C[6]O)(H){1|H<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(O){1|C<3>,2|O<2>}	H(C[6]C[6,6a]C[6])	120.6530	0.000	1	120.6276	0.308	5	120.8563	0.560	6	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6,6a]C[6a])(C[6]N[6]H)(H)	C[6](C[6]C[6,6a]H)(N[6]C[6,6]Pt)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6,6a]C[6a])(C[6]N[6]H)(H){1|Pt<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(N[6]C[6,6]Pt)(H){3|C<3>}	H(C[6]C[6,6a]C[6])	119.9570	0.000	1	119.9570	0.000	1	119.9796	0.334	219	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	C[6](C[6]C[6,6a]H)(N[6]B[5]C[6])(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|B<3>,1|C<4>,1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(N[6]B[5]C[6])(H){1|C<4>,1|H<1>,2|C<3>,2|O<2>}	H(C[6]C[6,6a]C[6])	119.9045	0.211	2	119.6950	0.154	3	119.9796	0.334	219	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	C[6](C[6]C[6,6a]H)(N[6]B[5]C[6])(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|B<3>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(N[6]B[5]C[6])(H){1|H<1>,2|C<3>,2|O<2>}	H(C[6]C[6,6a]C[6])	119.2760	0.000	1	119.6950	0.154	3	119.9796	0.334	219	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	C[6](C[6]C[6,6a]H)(N[6]C[5,6]S)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|C<4>,1|H<1>,1|S<4>,2|C<3>}	C[6](C[6]C[6,6a]H)(N[6]C[5,6]S)(H){2|C<3>,2|O<2>}	H(C[6]C[6,6a]C[6])	119.2970	0.000	1	119.2970	0.000	1	119.9796	0.334	219	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	C[6](C[6]C[6,6a]H)(N[6]C[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|Br<1>,1|C<4>,3|C<3>}	C[6](C[6]C[6,6a]H)(N[6]C[6]C)(H){1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.7415	0.012	2	119.7349	0.445	61	119.9796	0.334	219	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	C[6](C[6]C[6,6a]H)(N[6]C[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|Br<1>,1|C<4>,3|C<3>}	C[6](C[6]C[6,6a]H)(N[6]C[6]C)(H){1|H<1>,3|C<3>}	H(C[6]C[6,6a]C[6])	119.8110	0.000	1	119.7349	0.445	61	119.9796	0.334	219	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	C[6](C[6]C[6,6a]H)(N[6]C[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|C<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(N[6]C[6]C)(H){1|C<2>,1|C<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.7470	0.000	1	119.7349	0.445	61	119.9796	0.334	219	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	C[6](C[6]C[6,6a]H)(N[6]C[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|C<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(N[6]C[6]C)(H){1|C<2>,1|H<1>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.4430	0.000	1	119.7349	0.445	61	119.9796	0.334	219	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	C[6](C[6]C[6,6a]H)(N[6]C[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|C<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(N[6]C[6]C)(H){1|C<2>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.1240	1.274	2	119.7349	0.445	61	119.9796	0.334	219	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	C[6](C[6]C[6,6a]H)(N[6]C[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|C<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(N[6]C[6]C)(H){1|C<2>,3|C<3>}	H(C[6]C[6,6a]C[6])	119.1220	0.000	1	119.7349	0.445	61	119.9796	0.334	219	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	C[6](C[6]C[6,6a]H)(N[6]C[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|C<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(N[6]C[6]C)(H){1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.3700	0.182	3	119.7349	0.445	61	119.9796	0.334	219	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	C[6](C[6]C[6,6a]H)(N[6]C[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|C<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(N[6]C[6]C)(H){1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.3835	0.019	2	119.7349	0.445	61	119.9796	0.334	219	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	C[6](C[6]C[6,6a]H)(N[6]C[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|C<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(N[6]C[6]C)(H){1|H<1>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.7550	0.515	30	119.7349	0.445	61	119.9796	0.334	219	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	C[6](C[6]C[6,6a]H)(N[6]C[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|C<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(N[6]C[6]C)(H){1|H<1>,3|C<3>}	H(C[6]C[6,6a]C[6])	119.7120	0.000	1	119.7349	0.445	61	119.9796	0.334	219	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	C[6](C[6]C[6,6a]H)(N[6]C[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|C<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(N[6]C[6]C)(H){1|Ir<8>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.3197	0.474	3	119.7349	0.445	61	119.9796	0.334	219	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	C[6](C[6]C[6,6a]H)(N[6]C[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|C<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(N[6]C[6]C)(H){1|Rh<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.3173	0.170	3	119.7349	0.445	61	119.9796	0.334	219	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	C[6](C[6]C[6,6a]H)(N[6]C[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|C<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(N[6]C[6]C)(H){1|Se<1>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.3140	0.052	2	119.7349	0.445	61	119.9796	0.334	219	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	C[6](C[6]C[6,6a]H)(N[6]C[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|C<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(N[6]C[6]C)(H){3|C<3>}	H(C[6]C[6,6a]C[6])	118.0555	2.648	2	119.7349	0.445	61	119.9796	0.334	219	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	C[6](C[6]C[6,6a]H)(N[6]C[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|C<4>,1|O<2>,3|C<3>}	C[6](C[6]C[6,6a]H)(N[6]C[6]C)(H){1|H<1>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.7080	0.000	1	119.7349	0.445	61	119.9796	0.334	219	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	C[6](C[6]C[6,6a]H)(N[6]C[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|C<4>,4|C<3>}	C[6](C[6]C[6,6a]H)(N[6]C[6]C)(H){1|H<1>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.7320	0.095	5	119.7349	0.445	61	119.9796	0.334	219	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	C[6](C[6]C[6,6a]H)(N[6]C[6]C)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|H<1>,4|C<3>}	C[6](C[6]C[6,6a]H)(N[6]C[6]C)(H){1|H<1>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.7140	0.000	1	119.7349	0.445	61	119.9796	0.334	219	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	C[6](C[6]C[6,6a]H)(N[6]C[6]Cd)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|Cd<7>,1|H<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(N[6]C[6]Cd)(H){1|C<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.2352	0.141	14	120.2352	0.020	14	119.9796	0.334	219	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	C[6](C[6]C[6,6a]H)(N[6]C[6]Co)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|Co<6>,1|H<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(N[6]C[6]Co)(H){1|C<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.2060	0.000	1	119.8085	0.095	4	119.9796	0.334	219	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	C[6](C[6]C[6,6a]H)(N[6]C[6]Co)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|Co<6>,1|H<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(N[6]C[6]Co)(H){3|C<3>}	H(C[6]C[6,6a]C[6])	119.6760	0.194	3	119.8085	0.095	4	119.9796	0.334	219	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	C[6](C[6]C[6,6a]H)(N[6]C[6]Cr)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|Cr<6>,1|H<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(N[6]C[6]Cr)(H){1|H<1>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.7674	0.429	7	119.7674	0.184	7	119.9796	0.334	219	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	C[6](C[6]C[6,6a]H)(N[6]C[6]Cu)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|Cu<2>,1|H<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(N[6]C[6]Cu)(H){3|C<3>}	H(C[6]C[6,6a]C[6])	120.0520	0.219	2	120.0360	0.034	8	119.9796	0.334	219	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	C[6](C[6]C[6,6a]H)(N[6]C[6]Cu)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|Cu<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(N[6]C[6]Cu)(H){1|H<1>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.0780	0.225	3	120.0360	0.034	8	119.9796	0.334	219	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	C[6](C[6]C[6,6a]H)(N[6]C[6]Cu)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|Cu<5>,1|H<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(N[6]C[6]Cu)(H){1|H<1>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.1890	0.000	1	120.0360	0.034	8	119.9796	0.334	219	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	C[6](C[6]C[6,6a]H)(N[6]C[6]Cu)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|Cu<5>,1|H<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(N[6]C[6]Cu)(H){3|C<3>}	H(C[6]C[6,6a]C[6])	119.8805	0.110	2	120.0360	0.034	8	119.9796	0.334	219	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	C[6](C[6]C[6,6a]H)(N[6]C[6]Fe)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|Fe<6>,1|H<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(N[6]C[6]Fe)(H){1|N<3>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.4080	0.000	1	120.0760	0.089	3	119.9796	0.334	219	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	C[6](C[6]C[6,6a]H)(N[6]C[6]Fe)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|Fe<6>,1|H<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(N[6]C[6]Fe)(H){3|C<3>}	H(C[6]C[6,6a]C[6])	119.8310	0.000	1	120.0760	0.089	3	119.9796	0.334	219	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	C[6](C[6]C[6,6a]H)(N[6]C[6]Fe)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|Fe<8>,1|H<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(N[6]C[6]Fe)(H){1|H<1>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.9890	0.000	1	120.0760	0.089	3	119.9796	0.334	219	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	C[6](C[6]C[6,6a]H)(N[6]C[6]Ga)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|Ga<6>,1|H<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(N[6]C[6]Ga)(H){1|H<1>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.0927	0.330	3	120.0927	0.109	3	119.9796	0.334	219	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	C[6](C[6]C[6,6a]H)(N[6]C[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){2|H<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(N[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.8319	0.465	10	119.8821	0.174	16	119.9796	0.334	219	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	C[6](C[6]C[6,6a]H)(N[6]C[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){2|H<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(N[6]C[6]H)(H){1|N<3>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.1605	0.080	2	119.8821	0.174	16	119.9796	0.334	219	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	C[6](C[6]C[6,6a]H)(N[6]C[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){2|H<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(N[6]C[6]H)(H){1|O<2>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.4250	0.000	1	119.8821	0.174	16	119.9796	0.334	219	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	C[6](C[6]C[6,6a]H)(N[6]C[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){2|H<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(N[6]C[6]H)(H){3|C<3>}	H(C[6]C[6,6a]C[6])	119.6827	0.181	3	119.8821	0.174	16	119.9796	0.334	219	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	C[6](C[6]C[6,6a]H)(N[6]C[6]Ir)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|Ir<6>,1|H<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(N[6]C[6]Ir)(H){3|C<3>}	H(C[6]C[6,6a]C[6])	120.1636	0.426	24	120.1380	0.163	28	119.9796	0.334	219	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	C[6](C[6]C[6,6a]H)(N[6]C[6]Ir)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|Ir<7>,1|H<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(N[6]C[6]Ir)(H){3|C<3>}	H(C[6]C[6,6a]C[6])	119.9843	0.205	4	120.1380	0.163	28	119.9796	0.334	219	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	C[6](C[6]C[6,6a]H)(N[6]C[6]Mn)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|Mn<6>,1|H<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(N[6]C[6]Mn)(H){1|C<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.8847	0.097	4	119.9634	0.042	7	119.9796	0.334	219	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	C[6](C[6]C[6,6a]H)(N[6]C[6]Mn)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|Mn<6>,1|H<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(N[6]C[6]Mn)(H){3|C<3>}	H(C[6]C[6,6a]C[6])	120.0200	0.000	1	119.9634	0.042	7	119.9796	0.334	219	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	C[6](C[6]C[6,6a]H)(N[6]C[6]Mn)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|Mn<7>,1|H<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(N[6]C[6]Mn)(H){1|C<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.0925	0.405	2	119.9634	0.042	7	119.9796	0.334	219	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	C[6](C[6]C[6,6a]H)(N[6]C[6]N)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(N[6]C[6]N)(H){1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.4980	0.000	1	120.1193	0.120	3	119.9796	0.334	219	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	C[6](C[6]C[6,6a]H)(N[6]C[6]N)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|H<1>,1|N<2>,3|C<3>}	C[6](C[6]C[6,6a]H)(N[6]C[6]N)(H){1|H<1>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.0410	0.000	1	120.1193	0.120	3	119.9796	0.334	219	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	C[6](C[6]C[6,6a]H)(N[6]C[6]N)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6,6a]H)(N[6]C[6]N)(H){3|C<3>}	H(C[6]C[6,6a]C[6])	119.8190	0.000	1	120.1193	0.120	3	119.9796	0.334	219	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	C[6](C[6]C[6,6a]H)(N[6]C[6]Ni)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|Ni<6>,1|H<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(N[6]C[6]Ni)(H){1|H<1>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.5070	0.662	2	119.6120	0.252	3	119.9796	0.334	219	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	C[6](C[6]C[6,6a]H)(N[6]C[6]Ni)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|Ni<6>,1|H<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(N[6]C[6]Ni)(H){3|C<3>}	H(C[6]C[6,6a]C[6])	119.8220	0.000	1	119.6120	0.252	3	119.9796	0.334	219	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	C[6](C[6]C[6,6a]H)(N[6]C[6]O)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|H<1>,1|O<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(N[6]C[6]O)(H){1|H<1>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.0400	0.000	1	119.5638	0.214	6	119.9796	0.334	219	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	C[6](C[6]C[6,6a]H)(N[6]C[6]O)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|H<1>,1|O<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(N[6]C[6]O)(H){3|C<3>}	H(C[6]C[6,6a]C[6])	119.6686	0.430	5	119.5638	0.214	6	119.9796	0.334	219	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	C[6](C[6]C[6,6a]H)(N[6]C[6]Pd)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|Pd<4>,1|C<2>,3|C<3>}	C[6](C[6]C[6,6a]H)(N[6]C[6]Pd)(H){1|H<1>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.3935	0.168	2	120.2150	0.069	17	119.9796	0.334	219	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	C[6](C[6]C[6,6a]H)(N[6]C[6]Pd)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|Pd<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(N[6]C[6]Pd)(H){1|C<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.1080	0.170	5	120.2150	0.069	17	119.9796	0.334	219	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	C[6](C[6]C[6,6a]H)(N[6]C[6]Pd)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|Pd<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(N[6]C[6]Pd)(H){1|H<1>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.2430	0.000	1	120.2150	0.069	17	119.9796	0.334	219	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	C[6](C[6]C[6,6a]H)(N[6]C[6]Pd)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|Pd<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(N[6]C[6]Pd)(H){3|C<3>}	H(C[6]C[6,6a]C[6])	120.2317	0.323	9	120.2150	0.069	17	119.9796	0.334	219	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	C[6](C[6]C[6,6a]H)(N[6]C[6]Pt)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|Pt<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(N[6]C[6]Pt)(H){1|H<1>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.6450	0.000	1	120.1678	0.269	6	119.9796	0.334	219	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	C[6](C[6]C[6,6a]H)(N[6]C[6]Pt)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|Pt<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(N[6]C[6]Pt)(H){1|N<3>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.9670	0.000	1	120.1678	0.269	6	119.9796	0.334	219	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	C[6](C[6]C[6,6a]H)(N[6]C[6]Pt)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|Pt<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(N[6]C[6]Pt)(H){3|C<3>}	H(C[6]C[6,6a]C[6])	120.3487	0.547	4	120.1678	0.269	6	119.9796	0.334	219	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	C[6](C[6]C[6,6a]H)(N[6]C[6]Re)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|Re<6>,1|H<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(N[6]C[6]Re)(H){3|C<3>}	H(C[6]C[6,6a]C[6])	119.5460	0.000	1	119.5460	0.000	1	119.9796	0.334	219	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	C[6](C[6]C[6,6a]H)(N[6]C[6]Rh)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|Rh<6>,1|H<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(N[6]C[6]Rh)(H){1|H<1>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.2400	0.000	1	119.2400	0.000	1	119.9796	0.334	219	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	C[6](C[6]C[6,6a]H)(N[6]C[6]Tc)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|Tc<6>,1|H<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(N[6]C[6]Tc)(H){3|C<3>}	H(C[6]C[6,6a]C[6])	120.2390	0.098	2	120.2390	0.010	2	119.9796	0.334	219	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	C[6](C[6]C[6,6a]H)(N[6]C[6]Th)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|Th<13>,1|H<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(N[6]C[6]Th)(H){2|C<3>}	H(C[6]C[6,6a]C[6])	119.9180	0.000	1	119.9180	0.000	1	119.9796	0.334	219	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	C[6](C[6]C[6,6a]H)(N[6]C[6]Zn)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|Zn<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(N[6]C[6]Zn)(H){1|H<1>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.8155	0.292	2	120.4106	0.914	20	119.9796	0.334	219	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	C[6](C[6]C[6,6a]H)(N[6]C[6]Zn)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|Zn<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(N[6]C[6]Zn)(H){3|C<3>}	H(C[6]C[6,6a]C[6])	120.3675	0.078	2	120.4106	0.914	20	119.9796	0.334	219	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	C[6](C[6]C[6,6a]H)(N[6]C[6]Zn)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|Zn<5>,1|H<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(N[6]C[6]Zn)(H){1|C<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.0445	0.590	14	120.4106	0.914	20	119.9796	0.334	219	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	C[6](C[6]C[6,6a]H)(N[6]C[6]Zn)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|Zn<6>,1|H<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(N[6]C[6]Zn)(H){1|C<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	122.6115	0.930	2	120.4106	0.914	20	119.9796	0.334	219	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]N[6a])(C[6]N[6]H)(H)	C[6](C[6]C[6,6a]H)(N[6]C[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]N[6a])(C[6]N[6]H)(H){1|H<1>,2|C<3>,2|C<4>}	C[6](C[6]C[6,6a]H)(N[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.6020	0.000	1	120.4437	0.033	3	119.9796	0.334	219	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]N[6a])(C[6]N[6]H)(H)	C[6](C[6]C[6,6a]H)(N[6]C[6]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]N[6a])(C[6]N[6]H)(H){1|H<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6,6a]C[6])	120.3645	0.168	2	120.4437	0.033	3	119.9796	0.334	219	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:S-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]N[6a])(C[6]N[6]S)(H)	C[6](C[6]C[6,6a]H)(N[6]C[6]H)(S)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]N[6a])(C[6]N[6]S)(H){1|C<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(N[6]C[6]H)(S){1|C<3>,2|N<3>}	H(C[6]C[6,6a]C[6])	119.6930	0.000	2	119.6930	0.000	2	119.6930	0.000	2	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[5,6]H)(H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[5,6]H)(H){1|C<4>,1|H<1>,3|C<3>}	C[6](N[5,6]C[5,6]C[5])(C[6]C[6,6a]H)(H){1|C<2>,1|O<1>,2|C<3>,2|C<4>}	H(C[6]C[6,6a]C[6])	119.6430	0.000	1	119.7493	2.415	8	119.6313	2.238	9	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[5,6]H)(H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[5,6]H)(H){1|C<4>,1|H<1>,3|C<3>}	C[6](N[5,6]C[5,6]C[5])(C[6]C[6,6a]H)(H){1|C<4>,1|H<1>,4|C<3>}	H(C[6]C[6,6a]C[6])	121.0425	2.051	2	119.7493	2.415	8	119.6313	2.238	9	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[5,6]H)(H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[5,6]H)(H){1|H<1>,2|C<3>,2|C<4>}	C[6](N[5,6]C[5,6]C[5])(C[6]C[6,6a]H)(H){1|H<1>,2|C<2>,2|C<3>,2|C<4>}	H(C[6]C[6,6a]C[6])	120.0620	0.153	2	119.7493	2.415	8	119.6313	2.238	9	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[5,6]H)(H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[5,6]H)(H){1|H<1>,2|C<3>,2|C<4>}	C[6](N[5,6]C[5,6]C[5])(C[6]C[6,6a]H)(H){2|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6,6a]C[6])	118.7140	1.718	3	119.7493	2.415	8	119.6313	2.238	9	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[5,6]H)(H)	C[6](N[5,6]C[5,6]N[5])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[5,6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](N[5,6]C[5,6]N[5])(C[6]C[6,6a]H)(H){1|H<1>,2|N<3>,3|C<3>}	H(C[6]C[6,6a]C[6])	118.6880	0.000	1	118.6880	0.000	1	119.6313	2.238	9	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	N[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[5a,6]H)(H)	C[6](N[5a,6]C[5a,6]2)(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[5a,6]H)(H){1|H<1>,4|C<3>}	C[6](N[5a,6]C[5a,6]2)(C[6]C[6,6a]H)(H){5|C<3>}	H(C[6]C[6,6a]C[6])	119.2320	0.000	1	119.2320	0.000	1	120.7647	8.239	3	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	N[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[5a,6]H)(H)	C[6](N[5a,6]C[5a,6]C[5a])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[5a,6]H)(H){1|H<1>,4|C<3>}	C[6](N[5a,6]C[5a,6]C[5a])(C[6]C[6,6a]H)(H){5|C<3>}	H(C[6]C[6,6a]C[6])	124.0760	0.000	1	124.0760	0.000	1	120.7647	8.239	3	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	N[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[5a,6]H)(H)	C[6](N[5a,6]C[5a,6a]C[5a,6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[5a,6]H)(H){1|H<1>,4|C<3>}	C[6](N[5a,6]C[5a,6a]C[5a,6])(C[6]C[6,6a]H)(H){1|N<2>,4|C<3>}	H(C[6]C[6,6a]C[6])	118.9860	0.000	1	118.9860	0.000	1	120.7647	8.239	3	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6,6]H)(H)	C[6](N[6,6]C[6,6]B[6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6,6]H)(H){1|B<4>,1|H<1>,3|C<3>}	C[6](N[6,6]C[6,6]B[6])(C[6]C[6,6a]H)(H){1|N<2>,1|O<2>,2|C<3>,2|F<1>}	H(C[6]C[6,6a]C[6])	120.2110	0.059	2	120.1857	0.004	3	119.7746	0.255	38	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6,6]H)(H)	C[6](N[6,6]C[6,6]B[6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6,6]H)(H){1|B<4>,1|H<1>,3|C<3>}	C[6](N[6,6]C[6,6]B[6])(C[6]C[6,6a]H)(H){1|O<2>,2|F<1>,3|C<3>}	H(C[6]C[6,6a]C[6])	120.1350	0.000	1	120.1857	0.004	3	119.7746	0.255	38	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6,6]H)(H)	C[6](N[6,6]C[6,6]C[6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6,6]H)(H){1|C<4>,1|H<1>,3|C<3>}	C[6](N[6,6]C[6,6]C[6])(C[6]C[6,6a]H)(H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6,6a]C[6])	119.8038	0.507	30	119.7394	0.261	35	119.7746	0.255	38	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6,6]H)(H)	C[6](N[6,6]C[6,6]C[6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6,6]H)(H){1|C<4>,1|H<1>,3|C<3>}	C[6](N[6,6]C[6,6]C[6])(C[6]C[6,6a]H)(H){1|H<1>,1|N<2>,4|C<3>}	H(C[6]C[6,6a]C[6])	118.7530	0.000	1	119.7394	0.261	35	119.7746	0.255	38	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6,6]H)(H)	C[6](N[6,6]C[6,6]C[6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6,6]H)(H){1|C<4>,1|H<1>,3|C<3>}	C[6](N[6,6]C[6,6]C[6])(C[6]C[6,6a]H)(H){1|H<1>,1|N<3>,4|C<3>}	H(C[6]C[6,6a]C[6])	119.6250	0.000	1	119.7394	0.261	35	119.7746	0.255	38	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6,6]H)(H)	C[6](N[6,6]C[6,6]C[6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6,6]H)(H){1|C<4>,1|H<1>,3|C<3>}	C[6](N[6,6]C[6,6]C[6])(C[6]C[6,6a]H)(H){1|H<1>,1|O<1>,2|C<3>,2|C<4>}	H(C[6]C[6,6a]C[6])	119.2280	0.000	1	119.7394	0.261	35	119.7746	0.255	38	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6,6]H)(H)	C[6](N[6,6]C[6,6]C[6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6,6]H)(H){1|H<1>,2|C<3>,2|C<4>}	C[6](N[6,6]C[6,6]C[6])(C[6]C[6,6a]H)(H){1|C<4>,1|H<1>,2|C<2>,3|C<3>}	H(C[6]C[6,6a]C[6])	119.5790	0.120	2	119.7394	0.261	35	119.7746	0.255	38	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	N[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6,6a]H)(H)	C[6](N[6,6a]C[6,6a]C[6a])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6,6a]H)(H){1|H<1>,4|C<3>}	C[6](N[6,6a]C[6,6a]C[6a])(C[6]C[6,6a]H)(H){1|H<1>,4|C<3>}	H(C[6]C[6,6a]C[6])	120.3310	0.000	1	120.3310	0.000	1	120.3310	0.000	1	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a,6a]C[6a,6a])(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Os)(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a,6a]C[6a,6a])(C[6]N[6]H)(H){1|Os<6>,4|C<3>}	C[6](N[6]C[6,6a]Os)(C[6]C[6,6a]H)(H){3|C<3>}	H(C[6]C[6,6a]C[6])	119.2360	0.607	2	119.2360	0.368	2	119.4399	0.119	7	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a,6a]C[6a])(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Fe)(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a,6a]C[6a])(C[6]N[6]H)(H){1|Fe<6>,1|H<1>,3|C<3>}	C[6](N[6]C[6,6a]Fe)(C[6]C[6,6a]H)(H){3|C<3>}	H(C[6]C[6,6a]C[6])	119.5815	0.076	2	119.5815	0.006	2	119.4399	0.119	7	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a,6a]C[6a])(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Mn)(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a,6a]C[6a])(C[6]N[6]H)(H){1|Mn<6>,1|H<1>,3|C<3>}	C[6](N[6]C[6,6a]Mn)(C[6]C[6,6a]H)(H){3|C<3>}	H(C[6]C[6,6a]C[6])	119.6335	0.269	2	119.6335	0.073	2	119.4399	0.119	7	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	C[6](N[6]C[6a]C[6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|C<4>,1|H<1>,3|C<3>}	C[6](N[6]C[6a]C[6])(C[6]C[6,6a]H)(H){1|H<1>,5|C<3>}	H(C[6]C[6,6a]C[6])	119.1770	0.000	1	119.1770	0.000	1	119.4399	0.119	7	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	As[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]As[6]H)(C[6]C[6]H)(H)	C[6](As[6]C[6]W)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]As[6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|W<6>}	C[6](As[6]C[6]W)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	117.3610	0.400	12	117.3610	0.160	12	117.3610	0.160	12	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	B[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]B[6]H)(C[6]C[6]C)(H)	C[6](B[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]B[6]H)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](B[6]C[6]N[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	118.2092	0.189	4	118.2092	0.036	4	118.8906	1.169	17	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	B[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]B[6]H)(C[6]C[6]H)(H)	C[6](B[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]B[6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](B[6]C[6]N[6])(C[6]C[6]H)(H){1|H<1>,4|C<3>}	H(C[6]C[6]2)	119.4790	0.458	2	119.2903	0.212	3	118.8906	1.169	17	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	B[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]B[6]H)(C[6]C[6]H)(H)	C[6](B[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]B[6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](B[6]C[6]N[6])(C[6]C[6]H)(H){2|H<1>,3|C<3>}	H(C[6]C[6]2)	118.9130	0.000	1	119.2903	0.212	3	118.8906	1.169	17	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	B[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]B[6]H)(C[6]C[6]H)(H)	C[6](B[6]C[6]P)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]B[6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<3>}	C[6](B[6]C[6]P)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	118.4470	1.910	4	118.8275	1.963	8	118.8906	1.169	17	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	B[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]B[6]H)(C[6]C[6]H)(H)	C[6](B[6]C[6]P)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]B[6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<4>}	C[6](B[6]C[6]P)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.2080	0.740	4	118.8275	1.963	8	118.8906	1.169	17	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	B[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]B[6]H)(C[6]C[6]H)(H)	C[6](B[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]B[6]H)(C[6]C[6]H)(H){1|Zr<15>,1|C<3>,1|H<1>,1|N<3>}	C[6](B[6]C[6a]N[6])(C[6]C[6]H)(H){1|Zr<15>,1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.9230	0.000	1	119.9060	0.001	2	118.8906	1.169	17	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	B[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]B[6]H)(C[6]C[6]H)(H)	C[6](B[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]B[6]H)(C[6]C[6]H)(H){1|Zr<15>,1|C<3>,1|H<2>,1|N<3>}	C[6](B[6]C[6a]N[6])(C[6]C[6]H)(H){1|Zr<15>,1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.8890	0.000	1	119.9060	0.001	2	118.8906	1.169	17	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[3x6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[3x6]H)(C[6]C[5,6]O)(H)	C[6](C[3x6]C[5,3x6]C[6,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[3x6]H)(C[6]C[5,6]O)(H){1|H<1>,1|O<2>,2|C<4>}	C[6](C[3x6]C[5,3x6]C[6,6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>,1|O<2>,3|C<4>}	H(C[6]C[6]2)	119.5710	0.000	1	119.5710	0.000	1	120.1287	0.355	26	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[3x6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[3x6]H)(C[6]C[6,6]H)(H)	C[6](C[3x6]Si[6,6]C[5x6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[3x6]H)(C[6]C[6,6]H)(H){1|Si<4>,1|H<1>,2|C<4>}	C[6](C[3x6]Si[6,6]C[5x6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,5|C<4>}	H(C[6]C[6]2)	119.7260	0.000	1	119.7260	0.000	1	120.1287	0.355	26	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[3x6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[3x6]H)(C[6]C[6]H)(H)	C[6](C[3x6]C[3x6]N[3x6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[3x6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[3x6]C[3x6]N[3x6])(C[6]C[6]H)(H){2|Ge<3>,1|C<3>,1|P<4>,2|H<1>}	H(C[6]C[6]2)	119.3410	0.000	1	120.3030	0.211	7	120.1287	0.355	26	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[3x6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[3x6]H)(C[6]C[6]H)(H)	C[6](C[3x6]C[3x6]N[3x6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[3x6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[3x6]C[3x6]N[3x6])(C[6]C[6]H)(H){1|Nb<5>,1|C<3>,1|H<1>,3|C<4>}	H(C[6]C[6]2)	120.5340	0.000	1	120.3030	0.211	7	120.1287	0.355	26	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[3x6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[3x6]H)(C[6]C[6]H)(H)	C[6](C[3x6]C[3x6]N[3x6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[3x6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[3x6]C[3x6]N[3x6])(C[6]C[6]H)(H){1|Nb<6>,1|C<3>,1|H<1>,3|C<4>}	H(C[6]C[6]2)	120.2720	0.000	1	120.3030	0.211	7	120.1287	0.355	26	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[3x6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[3x6]H)(C[6]C[6]H)(H)	C[6](C[3x6]C[3x6]N[3x6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[3x6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[3x6]C[3x6]N[3x6])(C[6]C[6]H)(H){1|Nb<7>,1|C<3>,1|H<1>,3|C<4>}	H(C[6]C[6]2)	120.4935	0.216	4	120.3030	0.211	7	120.1287	0.355	26	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[3x6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[3x6]H)(C[6]C[6]H)(H)	C[6](C[3x6]C[5,3x6]C[3x6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[3x6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>}	C[6](C[3x6]C[5,3x6]C[3x6])(C[6]C[6]H)(H){1|C<2>,1|H<1>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	118.6220	0.000	1	118.6220	0.000	1	120.1287	0.355	26	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[3x6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[3x6]H)(C[6]C[6]H)(H)	C[6](C[3x6]N[3x6]P[3x6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[3x6]H)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|P<3>}	C[6](C[3x6]N[3x6]P[3x6])(C[6]C[6]H)(H){1|As<3>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.0913	0.096	3	120.0913	0.009	3	120.1287	0.355	26	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[3x6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[3x6]H)(C[6]N[6]C)(H)	C[6](C[3x6]C[4,6,6]C[3x6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[3x6]H)(C[6]N[6]C)(H){1|Mn<5>,1|C<3>,1|C<4>}	C[6](C[3x6]C[4,6,6]C[3x6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,4|C<4>}	H(C[6]C[6]2)	120.4940	0.228	4	120.4940	0.052	4	120.1287	0.355	26	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[3x6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[3x6]H)(H)	C[6](C[3x6]C[4,6,6]C[3x6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[3x6]H)(H){1|Mn<5>,1|C<4>,1|N<3>,2|C<3>}	C[6](C[3x6]C[4,6,6]C[3x6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>,3|C<4>}	H(C[6]C[6]2)	120.5083	0.186	3	120.1174	0.493	9	120.1287	0.355	26	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[3x6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[3x6]H)(H)	C[6](C[3x6]C[4,6,6]C[3x6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[3x6]H)(H){1|Mn<6>,1|C<4>,1|N<3>,2|C<3>}	C[6](C[3x6]C[4,6,6]C[3x6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>,3|C<4>}	H(C[6]C[6]2)	119.9730	0.000	1	120.1174	0.493	9	120.1287	0.355	26	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[3x6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[3x6]H)(H)	C[6](C[3x6]C[4,6,6]C[3x6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[3x6]H)(H){1|Re<6>,1|C<4>,1|N<3>,2|C<3>}	C[6](C[3x6]C[4,6,6]C[3x6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>,3|C<4>}	H(C[6]C[6]2)	119.9118	0.893	5	120.1174	0.493	9	120.1287	0.355	26	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[3x6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[3x6]O)(C[6]C[6,6]H)(H)	C[6](C[3x6]C[3x6]C[4x6])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[3x6]O)(C[6]C[6,6]H)(H){1|C<3>,1|C<4>,1|N<2>}	C[6](C[3x6]C[3x6]C[4x6])(C[6]C[6]H)(O){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	118.7640	0.000	1	118.7640	0.000	1	118.9794	0.062	10	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[3x6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[3x6]O)(C[6]C[6]H)(H)	C[6](C[3x6]C[3x6]2)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[3x6]O)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<1>}	C[6](C[3x6]C[3x6]2)(C[6]C[6]H)(O){1|C<3>,2|H<1>,3|C<4>}	H(C[6]C[6]2)	118.7510	0.335	2	119.0033	0.063	9	118.9794	0.062	10	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[3x6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[3x6]O)(C[6]C[6]H)(H)	C[6](C[3x6]C[3x6]2)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[3x6]O)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<1>}	C[6](C[3x6]C[3x6]2)(C[6]C[6]H)(O){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.0288	0.179	5	119.0033	0.063	9	118.9794	0.062	10	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[3x6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[3x6]O)(C[6]C[6]H)(H)	C[6](C[3x6]C[3x6]2)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[3x6]O)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<1>}	C[6](C[3x6]C[3x6]2)(C[6]C[6]H)(O){1|H<1>,2|C<4>,3|C<3>}	H(C[6]C[6]2)	119.0150	0.000	1	119.0033	0.063	9	118.9794	0.062	10	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[3x6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[3x6]O)(C[6]C[6]H)(H)	C[6](C[3x6]C[3x6]2)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[3x6]O)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<1>}	C[6](C[3x6]C[3x6]2)(C[6]C[6]H)(O){2|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.3690	0.000	1	119.0033	0.063	9	118.9794	0.062	10	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[4,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[4,6]H)(C[6]C[6]H)(H)	C[6](C[4,6]C[4,6]C[4])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[4,6]H)(C[6]C[6]H)(H){2|C<4>,2|H<1>}	C[6](C[4,6]C[4,6]C[4])(C[6]C[6]H)(H){1|C<3>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	119.5890	0.000	1	119.5890	0.000	1	119.2791	0.181	16	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[4,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[4,6]H)(C[6]C[6]H)(H)	C[6](C[4,6]N[4,6]C[4])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[4,6]H)(C[6]C[6]H)(H){1|N<3>,2|C<4>}	C[6](C[4,6]N[4,6]C[4])(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|P<4>,2|H<1>}	H(C[6]C[6]2)	119.2605	0.071	2	119.3233	0.014	3	119.2791	0.181	16	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[4,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[4,6]H)(C[6]C[6]H)(H)	C[6](C[4,6]N[4,6]C[4])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[4,6]H)(C[6]C[6]H)(H){1|N<3>,2|C<4>}	C[6](C[4,6]N[4,6]C[4])(C[6]C[6]H)(H){1|Si<4>,1|C<3>,3|H<1>}	H(C[6]C[6]2)	119.4490	0.000	1	119.3233	0.014	3	119.2791	0.181	16	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[4,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[4,6]H)(C[6]C[6]H)(H)	C[6](C[4,6]N[4,6]N[4])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[4,6]H)(C[6]C[6]H)(H){1|C<4>,2|N<3>}	C[6](C[4,6]N[4,6]N[4])(C[6]C[6]H)(H){1|Ge<3>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.0415	0.223	2	118.8100	0.056	6	119.2791	0.181	16	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[4,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[4,6]H)(C[6]C[6]H)(H)	C[6](C[4,6]N[4,6]N[4])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[4,6]H)(C[6]C[6]H)(H){1|C<4>,2|N<3>}	C[6](C[4,6]N[4,6]N[4])(C[6]C[6]H)(H){1|Si<4>,1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	118.5370	0.000	1	118.8100	0.056	6	119.2791	0.181	16	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[4,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[4,6]H)(C[6]C[6]H)(H)	C[6](C[4,6]N[4,6]N[4])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[4,6]H)(C[6]C[6]H)(H){3|N<3>}	C[6](C[4,6]N[4,6]N[4])(C[6]C[6]H)(H){1|Si<4>,1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	118.7467	0.136	3	118.8100	0.056	6	119.2791	0.181	16	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[4,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[4,6]H)(C[6]C[6]H)(H)	C[6](C[4,6]N[4,6]S[4])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[4,6]H)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|S<2>}	C[6](C[4,6]N[4,6]S[4])(C[6]C[6]H)(H){1|Si<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.6655	0.088	4	119.6745	0.008	6	119.2791	0.181	16	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[4,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[4,6]H)(C[6]C[6]H)(H)	C[6](C[4,6]N[4,6]S[4])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[4,6]H)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|S<2>}	C[6](C[4,6]N[4,6]S[4])(C[6]C[6]H)(H){1|Si<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.6925	0.120	2	119.6745	0.008	6	119.2791	0.181	16	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6,6]H)(C[6]C[6]H)(H)	C[6](C[5,6,6]C[5,5,6,6]C[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[5,6,6]C[5,5,6,6]C[5,6])(C[6]C[6]H)(H){1|H<1>,2|C<4>,3|C<3>}	H(C[6]C[6]2)	119.0620	0.000	1	119.0620	0.000	1	119.0620	0.000	1	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[5,6]Cl)(C[6]C[6]Cl)(H)	C[6](C[5,6]N[5,6]N[5])(C[6]C[6]H)(Cl)	H(C[6]C[6]2)	C[6](C[6]C[5,6]Cl)(C[6]C[6]Cl)(H){1|H<1>,2|N<3>}	C[6](C[5,6]N[5,6]N[5])(C[6]C[6]H)(Cl){1|Cl<1>,1|Re<6>,3|C<3>}	H(C[6]C[6]2)	120.0390	0.000	1	120.0390	0.000	1	119.9160	0.030	2	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[5,6]Cl)(C[6]C[6]H)(H)	C[6](C[5,6]N[5,6]N[5])(C[6]C[6]H)(Cl)	H(C[6]C[6]2)	C[6](C[6]C[5,6]Cl)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[5,6]N[5,6]N[5])(C[6]C[6]H)(Cl){1|C<3>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7930	0.000	1	119.7930	0.000	1	119.9160	0.030	2	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[3x3,4,3x5,14x6]C[6])(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,5a]N[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[3x3,4,3x5,14x6]C[6])(C[6]C[5,6]H)(H){1|C<3>,1|H<1>,1|N<3>,4|B<6>}	C[6](C[5,6]C[5,5a]N[5,6])(C[6]C[6]H)(H){1|B<4>,1|C<5>,1|S<2>,2|C<3>}	H(C[6]C[6]2)	119.8350	0.000	1	119.8350	0.000	1	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]C[6a])(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C[6a])(C[6]C[5,6]H)(H){1|O<2>,2|C<4>,3|C<3>}	C[6](C[5,6]C[5,5,6]C[5])(C[6]C[6]H)(H){1|N<3>,1|O<1>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	118.6250	0.240	2	118.6250	0.058	2	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6,6]H)(H)	C[6](C[5,6]C[5,6,6]C[5,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6,6]H)(H){1|Ru<11>,1|C<3>,2|C<4>}	C[6](C[5,6]C[5,6,6]C[5,6a])(C[6]C[6]H)(H){1|Ru<11>,1|H<1>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	118.0370	0.000	1	118.0370	0.000	1	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6,6]H)(H)	C[6](C[5,6]C[5,6,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6,6]H)(H){4|C<4>}	C[6](C[5,6]C[5,6,6]C[5])(C[6]C[6]H)(H){1|O<2>,2|C<4>,4|H<1>}	H(C[6]C[6]2)	119.9250	0.000	1	119.9250	0.000	1	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6,6]H)(H)	C[6](C[5,6]N[5,6,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6,6]H)(H){1|N<3>,2|C<4>}	C[6](C[5,6]N[5,6,6]C[5])(C[6]C[6]H)(H){1|C<3>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	119.4720	0.000	1	119.4720	0.000	1	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]B)(H)	C[6](C[5,6]C[5,6a]N[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]B)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[5,6]C[5,6a]N[5,6])(C[6]C[6]H)(H){1|B<3>,1|B<4>,3|C<3>}	H(C[6]C[6]2)	119.4320	0.530	2	119.4320	0.281	2	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]C)(H)	C[6](C[5,6]C[5,5a]N[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[5,6]C[5,5a]N[5,6])(C[6]C[6]H)(H){1|B<4>,1|C<4>,1|S<2>,2|C<3>}	H(C[6]C[6]2)	120.0070	0.000	1	120.0070	0.000	1	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]C)(H)	C[6](C[5,6]C[5,6]N[5,5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[5,6]C[5,6]N[5,5])(C[6]C[6]H)(H){1|Nb<6>,1|P<4>,3|C<3>}	H(C[6]C[6]2)	117.0160	0.000	1	117.0160	0.000	1	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]C)(H)	C[6](C[5,6]C[5,6]N[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[5,6]C[5,6]N[5,6])(C[6]C[6]H)(H){1|In<6>,1|C<4>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.7952	0.152	6	119.7952	0.023	6	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]C)(H)	C[6](C[5,6]C[5,6a]N[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[5,6]C[5,6a]N[5,6])(C[6]C[6]H)(H){1|B<4>,4|C<3>}	H(C[6]C[6]2)	119.4810	0.000	1	119.4810	0.000	1	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]C)(H)	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|In<6>,1|O<1>,1|O<2>,2|C<3>}	H(C[6]C[6]2)	120.2610	0.000	1	120.2610	0.000	1	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]C)(H)	C[6](C[5,6]N[5,6]N[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]C)(H){1|H<1>,2|N<3>}	C[6](C[5,6]N[5,6]N[5])(C[6]C[6]H)(H){2|C<3>,3|C<4>}	H(C[6]C[6]2)	119.3480	0.000	1	119.3480	0.000	1	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]F)(H)	C[6](C[5,6]N[5,6]N[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]F)(H){1|H<1>,2|N<3>}	C[6](C[5,6]N[5,6]N[5])(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|F<1>,2|C<4>}	H(C[6]C[6]2)	120.4850	0.000	1	120.4850	0.000	1	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[3,5]C[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>}	C[6](C[5,6]C[3,5]C[5,6])(C[6]C[6]H)(H){1|C<2>,2|H<1>,3|C<4>}	H(C[6]C[6]2)	122.1450	0.000	1	122.1450	0.000	1	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,5]N[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[5,6]C[5,5]N[5,6])(C[6]C[6]H)(H){1|In<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.4500	0.000	1	120.1950	0.101	4	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,5]N[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[5,6]C[5,5]N[5,6])(C[6]C[6]H)(H){1|Si<4>,1|C<3>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1100	0.328	3	120.1950	0.101	4	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,5a]N[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[5,6]C[5,5a]N[5,6])(C[6]C[6]H)(H){1|B<4>,1|H<1>,1|S<2>,2|C<3>}	H(C[6]C[6]2)	120.2400	0.000	1	119.8152	0.172	6	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,5a]N[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[5,6]C[5,5a]N[5,6])(C[6]C[6]H)(H){1|Si<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.3090	0.000	1	119.8152	0.172	6	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,5a]N[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|N<3>,1|P<4>}	C[6](C[5,6]C[5,5a]N[5,6])(C[6]C[6]H)(H){1|In<5>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.5855	0.275	4	119.8152	0.172	6	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6,6]C[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<1>}	C[6](C[5,6]C[5,6,6]C[5,6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>,3|C<4>}	H(C[6]C[6]2)	119.2110	0.000	1	119.2110	0.000	1	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6,6]N[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[5,6]C[5,6,6]N[5,6])(C[6]C[6]H)(H){1|Ge<3>,1|C<3>,1|H<1>,1|N<3>,2|C<4>}	H(C[6]C[6]2)	120.0850	0.000	1	119.9910	0.018	2	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6,6]N[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[5,6]C[5,6,6]N[5,6])(C[6]C[6]H)(H){1|Ge<3>,1|C<3>,1|H<1>,1|N<4>,2|C<4>}	H(C[6]C[6]2)	119.8970	0.000	1	119.9910	0.018	2	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|Si<4>,1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.3780	0.000	1	121.0819	41.625	21	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|Si<4>,1|O<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8600	0.000	1	121.0819	41.625	21	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<1>}	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<2>,3|H<1>}	H(C[6]C[6]2)	119.4848	0.134	4	121.0819	41.625	21	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<1>}	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|C<3>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	119.6090	0.000	1	121.0819	41.625	21	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>}	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|C<2>,1|C<4>,1|N<3>,3|H<1>}	H(C[6]C[6]2)	120.7510	0.000	1	121.0819	41.625	21	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>}	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|C<2>,1|H<1>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	148.7530	0.000	1	121.0819	41.625	21	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|H<1>,1|O<2>,2|C<4>}	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|N<3>,2|C<4>,4|H<1>}	H(C[6]C[6]2)	119.8648	0.248	6	121.0819	41.625	21	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|Os<8>,2|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.4550	0.000	1	121.0819	41.625	21	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ru<5>,1|Ru<7>,1|C<3>,1|C<4>}	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|Ru<7>,1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.5600	0.133	2	121.0819	41.625	21	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){2|C<3>}	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	123.6230	0.000	1	121.0819	41.625	21	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){2|C<3>}	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|C<2>,1|H<1>,1|N<2>,1|O<2>,1|S<4>}	H(C[6]C[6]2)	116.8300	0.000	1	121.0819	41.625	21	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){2|C<3>}	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|Se<4>,1|C<2>,1|H<1>,1|N<3>,1|O<3>}	H(C[6]C[6]2)	120.2130	0.000	1	121.0819	41.625	21	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]N[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[5,6]C[5,6]N[5,6])(C[6]C[6]H)(H){1|Ga<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.6225	0.808	2	120.1721	0.101	76	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]N[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[5,6]C[5,6]N[5,6])(C[6]C[6]H)(H){1|Ga<5>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.1660	0.194	4	120.1721	0.101	76	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]N[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[5,6]C[5,6]N[5,6])(C[6]C[6]H)(H){1|Ga<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.2095	0.335	32	120.1721	0.101	76	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]N[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[5,6]C[5,6]N[5,6])(C[6]C[6]H)(H){1|Ge<2>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.1825	0.166	2	120.1721	0.101	76	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]N[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[5,6]C[5,6]N[5,6])(C[6]C[6]H)(H){1|Ge<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.0035	0.062	2	120.1721	0.101	76	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]N[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[5,6]C[5,6]N[5,6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|P<6>,2|C<3>}	H(C[6]C[6]2)	120.0300	0.188	2	120.1721	0.101	76	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]N[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[5,6]C[5,6]N[5,6])(C[6]C[6]H)(H){1|In<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.0927	0.246	4	120.1721	0.101	76	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]N[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[5,6]C[5,6]N[5,6])(C[6]C[6]H)(H){1|Nb<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.2455	0.214	2	120.1721	0.101	76	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]N[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[5,6]C[5,6]N[5,6])(C[6]C[6]H)(H){1|Si<5>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.2595	0.158	4	120.1721	0.101	76	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]N[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[5,6]C[5,6]N[5,6])(C[6]C[6]H)(H){1|Si<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.3885	0.127	13	120.1721	0.101	76	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]N[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|N<3>,1|P<3>}	C[6](C[5,6]C[5,6]N[5,6])(C[6]C[6]H)(H){1|Ga<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.9830	0.277	2	120.1721	0.101	76	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]N[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|N<3>,1|P<3>}	C[6](C[5,6]C[5,6]N[5,6])(C[6]C[6]H)(H){1|In<5>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.1540	0.380	2	120.1721	0.101	76	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]N[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|N<3>,1|P<4>}	C[6](C[5,6]C[5,6]N[5,6])(C[6]C[6]H)(H){1|Ga<5>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.6190	0.089	2	120.1721	0.101	76	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]N[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|N<3>,1|P<4>}	C[6](C[5,6]C[5,6]N[5,6])(C[6]C[6]H)(H){1|In<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.6030	0.000	1	120.1721	0.101	76	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]N[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|N<3>,2|C<3>}	C[6](C[5,6]C[5,6]N[5,6])(C[6]C[6]H)(H){1|Ga<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.9850	0.274	2	120.1721	0.101	76	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]N[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|N<3>}	C[6](C[5,6]C[5,6]N[5])(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|C<4>,1|H<1>,1|S<2>}	H(C[6]C[6]2)	117.6450	0.000	1	118.6515	2.026	2	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]N[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|N<3>}	C[6](C[5,6]C[5,6]N[5])(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.6580	0.000	1	118.6515	2.026	2	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]S[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|S<2>}	C[6](C[5,6]C[5,6]S[5])(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5000	3.642	3	120.5000	13.267	3	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6a]C[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Os<5>,1|Os<6>,1|C<3>,1|C<4>}	C[6](C[5,6]C[5,6a]C[5,6])(C[6]C[6]H)(H){1|Os<6>,1|H<1>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	116.9240	0.066	2	117.9307	3.042	3	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6a]C[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){2|C<3>}	C[6](C[5,6]C[5,6a]C[5,6])(C[6]C[6]H)(H){1|B<4>,1|C<2>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.9440	0.000	1	117.9307	3.042	3	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6a]N[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[5,6]C[5,6a]N[5,6])(C[6]C[6]H)(H){1|B<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.0306	0.174	10	119.9757	0.064	12	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6a]N[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[5,6]C[5,6a]N[5,6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.3480	0.000	1	119.9757	0.064	12	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6a]N[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,2|N<3>}	C[6](C[5,6]C[5,6a]N[5,6])(C[6]C[6]H)(H){1|B<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.0540	0.000	1	119.9757	0.064	12	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]N[5,6]2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[5,6]N[5,6]2)(C[6]C[6]H)(H){1|H<1>,1|P<2>,3|C<3>}	H(C[6]C[6]2)	119.9320	0.000	2	119.9217	0.000	3	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]N[5,6]2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[5,6]N[5,6]2)(C[6]C[6]H)(H){1|H<1>,1|P<6>,3|C<3>}	H(C[6]C[6]2)	119.9010	0.000	1	119.9217	0.000	3	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	120.2540	0.000	1	120.0334	0.139	130	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|C<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.1030	0.000	1	120.0334	0.139	130	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|Ga<4>,1|C<3>,1|H<1>,1|O<1>,1|O<2>}	H(C[6]C[6]2)	119.3850	0.000	1	120.0334	0.139	130	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|Ga<4>,1|C<3>,1|P<4>,2|H<1>}	H(C[6]C[6]2)	119.6940	0.000	1	120.0334	0.139	130	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	119.7880	0.000	1	120.0334	0.139	130	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|B<3>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.4850	0.000	1	120.0334	0.139	130	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>,1|N<3>,1|O<1>}	H(C[6]C[6]2)	120.0320	0.000	1	120.0334	0.139	130	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|B<4>,1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.6650	0.000	1	120.0334	0.139	130	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|B<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.9545	0.105	2	120.0334	0.139	130	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|B<4>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5104	0.088	5	120.0334	0.139	130	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>,2|C<4>}	H(C[6]C[6]2)	119.4320	0.000	1	120.0334	0.139	130	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|C<3>,1|N<3>,1|P<2>,2|H<1>}	H(C[6]C[6]2)	119.6710	0.000	1	120.0334	0.139	130	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|C<3>,1|N<3>,1|P<3>,2|H<1>}	H(C[6]C[6]2)	119.7320	0.000	1	120.0334	0.139	130	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.7640	0.000	1	120.0334	0.139	130	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.9923	0.356	15	120.0334	0.139	130	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|Ga<4>,1|C<3>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.1980	0.000	1	120.0334	0.139	130	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|Ga<5>,1|C<3>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2300	0.000	1	120.0334	0.139	130	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|Ga<5>,1|C<3>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.4060	0.253	4	120.0334	0.139	130	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|Ga<5>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.3890	0.000	1	120.0334	0.139	130	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|Ga<6>,1|C<3>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3770	1.041	2	120.0334	0.139	130	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|Ga<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.1165	0.472	2	120.0334	0.139	130	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.3760	0.155	4	120.0334	0.139	130	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	119.6409	0.127	11	120.0334	0.139	130	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|O<1>,3|C<3>}	H(C[6]C[6]2)	120.3050	0.164	4	120.0334	0.139	130	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|O<2>,1|P<4>,2|C<3>}	H(C[6]C[6]2)	119.4515	0.384	2	120.0334	0.139	130	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|In<5>,1|C<3>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9440	0.000	1	120.0334	0.139	130	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|In<6>,1|C<3>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2062	0.219	6	120.0334	0.139	130	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|In<6>,1|C<3>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.5515	0.296	2	120.0334	0.139	130	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|In<7>,1|C<3>,1|H<1>,1|O<1>,1|O<2>}	H(C[6]C[6]2)	120.3670	0.000	1	120.0334	0.139	130	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|Se<2>,1|H<1>,1|N<2>,2|C<3>}	H(C[6]C[6]2)	119.7300	0.000	1	120.0334	0.139	130	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|Se<2>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.8260	0.086	2	120.0334	0.139	130	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|Si<4>,1|C<3>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.9080	0.013	2	120.0334	0.139	130	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|Si<4>,1|H<1>,1|O<2>,2|C<3>}	H(C[6]C[6]2)	119.4550	0.000	1	120.0334	0.139	130	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|C<4>,1|O<2>,2|H<1>}	H(C[6]C[6]2)	119.9455	0.245	4	120.0334	0.139	130	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|B<6>,1|C<3>,1|C<5>,3|H<1>}	H(C[6]C[6]2)	119.6320	0.000	1	120.0334	0.139	130	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|B<6>,1|C<3>,1|C<6>,3|H<1>}	H(C[6]C[6]2)	119.7910	0.000	1	120.0334	0.139	130	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>,3|H<1>}	H(C[6]C[6]2)	119.8920	0.000	1	120.0334	0.139	130	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|C<3>,2|H<1>,3|C<4>}	H(C[6]C[6]2)	120.3510	0.000	1	120.0334	0.139	130	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<2>,3|C<3>}	H(C[6]C[6]2)	120.0750	0.000	1	120.0334	0.139	130	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	118.9290	0.000	1	120.0334	0.139	130	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|Ga<4>,1|C<3>,1|C<4>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.0330	0.215	2	120.0334	0.139	130	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|Ga<6>,1|C<3>,1|N<3>,3|H<1>}	H(C[6]C[6]2)	120.1280	0.000	1	120.0334	0.139	130	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|Ga<6>,1|C<3>,1|N<4>,3|H<1>}	H(C[6]C[6]2)	120.3700	0.072	4	120.0334	0.139	130	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|O<2>,4|C<3>}	H(C[6]C[6]2)	120.1430	0.018	3	120.0334	0.139	130	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|In<6>,1|C<3>,1|N<4>,3|H<1>}	H(C[6]C[6]2)	120.0505	0.388	2	120.0334	0.139	130	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|In<6>,1|C<3>,1|O<2>,3|H<1>}	H(C[6]C[6]2)	120.3600	0.223	2	120.0334	0.139	130	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|Si<5>,1|C<3>,1|C<4>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.2650	0.126	2	120.0334	0.139	130	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|Si<5>,1|C<3>,1|N<3>,3|H<1>}	H(C[6]C[6]2)	120.2878	0.136	8	120.0334	0.139	130	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){2|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.8840	0.000	1	120.0334	0.139	130	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|N<3>,2|C<3>}	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	119.8490	0.000	1	120.0334	0.139	130	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|N<3>,2|C<3>}	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|C<3>,1|N<3>,1|P<2>,2|H<1>}	H(C[6]C[6]2)	120.0950	0.375	2	120.0334	0.139	130	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|N<3>,2|C<3>}	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|In<4>,1|C<3>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7370	0.000	1	120.0334	0.139	130	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|N<3>,2|C<3>}	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|In<6>,1|C<3>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0830	0.040	2	120.0334	0.139	130	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|N<3>,2|C<3>}	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|In<6>,1|C<3>,1|H<1>,1|O<1>,1|O<2>}	H(C[6]C[6]2)	120.3543	0.205	3	120.0334	0.139	130	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|N<3>,2|C<4>}	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|N<3>,3|H<1>}	H(C[6]C[6]2)	120.0605	0.170	2	120.0334	0.139	130	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|N<3>,2|C<4>}	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|P<4>,3|H<1>}	H(C[6]C[6]2)	120.1770	0.000	1	120.0334	0.139	130	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|N<3>,2|C<4>}	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|Ga<4>,1|B<4>,1|C<3>,1|P<4>,2|H<1>}	H(C[6]C[6]2)	120.1830	0.000	1	120.0334	0.139	130	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]N[5,6]N[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<4>,2|N<3>}	C[6](C[5,6]N[5,6]N[5])(C[6]C[6]H)(H){1|Cu<4>,1|H<1>,1|S<2>,2|C<3>}	H(C[6]C[6]2)	119.5420	0.048	2	119.2916	1.004	15	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]N[5,6]N[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[5,6]N[5,6]N[5])(C[6]C[6]H)(H){1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.3165	0.227	2	119.2916	1.004	15	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]N[5,6]N[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[5,6]N[5,6]N[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	118.6310	0.000	1	119.2916	1.004	15	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]N[5,6]N[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[5,6]N[5,6]N[5])(C[6]C[6]H)(H){1|In<6>,1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1880	0.000	1	119.2916	1.004	15	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]N[5,6]N[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[5,6]N[5,6]N[5])(C[6]C[6]H)(H){1|C<4>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	118.2197	1.865	3	119.2916	1.004	15	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]N[5,6]N[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[5,6]N[5,6]N[5])(C[6]C[6]H)(H){1|Co<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.6490	0.000	1	119.2916	1.004	15	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]N[5,6]N[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[5,6]N[5,6]N[5])(C[6]C[6]H)(H){1|Cu<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.1200	0.000	1	119.2916	1.004	15	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]N[5,6]N[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[5,6]N[5,6]N[5])(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.6870	0.000	1	119.2916	1.004	15	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]N[5,6]N[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[5,6]N[5,6]N[5])(C[6]C[6]H)(H){1|Pt<5>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.2120	0.000	1	119.2916	1.004	15	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]N[5,6]N[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[5,6]N[5,6]N[5])(C[6]C[6]H)(H){1|Ru<6>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.7555	0.907	2	119.2916	1.004	15	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]N[5,6]O[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<4>,1|N<3>,1|O<2>}	C[6](C[5,6]N[5,6]O[5])(C[6]C[6]H)(H){1|Si<5>,1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.5290	0.034	2	119.5341	0.045	14	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]N[5,6]O[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Cl<1>,1|N<3>,1|O<2>}	C[6](C[5,6]N[5,6]O[5])(C[6]C[6]H)(H){1|Si<5>,1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.4345	0.106	6	119.5341	0.045	14	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]N[5,6]O[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<2>}	C[6](C[5,6]N[5,6]O[5])(C[6]C[6]H)(H){1|Si<4>,1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.4280	0.000	1	119.5341	0.045	14	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]N[5,6]O[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<2>}	C[6](C[5,6]N[5,6]O[5])(C[6]C[6]H)(H){1|Si<5>,1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.6763	0.145	3	119.5341	0.045	14	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]N[5,6]O[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<2>}	C[6](C[5,6]N[5,6]O[5])(C[6]C[6]H)(H){1|Si<5>,1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.6780	0.559	2	119.5341	0.045	14	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]N[5,6]P[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|P<2>}	C[6](C[5,6]N[5,6]P[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.6250	0.000	2	120.0612	0.183	5	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]N[5,6]P[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|P<2>}	C[6](C[5,6]N[5,6]P[5])(C[6]C[6]H)(H){1|H<1>,1|P<2>,2|C<3>}	H(C[6]C[6]2)	120.5070	0.000	1	120.0612	0.183	5	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]N[5,6]P[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|P<2>}	C[6](C[5,6]N[5,6]P[5])(C[6]C[6]H)(H){1|H<1>,1|P<3>,2|C<3>}	H(C[6]C[6]2)	120.2745	0.252	2	120.0612	0.183	5	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]N[5,6]S[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|S<2>}	C[6](C[5,6]N[5,6]S[5])(C[6]C[6]H)(H){1|Ge<2>,1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.8830	0.000	1	120.2030	0.205	2	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]N[5,6]S[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|S<2>}	C[6](C[5,6]N[5,6]S[5])(C[6]C[6]H)(H){1|In<6>,1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.5230	0.000	1	120.2030	0.205	2	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]N[5,6]Se[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Se<2>,1|H<1>,1|N<3>}	C[6](C[5,6]N[5,6]Se[5])(C[6]C[6]H)(H){1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.9290	0.000	1	119.9290	0.000	1	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]N[5,6]Si[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Si<4>,1|H<1>,1|N<3>}	C[6](C[5,6]N[5,6]Si[5])(C[6]C[6]H)(H){1|Ga<4>,1|C<3>,1|H<1>,3|C<4>}	H(C[6]C[6]2)	120.3470	0.098	3	120.4983	0.067	7	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]N[5,6]Si[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Si<4>,1|H<1>,1|N<3>}	C[6](C[5,6]N[5,6]Si[5])(C[6]C[6]H)(H){1|Ga<5>,1|C<3>,1|H<1>,3|C<4>}	H(C[6]C[6]2)	120.7635	0.405	2	120.4983	0.067	7	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]N[5,6]Si[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Si<4>,1|H<1>,1|N<3>}	C[6](C[5,6]N[5,6]Si[5])(C[6]C[6]H)(H){1|In<4>,1|C<3>,1|H<1>,3|C<4>}	H(C[6]C[6]2)	120.4600	0.092	2	120.4983	0.067	7	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]I)(H)	C[6](C[5,6]C[5,6]N[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]I)(H){1|C<3>,1|N<3>}	C[6](C[5,6]C[5,6]N[5])(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|C<4>,1|H<1>,1|I<1>}	H(C[6]C[6]2)	120.5150	0.000	1	120.5150	0.000	1	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]Ir)(H)	C[6](C[5,6]N[5,6]O[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]Ir)(H){1|O<2>,2|N<3>}	C[6](C[5,6]N[5,6]O[5])(C[6]C[6]H)(H){1|Ir<8>,1|C<3>,2|C<4>}	H(C[6]C[6]2)	118.0800	0.000	1	118.0800	0.000	1	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]N)(H)	C[6](C[5,6]N[5,6]N[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]N)(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[5,6]N[5,6]N[5])(C[6]C[6]H)(H){1|C<3>,1|C<4>,2|N<3>}	H(C[6]C[6]2)	120.1820	0.000	1	120.1820	0.000	1	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]N)(H)	C[6](C[5,6]N[5,6]O[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]N)(H){1|H<1>,1|N<3>,1|O<2>}	C[6](C[5,6]N[5,6]O[5])(C[6]C[6]H)(H){1|Si<5>,1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.6685	0.227	2	120.6685	0.052	2	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	C[6](C[5,6]C[5,6]N[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[5,6]C[5,6]N[5])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<1>,1|O<2>}	H(C[6]C[6]2)	119.0550	0.000	1	119.0550	0.000	1	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	C[6](C[5,6]C[5,6]O[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|C<3>,1|O<2>,2|H<1>}	C[6](C[5,6]C[5,6]O[5])(C[6]C[6]H)(H){1|O<2>,3|C<4>}	H(C[6]C[6]2)	119.8120	0.000	1	119.8120	0.000	1	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]N[5,6]H)(H)	C[6](C[5,6]C[5,5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]N[5,6]H)(H){1|C<4>,2|C<3>}	C[6](C[5,6]C[5,5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	120.6640	0.000	1	120.6640	0.000	1	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]N[6]C)(H)	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]N[6]C)(H){1|Co<5>,1|C<3>,1|C<4>}	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3080	0.000	1	120.3080	0.000	1	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]N[6]Cl)(H)	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]N[6]Cl)(H){1|Al<5>,1|C<3>,1|C<4>}	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|Cl<1>,1|N<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	120.4330	0.000	1	120.4330	0.000	1	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	C[6](C[5,6]C[5,5]C[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[5,6]C[5,5]C[5,6])(C[6]C[6]H)(H){1|N<3>,1|N<4>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	120.2210	0.000	1	119.7730	0.401	2	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	C[6](C[5,6]C[5,5]C[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|C<4>}	C[6](C[5,6]C[5,5]C[5,6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,4|C<3>}	H(C[6]C[6]2)	119.3250	0.000	1	119.7730	0.401	2	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Ag<4>,2|C<3>}	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>,2|C<3>}	H(C[6]C[6]2)	119.7495	0.077	2	118.9983	5.317	76	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|C<4>,2|C<3>}	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>,2|C<3>}	H(C[6]C[6]2)	119.7015	0.029	2	118.9983	5.317	76	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Co<6>,2|C<3>}	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>,2|C<3>}	H(C[6]C[6]2)	116.5352	6.767	8	118.9983	5.317	76	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Cu<3>,2|C<3>}	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	119.1420	0.010	2	118.9983	5.317	76	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|C<4>}	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|C<4>,2|N<3>,3|H<1>}	H(C[6]C[6]2)	119.2280	0.000	1	118.9983	5.317	76	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Cu<4>,2|C<3>}	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.2627	0.394	4	118.9983	5.317	76	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Cu<4>,2|C<3>}	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	119.1947	0.250	4	118.9983	5.317	76	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>,2|C<3>}	H(C[6]C[6]2)	120.0200	0.000	1	118.9983	5.317	76	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	119.7320	0.000	1	118.9983	5.317	76	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|C<4>}	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	119.2065	0.342	2	118.9983	5.317	76	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|C<4>}	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>,3|H<1>}	H(C[6]C[6]2)	119.5885	0.095	2	118.9983	5.317	76	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Ni<6>,2|C<3>}	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>,2|C<3>}	H(C[6]C[6]2)	120.5157	1.266	3	118.9983	5.317	76	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Ni<6>,2|C<3>}	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	119.2115	0.105	2	118.9983	5.317	76	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|C<4>}	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	119.7650	0.000	1	118.9983	5.317	76	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|C<4>}	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|Pd<4>,1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8840	0.000	1	118.9983	5.317	76	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Pd<4>,2|C<3>}	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>,2|C<3>}	H(C[6]C[6]2)	120.2405	0.299	4	118.9983	5.317	76	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|C<4>}	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|N<3>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	119.2685	0.005	2	118.9983	5.317	76	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Rh<4>,1|C<3>,1|C<4>}	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|Rh<4>,1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.8300	0.000	1	118.9983	5.317	76	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Rh<4>,2|C<3>}	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.0010	0.190	2	118.9983	5.317	76	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Rh<6>,2|C<3>}	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	118.7897	0.153	4	118.9983	5.317	76	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Rh<6>,2|C<3>}	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	118.8920	0.173	4	118.9983	5.317	76	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|C<4>}	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|N<3>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	119.2085	0.169	2	118.9983	5.317	76	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Ru<6>,2|C<3>}	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|B<3>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	118.6730	0.341	2	118.9983	5.317	76	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Ru<6>,2|C<3>}	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>,2|C<3>}	H(C[6]C[6]2)	119.8800	0.000	1	118.9983	5.317	76	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Ru<6>,2|C<3>}	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	118.9702	0.297	4	118.9983	5.317	76	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Ru<8>,1|C<3>,1|C<4>}	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.1585	0.097	2	118.9983	5.317	76	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Ru<8>,1|C<3>,1|C<4>}	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|Ru<8>,1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	118.8095	0.228	2	118.9983	5.317	76	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Ru<8>,2|C<3>}	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	118.5862	0.189	6	118.9983	5.317	76	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Zn<4>,2|C<3>}	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	118.8265	0.084	2	118.9983	5.317	76	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Zn<6>,2|C<3>}	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>,2|C<3>}	H(C[6]C[6]2)	119.8490	0.498	2	118.9983	5.317	76	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	C[6](C[5,6]C[5,6]N[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[5,6]C[5,6]N[5])(C[6]C[6]H)(H){1|N<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.4793	0.385	3	119.6345	0.096	6	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	C[6](C[5,6]C[5,6]N[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|N<2>}	C[6](C[5,6]C[5,6]N[5])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>,1|P<4>}	H(C[6]C[6]2)	119.7897	0.137	3	119.6345	0.096	6	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]N[6]O)(H)	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]N[6]O)(H){1|Cu<4>,1|C<3>,1|C<4>}	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|C<4>,1|O<2>,2|H<1>,2|N<3>}	H(C[6]C[6]2)	121.2320	0.000	1	121.2320	0.000	1	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]S[6]H)(H)	C[6](C[5,6]C[5,6a]C[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]S[6]H)(H){2|C<3>}	C[6](C[5,6]C[5,6a]C[5,6])(C[6]C[6]H)(H){1|H<1>,1|S<2>,3|C<3>}	H(C[6]C[6]2)	117.9980	0.119	2	117.9980	0.014	2	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]Se[6]H)(H)	C[6](C[5,6]C[5,6a]C[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]Se[6]H)(H){2|C<3>}	C[6](C[5,6]C[5,6a]C[5,6])(C[6]C[6]H)(H){1|Se<2>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	118.0130	0.000	1	118.0130	0.000	1	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)2(H)	C[6](C[5,6]N[5,5,6]C[5,5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)2(H){1|N<3>,2|C<3>}	C[6](C[5,6]N[5,5,6]C[5,5])(C[6]C[6]H)(H){1|Ga<5>,1|C<3>,1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	119.8340	0.000	1	119.6063	0.043	3	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)2(H)	C[6](C[5,6]N[5,5,6]C[5,5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)2(H){1|N<3>,2|C<3>}	C[6](C[5,6]N[5,5,6]C[5,5])(C[6]C[6]H)(H){1|Ga<5>,1|C<3>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	119.4925	0.090	2	119.6063	0.043	3	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)2(H)	C[6](C[5,6]N[5,5,6]C[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)2(H){1|N<3>,2|C<3>}	C[6](C[5,6]N[5,5,6]C[5,6])(C[6]C[6]H)(H){1|Ga<5>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.7060	0.334	4	119.6468	0.094	18	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)2(H)	C[6](C[5,6]N[5,5,6]C[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)2(H){1|N<3>,2|C<3>}	C[6](C[5,6]N[5,5,6]C[5,6])(C[6]C[6]H)(H){1|Ga<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.6337	0.065	6	119.6468	0.094	18	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)2(H)	C[6](C[5,6]N[5,5,6]C[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)2(H){1|N<3>,2|C<3>}	C[6](C[5,6]N[5,5,6]C[5,6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|P<6>,2|C<3>}	H(C[6]C[6]2)	119.5075	0.015	2	119.6468	0.094	18	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)2(H)	C[6](C[5,6]N[5,5,6]C[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)2(H){1|N<3>,2|C<3>}	C[6](C[5,6]N[5,5,6]C[5,6])(C[6]C[6]H)(H){1|In<5>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.2225	0.076	2	119.6468	0.094	18	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)2(H)	C[6](C[5,6]N[5,5,6]C[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)2(H){1|N<3>,2|C<3>}	C[6](C[5,6]N[5,5,6]C[5,6])(C[6]C[6]H)(H){1|In<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.3893	0.295	4	119.6468	0.094	18	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)2(H)	C[6](C[5,6]N[5,5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[5,6]N[5,5,6]C[5])(C[6]C[6]H)(H){1|Ga<6>,1|C<3>,1|H<1>,1|O<1>,1|O<2>}	H(C[6]C[6]2)	119.7815	0.148	2	120.3238	0.244	15	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)2(H)	C[6](C[5,6]N[5,5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[5,6]N[5,5,6]C[5])(C[6]C[6]H)(H){1|Ga<6>,1|C<3>,1|N<3>,3|H<1>}	H(C[6]C[6]2)	119.8400	0.000	1	120.3238	0.244	15	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)2(H)	C[6](C[5,6]N[5,5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[5,6]N[5,5,6]C[5])(C[6]C[6]H)(H){1|Ga<6>,1|C<3>,1|N<4>,3|H<1>}	H(C[6]C[6]2)	119.6920	0.000	1	120.3238	0.244	15	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)2(H)	C[6](C[5,6]N[5,5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)2(H){1|N<3>,2|C<3>}	C[6](C[5,6]N[5,5,6]C[5])(C[6]C[6]H)(H){1|C<3>,1|N<3>,1|S<3>,2|H<1>}	H(C[6]C[6]2)	120.0070	0.000	1	120.3238	0.244	15	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)2(H)	C[6](C[5,6]N[5,5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)2(H){1|N<3>,2|C<3>}	C[6](C[5,6]N[5,5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|P<3>,2|C<3>}	H(C[6]C[6]2)	120.6810	0.133	2	120.3238	0.244	15	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)2(H)	C[6](C[5,6]N[5,5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)2(H){1|N<3>,2|C<3>}	C[6](C[5,6]N[5,5,6]C[5])(C[6]C[6]H)(H){1|In<7>,1|C<3>,1|H<1>,1|O<1>,1|O<2>}	H(C[6]C[6]2)	120.5491	0.446	8	120.3238	0.244	15	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,6,6a]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[5,6]H)(H){3|C<3>}	C[6](C[5,6]C[5,6,6a]C[5])(C[6]C[6]H)(H){1|C<4>,1|O<1>,3|C<3>}	H(C[6]C[6]2)	118.1006	0.336	5	118.1006	0.113	5	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,6a]N[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[5,6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[5,6]C[5,6a]N[5,6])(C[6]C[6]H)(H){1|B<4>,4|C<3>}	H(C[6]C[6]2)	119.5920	0.000	1	119.5920	0.000	1	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,5]C[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[5,6]H)(H){1|Ir<6>,1|C<4>,3|C<3>}	C[6](C[5,6]C[5,5]C[5,6])(C[6]C[6]H)(H){1|N<3>,5|C<3>}	H(C[6]C[6]2)	119.0130	0.000	1	119.0130	0.000	1	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[5,6]H)(H){1|Pt<4>,1|C<4>,3|C<3>}	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	118.9910	0.064	2	118.7647	0.095	4	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[5,6]H)(H){1|Pt<4>,4|C<3>}	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	118.5385	0.274	2	118.7647	0.095	4	119.8040	3.191	473	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6]O)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,5,6]C[5,6])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]O)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[5,6]C[5,5,6]C[5,6])(C[6]C[6]H)(O){1|H<1>,2|C<3>,3|C<4>}	H(C[6]C[6]2)	119.4110	0.000	1	119.4110	0.000	1	119.2537	0.017	6	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6]O)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]O[5])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]O)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[5,6]C[5,6]O[5])(C[6]C[6]H)(O){1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.2222	0.120	5	119.2222	0.014	5	119.2537	0.017	6	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]C)(C[6]C[5a,6]H)(H)	C[6](C[5a,6]N[5a,5a,6]N[5a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]C)(C[6]C[5a,6]H)(H){1|C<3>,1|N<2>,1|N<3>}	C[6](C[5a,6]N[5a,5a,6]N[5a])(C[6]C[6]H)(H){1|C<4>,3|C<3>}	H(C[6]C[6]2)	117.3110	0.000	1	117.3110	0.000	1	119.3458	0.971	198	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(C[6]C[6,6a]H)(H)	C[6](C[5a,6]N[5a,6,6a]C[5a,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)(C[6]C[6,6a]H)(H){1|N<3>,2|C<3>}	C[6](C[5a,6]N[5a,6,6a]C[5a,6a])(C[6]C[6]H)(H){1|H<1>,4|C<3>}	H(C[6]C[6]2)	119.3120	0.000	1	119.3120	0.000	1	119.3458	0.971	198	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(C[6]C[6]C)(H)	C[6](C[5a,6]C[5a,6]N[5a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)(C[6]C[6]C)(H){1|C<3>,1|N<2>,1|O<1>}	C[6](C[5a,6]C[5a,6]N[5a])(C[6]C[6]H)(H){1|C<4>,3|C<3>}	H(C[6]C[6]2)	120.3490	0.000	1	120.3490	0.000	1	119.3458	0.971	198	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(C[6]C[6]C)(H)	C[6](C[5a,6]N[5a,6]N[5a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)(C[6]C[6]C)(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[5a,6]N[5a,6]N[5a])(C[6]C[6]H)(H){1|C<4>,3|C<3>}	H(C[6]C[6]2)	118.9710	0.000	1	118.9710	0.000	1	119.3458	0.971	198	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(C[6]C[6]F)(H)	C[6](C[5a,6]N[5a,6]C[5a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)(C[6]C[6]F)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[5a,6]N[5a,6]C[5a])(C[6]C[6]H)(H){1|F<1>,4|C<3>}	H(C[6]C[6]2)	123.7230	0.000	1	123.7230	0.000	1	119.3458	0.971	198	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H)	C[6](C[5a,6]C[5a,5a]N[5a,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[5a,6]C[5a,5a]N[5a,6])(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	119.8225	0.312	2	119.9800	0.248	8	119.3458	0.971	198	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H)	C[6](C[5a,6]C[5a,5a]N[5a,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[5a,6]C[5a,5a]N[5a,6])(C[6]C[6]H)(H){1|B<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.0325	0.561	6	119.9800	0.248	8	119.3458	0.971	198	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H)	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H){2|C<3>}	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H){1|C<2>,1|H<1>,1|S<2>,2|C<3>}	H(C[6]C[6]2)	115.5970	0.000	1	115.5970	0.000	1	119.3458	0.971	198	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H)	C[6](C[5a,6]C[5a,6]N[5a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H){1|C<3>,1|N<3>}	C[6](C[5a,6]C[5a,6]N[5a])(C[6]C[6]H)(H){1|C<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	118.9690	0.000	1	117.1565	6.570	2	119.3458	0.971	198	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H)	C[6](C[5a,6]C[5a,6]N[5a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H){1|C<3>,1|N<3>}	C[6](C[5a,6]C[5a,6]N[5a])(C[6]C[6]H)(H){1|Zn<5>,1|C<2>,1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	115.3440	0.000	1	117.1565	6.570	2	119.3458	0.971	198	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H)	C[6](C[5a,6]C[5a,6a]C[5a,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H){2|C<3>}	C[6](C[5a,6]C[5a,6a]C[5a,6])(C[6]C[6]H)(H){1|C<2>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.3480	0.000	1	119.3480	0.000	1	119.3458	0.971	198	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H)	C[6](C[5a,6]C[5a,6a]N[5a,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[5a,6]C[5a,6a]N[5a,6])(C[6]C[6]H)(H){1|B<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.9735	1.176	2	120.6633	0.980	3	119.3458	0.971	198	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H)	C[6](C[5a,6]C[5a,6a]N[5a,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[5a,6]C[5a,6a]N[5a,6])(C[6]C[6]H)(H){1|H<1>,1|N<2>,3|C<3>}	H(C[6]C[6]2)	120.0430	0.000	1	120.6633	0.980	3	119.3458	0.971	198	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H)	C[6](C[5a,6]N[5a,5a]N[5a,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[5a,6]N[5a,5a]N[5a,6])(C[6]C[6]H)(H){1|B<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.5440	0.000	1	119.5440	0.000	1	119.3458	0.971	198	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H)	C[6](C[5a,6]N[5a,6]2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[5a,6]N[5a,6]2)(C[6]C[6]H)(H){1|B<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	115.9245	2.160	2	115.9245	4.667	2	119.3458	0.971	198	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H)	C[6](C[5a,6]N[5a,6]C[5a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[5a,6]N[5a,6]C[5a])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	119.9130	0.000	1	119.8097	0.165	12	119.3458	0.971	198	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H)	C[6](C[5a,6]N[5a,6]C[5a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[5a,6]N[5a,6]C[5a])(C[6]C[6]H)(H){1|H<1>,4|C<3>}	H(C[6]C[6]2)	119.8015	0.021	2	119.8097	0.165	12	119.3458	0.971	198	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H)	C[6](C[5a,6]N[5a,6]C[5a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[5a,6]N[5a,6]C[5a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.6929	0.373	8	119.8097	0.165	12	119.3458	0.971	198	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H)	C[6](C[5a,6]N[5a,6]C[5a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H){1|N<3>,2|C<3>}	C[6](C[5a,6]N[5a,6]C[5a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6570	0.000	1	119.8097	0.165	12	119.3458	0.971	198	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H)	C[6](C[5a,6]N[5a,6]N[5a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[5a,6]N[5a,6]N[5a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.2750	0.000	1	119.2601	0.408	11	119.3458	0.971	198	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H)	C[6](C[5a,6]N[5a,6]N[5a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[5a,6]N[5a,6]N[5a])(C[6]C[6]H)(H){1|H<1>,1|S<2>,2|C<3>}	H(C[6]C[6]2)	119.5110	0.000	1	119.2601	0.408	11	119.3458	0.971	198	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H)	C[6](C[5a,6]N[5a,6]N[5a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[5a,6]N[5a,6]N[5a])(C[6]C[6]H)(H){1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.6520	0.153	2	119.2601	0.408	11	119.3458	0.971	198	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H)	C[6](C[5a,6]N[5a,6]N[5a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[5a,6]N[5a,6]N[5a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	118.5937	0.964	3	119.2601	0.408	11	119.3458	0.971	198	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H)	C[6](C[5a,6]N[5a,6]N[5a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[5a,6]N[5a,6]N[5a])(C[6]C[6]H)(H){2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.4975	0.300	4	119.2601	0.408	11	119.3458	0.971	198	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H)	C[6](C[5a,6]N[5a,6a]N[5a,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[5a,6]N[5a,6a]N[5a,6])(C[6]C[6]H)(H){1|B<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.3667	0.199	4	119.3667	0.040	4	119.3458	0.971	198	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(C[6]C[6]O)(H)	C[6](C[5a,6]C[5a,6]N[5a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)(C[6]C[6]O)(H){1|N<3>,2|C<3>}	C[6](C[5a,6]C[5a,6]N[5a])(C[6]C[6]H)(H){1|C<4>,1|O<1>,3|C<3>}	H(C[6]C[6]2)	118.9315	0.145	2	118.9315	0.021	2	119.3458	0.971	198	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H)	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H){1|B<4>,2|C<3>}	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H){1|C<3>,2|H<1>,2|N<3>}	H(C[6]C[6]2)	119.7490	0.000	1	119.6691	0.284	110	119.3458	0.971	198	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H)	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H){1|B<5>,2|C<3>}	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H){1|C<3>,2|H<1>,2|N<3>}	H(C[6]C[6]2)	119.5730	0.000	1	119.6691	0.284	110	119.3458	0.971	198	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H)	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H){1|Cu<4>,2|C<3>}	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H){1|C<3>,2|H<1>,2|N<3>}	H(C[6]C[6]2)	119.6397	0.202	6	119.6691	0.284	110	119.3458	0.971	198	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H)	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H){1|Cu<5>,2|C<3>}	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H){1|C<3>,2|H<1>,2|N<3>}	H(C[6]C[6]2)	119.8750	0.000	1	119.6691	0.284	110	119.3458	0.971	198	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H)	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>,2|N<3>}	H(C[6]C[6]2)	119.4180	0.000	1	119.6691	0.284	110	119.3458	0.971	198	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H)	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H){1|C<3>,2|H<1>,2|N<3>}	H(C[6]C[6]2)	118.9468	2.439	4	119.6691	0.284	110	119.3458	0.971	198	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H)	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H){1|Ir<6>,2|C<3>}	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H){1|C<3>,2|H<1>,2|N<3>}	H(C[6]C[6]2)	119.5105	0.097	2	119.6691	0.284	110	119.3458	0.971	198	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H)	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H){1|Ir<7>,2|C<3>}	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H){1|C<3>,2|H<1>,2|N<3>}	H(C[6]C[6]2)	119.8950	0.023	2	119.6691	0.284	110	119.3458	0.971	198	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H)	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H){1|Li<4>,2|C<3>}	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H){1|C<3>,1|N<3>,1|N<4>,2|H<1>}	H(C[6]C[6]2)	120.0740	0.000	1	119.6691	0.284	110	119.3458	0.971	198	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H)	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H){1|Li<4>,2|C<3>}	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H){1|C<3>,2|H<1>,2|N<3>}	H(C[6]C[6]2)	119.9011	0.088	7	119.6691	0.284	110	119.3458	0.971	198	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H)	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H){1|Pd<4>,2|C<3>}	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H){1|C<3>,2|H<1>,2|N<3>}	H(C[6]C[6]2)	119.6249	0.412	14	119.6691	0.284	110	119.3458	0.971	198	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H)	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H){1|Pt<4>,2|C<3>}	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H){1|C<3>,2|H<1>,2|N<3>}	H(C[6]C[6]2)	119.8523	0.349	22	119.6691	0.284	110	119.3458	0.971	198	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H)	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H){1|Pt<5>,2|C<3>}	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H){1|C<3>,2|H<1>,2|N<3>}	H(C[6]C[6]2)	119.5445	0.069	2	119.6691	0.284	110	119.3458	0.971	198	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H)	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H){1|Pt<6>,2|C<3>}	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H){1|C<3>,2|H<1>,2|N<3>}	H(C[6]C[6]2)	119.9095	0.125	2	119.6691	0.284	110	119.3458	0.971	198	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H)	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H){1|Rh<4>,2|C<3>}	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H){1|C<3>,2|H<1>,2|N<3>}	H(C[6]C[6]2)	118.9860	0.681	3	119.6691	0.284	110	119.3458	0.971	198	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H)	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H){1|Rh<5>,2|C<3>}	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H){1|C<3>,2|H<1>,2|N<3>}	H(C[6]C[6]2)	119.9125	0.144	2	119.6691	0.284	110	119.3458	0.971	198	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H)	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H){1|Rh<5>,2|C<3>}	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	119.9790	0.124	3	119.6691	0.284	110	119.3458	0.971	198	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H)	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H){1|Rh<7>,2|C<3>}	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H){1|C<3>,2|H<1>,2|N<3>}	H(C[6]C[6]2)	119.7716	0.136	10	119.6691	0.284	110	119.3458	0.971	198	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H)	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H){1|Rh<8>,2|C<3>}	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H){1|C<3>,2|H<1>,2|N<3>}	H(C[6]C[6]2)	119.5258	0.181	4	119.6691	0.284	110	119.3458	0.971	198	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H)	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H){1|Ru<7>,2|C<3>}	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H){1|C<3>,2|H<1>,2|N<3>}	H(C[6]C[6]2)	119.5461	0.192	15	119.6691	0.284	110	119.3458	0.971	198	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H)	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H){1|Ru<8>,2|C<3>}	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H){1|C<3>,2|H<1>,2|N<3>}	H(C[6]C[6]2)	119.4890	0.231	4	119.6691	0.284	110	119.3458	0.971	198	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H)	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H){1|Ru<9>,2|C<3>}	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H){1|C<3>,2|H<1>,2|N<3>}	H(C[6]C[6]2)	119.6920	0.049	3	119.6691	0.284	110	119.3458	0.971	198	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H)	C[6](C[5a,6]C[5a,6]N[5a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[5a,6]C[5a,6]N[5a])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	119.2280	0.000	1	119.2280	0.000	1	119.3458	0.971	198	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H)	C[6](C[5a,6]C[5a,6]O[5a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|O<2>}	C[6](C[5a,6]C[5a,6]O[5a])(C[6]C[6]H)(H){1|B<4>,1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	119.3450	0.000	1	119.3450	0.000	1	119.3458	0.971	198	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(C[6]Se[6]H)(H)	C[6](C[5a,6]C[5a,6a]C[5a,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)(C[6]Se[6]H)(H){2|C<3>}	C[6](C[5a,6]C[5a,6a]C[5a,6])(C[6]C[6]H)(H){1|Se<2>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	117.1770	0.000	1	117.1770	0.000	1	119.3458	0.971	198	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)2(H)	C[6](C[5a,6]N[5a,5a,6]C[5a,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)2(H){1|C<3>,1|N<2>,1|N<3>}	C[6](C[5a,6]N[5a,5a,6]C[5a,6a])(C[6]C[6]H)(H){1|H<1>,4|C<3>}	H(C[6]C[6]2)	118.3470	0.000	1	118.3305	0.031	13	119.3458	0.971	198	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)2(H)	C[6](C[5a,6]N[5a,5a,6]C[5a,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)2(H){1|N<3>,2|C<3>}	C[6](C[5a,6]N[5a,5a,6]C[5a,6a])(C[6]C[6]H)(H){1|H<1>,4|C<3>}	H(C[6]C[6]2)	118.3292	0.185	12	118.3305	0.031	13	119.3458	0.971	198	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)2(H)	C[6](C[5a,6]N[5a,5a,6]C[5a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)2(H){1|C<3>,1|N<2>,1|N<3>}	C[6](C[5a,6]N[5a,5a,6]C[5a])(C[6]C[6]H)(H){1|H<1>,4|C<3>}	H(C[6]C[6]2)	117.7960	0.000	1	118.3127	0.220	18	119.3458	0.971	198	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)2(H)	C[6](C[5a,6]N[5a,5a,6]C[5a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)2(H){1|N<3>,2|C<3>}	C[6](C[5a,6]N[5a,5a,6]C[5a])(C[6]C[6]H)(H){1|B<3>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	118.3650	0.000	1	118.3127	0.220	18	119.3458	0.971	198	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)2(H)	C[6](C[5a,6]N[5a,5a,6]C[5a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)2(H){1|N<3>,2|C<3>}	C[6](C[5a,6]N[5a,5a,6]C[5a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,3|C<3>}	H(C[6]C[6]2)	118.3040	0.000	1	118.3127	0.220	18	119.3458	0.971	198	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)2(H)	C[6](C[5a,6]N[5a,5a,6]C[5a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)2(H){1|N<3>,2|C<3>}	C[6](C[5a,6]N[5a,5a,6]C[5a])(C[6]C[6]H)(H){1|H<1>,4|C<3>}	H(C[6]C[6]2)	118.2891	0.245	11	118.3127	0.220	18	119.3458	0.971	198	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)2(H)	C[6](C[5a,6]N[5a,5a,6]C[5a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)2(H){1|N<3>,2|C<3>}	C[6](C[5a,6]N[5a,5a,6]C[5a])(C[6]C[6]H)(H){1|N<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	118.1180	0.000	1	118.3127	0.220	18	119.3458	0.971	198	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)2(H)	C[6](C[5a,6]N[5a,5a,6]C[5a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)2(H){1|N<3>,2|C<3>}	C[6](C[5a,6]N[5a,5a,6]C[5a])(C[6]C[6]H)(H){1|Se<3>,1|C<3>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.8930	0.000	1	118.3127	0.220	18	119.3458	0.971	198	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)2(H)	C[6](C[5a,6]N[5a,5a,6]C[5a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)2(H){1|N<3>,2|C<3>}	C[6](C[5a,6]N[5a,5a,6]C[5a])(C[6]C[6]H)(H){2|H<1>,3|C<3>}	H(C[6]C[6]2)	117.9865	0.337	2	118.3127	0.220	18	119.3458	0.971	198	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)2(H)	C[6](C[5a,6]N[5a,5a,6]N[5a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)2(H){1|C<3>,1|N<2>,1|N<3>}	C[6](C[5a,6]N[5a,5a,6]N[5a])(C[6]C[6]H)(H){1|H<1>,3|C<3>}	H(C[6]C[6]2)	118.0665	0.370	2	118.0665	0.137	2	119.3458	0.971	198	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5a,6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6]C[6a])(C[6]C[5a,6]O)(H)	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C[6a])(C[6]C[5a,6]O)(H){6|C<3>}	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(O){1|C<3>,1|N<2>,1|N<3>,2|C<4>}	H(C[6]C[6]2)	117.5060	0.000	1	117.5060	0.000	1	118.1654	0.200	9	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5a,6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5a,6]O)(C[6]C[6]2)(H)	C[6](C[5a,6]C[5a,6]N[5a])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]O)(C[6]C[6]2)(H){1|N<3>,1|O<1>,3|C<3>}	C[6](C[5a,6]C[5a,6]N[5a])(C[6]C[6]H)(O){1|C<4>,1|N<2>,3|C<3>}	H(C[6]C[6]2)	118.0590	0.181	2	118.0590	0.033	2	118.1654	0.200	9	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5a,6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5a,6]O)(C[6]C[6]H)(H)	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]O)(C[6]C[6]H)(H){2|C<3>,2|O<2>}	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(O){1|C<3>,1|C<4>,1|H<1>,1|N<2>,1|O<2>}	H(C[6]C[6]2)	118.1990	0.072	2	118.1990	0.005	2	118.1654	0.200	9	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5a,6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5a,6]O)(C[6]C[6]H)(H)	C[6](C[5a,6]C[5a,6]N[5a])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]O)(C[6]C[6]H)(H){1|C<3>,1|N<3>,1|O<1>}	C[6](C[5a,6]C[5a,6]N[5a])(C[6]C[6]H)(O){1|H<1>,1|S<4>,3|C<3>}	H(C[6]C[6]2)	118.5800	0.000	1	118.5800	0.000	1	118.1654	0.200	9	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5a,6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5a,6]O)(C[6]C[6]H)(H)	C[6](C[5a,6]C[5a,6a]C[5a,6])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]O)(C[6]C[6]H)(H){1|O<1>,2|C<3>}	C[6](C[5a,6]C[5a,6a]C[5a,6])(C[6]C[6]H)(O){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	118.8530	0.000	1	118.8530	0.000	1	118.1654	0.200	9	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5a,6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5a,6]O)(C[6]C[6]O)(H)	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]O)(C[6]C[6]O)(H){2|C<3>,2|O<2>}	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(O){1|C<3>,1|C<4>,1|N<2>,2|O<2>}	H(C[6]C[6]2)	118.4700	0.000	1	118.4700	0.000	1	118.1654	0.200	9	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5a,6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[5a,6]O)(H)	C[6](C[5a,6]C[5a,6]N[5a])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[5a,6]O)(H){1|N<3>,1|O<1>,3|C<3>}	C[6](C[5a,6]C[5a,6]N[5a])(C[6]C[6]H)(O){1|C<4>,1|N<2>,3|C<3>}	H(C[6]C[6]2)	117.5640	0.000	1	117.5640	0.000	1	118.1654	0.200	9	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6,6]Br)(C[6]C[6]Br)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(Br)	H(C[6]C[6]2)	C[6](C[6]C[6,6]Br)(C[6]C[6]Br)(H){1|Dy<13>,1|C<3>,1|C<4>,1|O<2>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(Br){1|Dy<13>,1|Br<1>,1|C<3>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9893	0.215	3	119.9893	0.046	3	119.9893	0.046	3	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6,6]Cl)(C[6]C[6]H)(H)	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6,6]Cl)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(Cl){1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.5430	0.000	1	120.5430	0.000	1	120.5430	0.000	1	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[3x6]O)(C[6]C[6,6]H)(H)	C[6](C[6,6]C[4x6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[3x6]O)(C[6]C[6,6]H)(H){1|C<3>,1|C<4>,1|N<2>}	C[6](C[6,6]C[4x6]N[6])(C[6]C[6]H)(H){1|C<4>,1|O<1>,2|C<3>}	H(C[6]C[6]2)	118.6850	0.000	1	118.6850	0.000	1	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6,6]H)(H)	C[6](C[6,6]C[5,6,6]C[6,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6,6]H)(H){1|C<3>,1|H<1>,2|C<4>}	C[6](C[6,6]C[5,6,6]C[6,6])(C[6]C[6]H)(H){1|H<1>,6|C<4>}	H(C[6]C[6]2)	119.2280	0.000	1	119.0215	0.085	2	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6,6]H)(H)	C[6](C[6,6]C[5,6,6]C[6,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6,6]H)(H){1|C<3>,1|O<2>,2|C<4>}	C[6](C[6,6]C[5,6,6]C[6,6])(C[6]C[6]H)(H){1|H<1>,6|C<4>}	H(C[6]C[6]2)	118.8150	0.000	1	119.0215	0.085	2	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6,6]H)(H)	C[6](C[6,6]C[5,6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6,6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|O<2>}	C[6](C[6,6]C[5,6,6]C[6])(C[6]C[6]H)(H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	117.1580	0.000	1	118.3847	0.408	6	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6,6]H)(H)	C[6](C[6,6]C[5,6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6,6]H)(H){1|Ca<12>,1|C<3>,2|C<4>}	C[6](C[6,6]C[5,6,6]C[6])(C[6]C[6]H)(H){1|Ca<12>,1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.5825	0.252	4	118.3847	0.408	6	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6,6]H)(H)	C[6](C[6,6]C[5,6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6,6]H)(H){1|H<1>,1|N<3>,2|C<4>}	C[6](C[6,6]C[5,6,6]C[6])(C[6]C[6]H)(H){1|C<3>,2|C<4>,4|H<1>}	H(C[6]C[6]2)	118.8200	0.000	1	118.3847	0.408	6	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6,6]H)(H)	C[6](C[6,6]N[5,6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6,6]H)(H){1|N<3>,2|C<4>}	C[6](C[6,6]N[5,6,6]C[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,4|C<3>}	H(C[6]C[6]2)	119.4890	0.000	1	119.4890	0.000	1	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]O)(C[6]C[6,6]H)(H)	C[6](C[6,6]C[5,6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]O)(C[6]C[6,6]H)(H){1|C<3>,1|C<4>,2|O<2>}	C[6](C[6,6]C[5,6,6]C[6])(C[6]C[6]H)(H){1|O<1>,2|H<1>,3|C<4>}	H(C[6]C[6]2)	119.1090	0.000	1	119.1090	0.000	1	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6,6]H)(H){1|Fe<10>,1|Rh<4>,2|C<3>,2|C<4>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	119.4160	0.387	2	120.1059	0.267	7	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6,6]H)(H){1|Ru<5>,1|C<4>,3|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	120.3910	0.000	1	120.1059	0.267	7	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6,6]H)(H){1|Ru<5>,1|N<3>,1|S<2>,2|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	120.3517	0.236	3	120.1059	0.267	7	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6,6]H)(H){1|Ru<5>,1|S<3>,3|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	120.4630	0.000	1	120.1059	0.267	7	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6,6]H)(H){1|Pd<4>,1|N<3>,3|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	120.0340	0.000	1	120.0071	0.060	7	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6,6]H)(H){1|Ru<5>,1|N<3>,3|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	120.0595	0.285	4	120.0071	0.060	7	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6,6]H)(H){1|Ru<5>,1|S<2>,3|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	119.6900	0.000	1	120.0071	0.060	7	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6,6]H)(H){1|Ru<5>,4|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	120.0880	0.000	1	120.0071	0.060	7	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6,6]O)(H)	C[6](C[6,6]C[3x6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6,6]O)(H){1|C<3>,3|C<4>}	C[6](C[6,6]C[3x6]C[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>,3|C<4>}	H(C[6]C[6]2)	118.9375	0.400	2	118.9375	0.160	2	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]C)(H)	C[6](C[6,6]C[6,6]N[6,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6,6]C[6,6]N[6,6])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	119.7050	0.099	2	119.7050	0.010	2	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]C)(H)	C[6](C[6,6]C[6,6]O[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]C)(H){1|C<3>,1|O<1>,1|O<2>}	C[6](C[6,6]C[6,6]O[6])(C[6]C[6]H)(H){1|C<4>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.2520	0.000	1	119.2520	0.000	1	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]C)(H)	C[6](C[6,6]C[6,6a]N[6,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6,6]C[6,6a]N[6,6])(C[6]C[6]H)(H){1|B<4>,1|C<4>,3|C<3>}	H(C[6]C[6]2)	119.6520	0.000	1	119.6520	0.000	1	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<1>}	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,2|C<3>,2|O<2>}	H(C[6]C[6]2)	118.7485	1.559	2	119.0683	1.522	3	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<1>}	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,4|C<3>}	H(C[6]C[6]2)	119.7080	0.000	1	119.0683	1.522	3	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6,6]C[5a,6]N[6,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6,6]C[5a,6]N[6,6])(C[6]C[6]H)(H){1|B<4>,1|H<1>,1|N<2>,2|C<3>}	H(C[6]C[6]2)	120.1830	0.000	1	120.2350	0.005	2	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6,6]C[5a,6]N[6,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|N<3>,2|C<3>}	C[6](C[6,6]C[5a,6]N[6,6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.2870	0.000	1	120.2350	0.005	2	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<1>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<4>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	120.0590	0.000	1	118.9589	1.986	22	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<4>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|Rh<7>,1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	120.2120	0.000	1	118.9589	1.986	22	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<4>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|Zr<14>,1|C<5>,1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1940	0.000	1	118.9589	1.986	22	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Li<4>,1|Li<5>,1|C<3>,1|C<4>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<3>,3|C<4>}	H(C[6]C[6]2)	120.2030	0.000	1	118.9589	1.986	22	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Li<4>,1|Li<5>,2|C<4>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|Li<5>,1|C<3>,1|H<1>,1|O<3>,3|C<4>}	H(C[6]C[6]2)	119.8730	0.000	1	118.9589	1.986	22	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|O<1>,2|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	122.7740	0.000	1	118.9589	1.986	22	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Os<8>,1|C<3>,1|C<4>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|Os<8>,1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	118.2985	0.593	2	118.9589	1.986	22	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Ti<12>,1|C<3>,1|C<4>,1|O<2>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|Ti<12>,1|C<3>,1|C<4>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	118.1498	0.671	5	118.9589	1.986	22	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Ti<8>,1|C<3>,1|C<4>,1|O<2>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|Ti<8>,1|C<3>,1|C<4>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	118.0760	0.000	1	118.9589	1.986	22	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Ti<9>,1|O<2>,2|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.1985	0.230	2	118.9589	1.986	22	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){2|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	115.7520	0.000	1	118.9589	1.986	22	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){2|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<2>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	117.6820	0.000	1	118.9589	1.986	22	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){2|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<2>,1|N<3>,1|O<2>,2|H<1>}	H(C[6]C[6]2)	118.8270	0.000	1	118.9589	1.986	22	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){2|Y<14>,1|O<3>,2|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<5>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.7930	0.000	1	118.9589	1.986	22	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){2|Yb<14>,1|O<3>,2|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<5>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.4960	0.000	1	118.9589	1.986	22	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){3|C<4>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|Zr<11>,1|C<3>,1|C<4>,1|N<3>,3|H<1>}	H(C[6]C[6]2)	118.4120	0.000	1	118.9589	1.986	22	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6,6]C[6,6]N[6,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6,6]C[6,6]N[6,6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.1059	0.819	20	120.0097	0.595	26	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6,6]C[6,6]N[6,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6,6]C[6,6]N[6,6])(C[6]C[6]H)(H){1|Ge<3>,1|C<3>,1|H<1>,1|N<3>,2|C<4>}	H(C[6]C[6]2)	120.1430	0.218	2	120.0097	0.595	26	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6,6]C[6,6]N[6,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6,6]C[6,6]N[6,6])(C[6]C[6]H)(H){1|Rh<9>,1|H<1>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	119.7950	0.000	1	120.0097	0.595	26	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6,6]C[6,6]N[6,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<4>,1|N<3>,1|O<2>}	C[6](C[6,6]C[6,6]N[6,6])(C[6]C[6]H)(H){1|C<3>,2|H<1>,3|C<4>}	H(C[6]C[6]2)	119.5730	0.445	2	120.0097	0.595	26	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6,6]C[6,6]N[6,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<4>,1|N<3>,1|S<1>}	C[6](C[6,6]C[6,6]N[6,6])(C[6]C[6]H)(H){1|C<3>,2|H<1>,3|C<4>}	H(C[6]C[6]2)	118.9060	0.000	1	120.0097	0.595	26	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6,6]C[6,6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|N<3>}	C[6](C[6,6]C[6,6]N[6])(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|N<2>,2|H<1>}	H(C[6]C[6]2)	119.1240	0.000	1	119.1240	0.000	1	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6,6]C[6,6a]N[6,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6,6]C[6,6a]N[6,6])(C[6]C[6]H)(H){1|B<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.2695	0.231	2	120.2474	0.088	25	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6,6]C[6,6a]N[6,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6,6]C[6,6a]N[6,6])(C[6]C[6]H)(H){1|B<4>,1|H<1>,1|N<2>,2|C<3>}	H(C[6]C[6]2)	120.4275	0.250	2	120.2474	0.088	25	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6,6]C[6,6a]N[6,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6,6]C[6,6a]N[6,6])(C[6]C[6]H)(H){1|B<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.2352	0.294	13	120.2474	0.088	25	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6,6]C[6,6a]N[6,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6,6]C[6,6a]N[6,6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.3120	0.158	3	120.2474	0.088	25	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6,6]C[6,6a]N[6,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6,6]C[6,6a]N[6,6])(C[6]C[6]H)(H){1|H<1>,4|C<3>}	H(C[6]C[6]2)	120.5905	0.121	2	120.2474	0.088	25	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6,6]C[6,6a]N[6,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|N<3>,2|C<3>}	C[6](C[6,6]C[6,6a]N[6,6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.8720	0.273	3	120.2474	0.088	25	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6,6]N[5a,6]N[6,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[6,6]N[5a,6]N[6,6])(C[6]C[6]H)(H){1|B<4>,1|H<1>,1|N<2>,2|C<3>}	H(C[6]C[6]2)	120.1030	0.000	1	120.2095	0.023	2	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6,6]N[5a,6]N[6,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[6,6]N[5a,6]N[6,6])(C[6]C[6]H)(H){1|H<1>,4|C<3>}	H(C[6]C[6]2)	120.3160	0.000	1	120.2095	0.023	2	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H){1|B<4>,1|C<2>,1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.2040	0.098	2	120.2531	0.089	72	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H){1|B<4>,1|C<2>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.0628	0.227	10	120.2531	0.089	72	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|C<4>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	119.3380	0.000	1	120.2531	0.089	72	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>,1|N<3>,1|O<1>}	H(C[6]C[6]2)	120.2910	0.000	1	120.2531	0.089	72	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H){1|B<4>,1|H<1>,1|N<2>,2|C<3>}	H(C[6]C[6]2)	120.0635	0.029	2	120.2531	0.089	72	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H){1|B<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.0753	0.208	14	120.2531	0.089	72	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H){1|B<4>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2820	0.128	16	120.2531	0.089	72	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H){1|C<4>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4780	0.000	1	120.2531	0.089	72	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H){1|Ge<4>,1|Si<4>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.0670	0.027	4	120.2531	0.089	72	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H){1|N<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.7070	0.000	1	120.2531	0.089	72	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H){1|Nb<6>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4750	0.000	1	120.2531	0.089	72	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|C<4>,3|H<1>}	H(C[6]C[6]2)	120.6624	0.147	9	120.2531	0.089	72	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H){1|B<4>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	119.7670	0.000	1	120.2531	0.089	72	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>,3|H<1>}	H(C[6]C[6]2)	120.2670	0.116	2	120.2531	0.089	72	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<3>,3|H<1>}	H(C[6]C[6]2)	120.7740	0.000	1	120.2531	0.089	72	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H){1|C<4>,1|O<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.9200	0.000	1	120.2531	0.089	72	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H){1|Ga<4>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	120.3990	0.000	1	120.2531	0.089	72	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H){1|Ga<5>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	120.4195	0.223	2	120.2531	0.089	72	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H){1|In<6>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	120.3725	0.166	2	120.2531	0.089	72	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Cl<1>,1|N<2>,1|N<3>}	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(H){1|B<4>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.0790	0.000	1	120.0351	0.215	26	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(H){1|B<4>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.1095	0.217	12	120.0351	0.215	26	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	120.1120	0.000	1	120.0351	0.215	26	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.5010	0.281	2	120.0351	0.215	26	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(H){1|Ge<3>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.1670	0.174	3	120.0351	0.215	26	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|N<4>}	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,4|C<4>}	H(C[6]C[6]2)	120.5300	0.000	1	120.0351	0.215	26	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(H){1|B<4>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1900	0.397	2	120.0351	0.215	26	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.9845	0.948	2	120.0351	0.215	26	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(H){1|In<6>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5130	0.008	2	120.0351	0.215	26	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6,6]N[6,6]O[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<2>}	C[6](C[6,6]N[6,6]O[6])(C[6]C[6]H)(H){1|B<4>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.7780	0.000	1	119.7780	0.000	1	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6,6]N[6,6]S[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|S<2>}	C[6](C[6,6]N[6,6]S[6])(C[6]C[6]H)(H){1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.9020	0.000	1	120.9020	0.000	1	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	C[6](C[6,6]C[6,6]2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,2|C<4>}	C[6](C[6,6]C[6,6]2)(C[6]C[6]H)(H){1|H<1>,1|O<1>,4|C<4>}	H(C[6]C[6]2)	119.2010	0.301	2	119.2010	0.091	2	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,2|C<4>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,1|O<1>,4|C<4>}	H(C[6]C[6]2)	119.5400	0.000	1	119.3260	0.092	2	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|H<1>,2|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|O<1>,1|P<4>,3|C<3>}	H(C[6]C[6]2)	119.1120	0.000	1	119.3260	0.092	2	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	C[6](C[6,6]C[6,6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6,6]C[6,6]N[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<1>,1|O<2>}	H(C[6]C[6]2)	119.0240	0.000	1	119.5898	0.194	5	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	C[6](C[6,6]C[6,6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6,6]C[6,6]N[6])(C[6]C[6]H)(H){1|C<4>,1|O<1>,2|C<3>}	H(C[6]C[6]2)	119.9825	0.337	2	119.5898	0.194	5	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	C[6](C[6,6]C[6,6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6,6]C[6,6]N[6])(C[6]C[6]H)(H){1|C<4>,2|C<3>,2|O<1>}	H(C[6]C[6]2)	119.4800	0.096	2	119.5898	0.194	5	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]S)(H)	C[6](C[6,6]C[6,6a]C[6,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]S)(H){1|C<3>,1|C<4>,2|H<1>}	C[6](C[6,6]C[6,6a]C[6,6])(C[6]C[6]H)(H){1|H<1>,1|S<4>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	119.7230	0.337	2	119.7230	0.113	2	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[5,6]O)(H)	C[6](C[6,6]C[5,6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[5,6]O)(H){1|C<4>,2|C<3>}	C[6](C[6,6]C[5,6,6]C[6])(C[6]C[6]H)(H){1|N<3>,1|O<1>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.9280	0.000	1	118.9280	0.000	1	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	C[6](C[6,6]C[3,6]C[6,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|Cu<4>,1|C<3>,1|C<4>}	C[6](C[6,6]C[3,6]C[6,6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>,1|O<2>,2|C<4>}	H(C[6]C[6]2)	120.1550	0.272	2	120.1550	0.074	2	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|Al<4>,1|C<3>,1|C<4>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|N<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	120.1700	0.000	1	120.2132	0.855	73	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|Al<4>,1|C<3>,1|C<4>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|N<3>,2|H<1>,3|C<4>}	H(C[6]C[6]2)	119.9630	0.000	1	120.2132	0.855	73	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|Al<5>,1|C<3>,1|C<4>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|N<3>,2|H<1>,3|C<4>}	H(C[6]C[6]2)	120.1580	0.000	1	120.2132	0.855	73	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|B<5>,2|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	119.6840	0.000	1	120.2132	0.855	73	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|Co<4>,2|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	119.9880	0.000	1	120.2132	0.855	73	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|Co<5>,1|C<3>,1|C<4>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.7640	0.000	1	120.2132	0.855	73	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|Co<5>,2|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	120.0717	0.292	3	120.2132	0.855	73	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|Co<6>,2|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	119.9395	0.059	2	120.2132	0.855	73	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|Co<6>,2|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	120.0010	0.000	1	120.2132	0.855	73	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|Cu<3>,2|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.2730	0.081	3	120.2132	0.855	73	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|Cu<4>,2|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.6095	0.243	2	120.2132	0.855	73	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|Cu<5>,1|C<2>,1|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<4>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	121.0100	0.000	1	120.2132	0.855	73	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|Cu<5>,2|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	122.0730	0.000	1	120.2132	0.855	73	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|Cu<5>,2|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.6726	0.100	5	120.2132	0.855	73	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|Dy<13>,1|C<3>,1|C<4>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|Dy<13>,1|Br<1>,1|C<3>,1|N<3>,2|C<4>}	H(C[6]C[6]2)	119.4157	0.347	3	120.2132	0.855	73	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|Fe<5>,1|C<3>,1|C<4>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6330	0.000	1	120.2132	0.855	73	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|Fe<5>,2|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.5410	0.246	2	120.2132	0.855	73	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|Fe<6>,2|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.0730	0.000	1	120.2132	0.855	73	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|C<5>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.5620	0.163	2	120.2132	0.855	73	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|Ni<3>,1|C<3>,1|C<4>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){2|C<3>,2|H<1>,2|N<3>}	H(C[6]C[6]2)	120.5090	0.000	1	120.2132	0.855	73	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|Ni<3>,2|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	119.7450	0.203	4	120.2132	0.855	73	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|Ni<4>,2|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	119.9075	0.288	12	120.2132	0.855	73	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|Ni<5>,1|C<3>,1|C<4>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|N<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	120.5365	0.176	2	120.2132	0.855	73	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|Ni<5>,2|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	119.7343	0.020	3	120.2132	0.855	73	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|Ni<6>,2|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	120.0890	0.000	1	120.2132	0.855	73	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|Pt<4>,2|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	126.9970	0.000	1	120.2132	0.855	73	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|Rh<5>,2|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	120.1205	0.047	2	120.2132	0.855	73	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|Rh<7>,2|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	119.7580	0.000	1	120.2132	0.855	73	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|Ru<6>,2|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.1420	0.115	4	120.2132	0.855	73	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|Ru<7>,1|C<3>,1|C<4>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|Ru<7>,1|H<1>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	120.2400	0.000	1	120.2132	0.855	73	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|Ti<12>,1|C<3>,1|C<4>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|Ti<12>,1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.2270	0.176	5	120.2132	0.855	73	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|Ti<8>,1|C<3>,1|C<4>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|Ti<8>,1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.2750	0.000	1	120.2132	0.855	73	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|Ti<9>,2|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>,2|C<4>}	H(C[6]C[6]2)	119.5715	0.023	2	120.2132	0.855	73	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	C[6](C[6,6]C[6,6]O[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|C<3>,1|C<4>,1|O<2>}	C[6](C[6,6]C[6,6]O[6])(C[6]C[6]H)(H){1|C<3>,1|N<3>,2|C<4>}	H(C[6]C[6]2)	119.2802	0.641	4	119.2802	0.411	4	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](C[6,6]C[5,5,6]C[6,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Co<7>,1|C<3>,1|C<4>}	C[6](C[6,6]C[5,5,6]C[6,6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,3|N<3>}	H(C[6]C[6]2)	120.3572	0.419	4	120.3572	0.176	4	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|O<2>,2|N<3>}	H(C[6]C[6]2)	120.5720	0.000	1	120.5720	0.000	1	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Al<4>,1|C<3>,1|C<4>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>,3|H<1>}	H(C[6]C[6]2)	120.5670	0.000	1	120.5505	1.289	119	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Al<4>,1|C<3>,1|C<4>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|N<3>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	120.8470	0.000	1	120.5505	1.289	119	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Al<5>,1|C<3>,1|C<4>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|N<3>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	120.6680	0.000	1	120.5505	1.289	119	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>,3|H<1>}	H(C[6]C[6]2)	120.9900	0.000	1	120.5505	1.289	119	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|N<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	120.6440	0.000	1	120.5505	1.289	119	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|O<1>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|N<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.8400	0.000	1	120.5505	1.289	119	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|O<1>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|N<3>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	120.0805	0.151	2	120.5505	1.289	119	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|C<3>,2|C<4>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|N<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	120.2237	0.230	4	120.5505	1.289	119	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Cd<6>,1|C<2>,1|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	122.2300	0.000	1	120.5505	1.289	119	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Co<6>,2|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>,2|C<3>}	H(C[6]C[6]2)	120.1500	0.069	3	120.5505	1.289	119	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Cu<3>,2|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,2|H<1>,2|N<3>}	H(C[6]C[6]2)	120.5510	0.000	1	120.5505	1.289	119	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Cu<4>,2|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,2|H<1>,2|N<3>}	H(C[6]C[6]2)	120.5370	0.000	1	120.5505	1.289	119	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Cu<5>,1|C<2>,1|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	123.6295	7.038	2	120.5505	1.289	119	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Cu<5>,2|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	122.1830	3.786	2	120.5505	1.289	119	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Cu<5>,2|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,2|H<1>,2|N<3>}	H(C[6]C[6]2)	121.3660	0.000	1	120.5505	1.289	119	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>,2|C<3>}	H(C[6]C[6]2)	120.3874	0.219	5	120.5505	1.289	119	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Hg<6>,2|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>,2|C<3>}	H(C[6]C[6]2)	120.5840	0.328	4	120.5505	1.289	119	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|C<4>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>,3|H<1>}	H(C[6]C[6]2)	120.2703	0.490	9	120.5505	1.289	119	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|C<4>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|N<3>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	120.8760	0.000	1	120.5505	1.289	119	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Ir<8>,2|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,2|H<1>,2|N<3>}	H(C[6]C[6]2)	121.5230	0.000	1	120.5505	1.289	119	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Ir<8>,2|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>,2|C<3>}	H(C[6]C[6]2)	120.1440	0.000	1	120.5505	1.289	119	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Mg<5>,1|C<3>,1|C<4>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>,3|H<1>}	H(C[6]C[6]2)	121.5600	0.000	1	120.5505	1.289	119	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Mg<5>,1|C<3>,1|C<4>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|N<3>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	120.4985	0.081	2	120.5505	1.289	119	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Mn<6>,2|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>,2|C<3>}	H(C[6]C[6]2)	120.4590	0.549	4	120.5505	1.289	119	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Mn<7>,2|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>,2|C<3>}	H(C[6]C[6]2)	120.6510	0.000	1	120.5505	1.289	119	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Ni<4>,2|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.6990	0.000	1	120.5505	1.289	119	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Ni<5>,1|C<3>,1|C<4>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>,3|H<1>}	H(C[6]C[6]2)	120.3814	0.274	5	120.5505	1.289	119	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|C<4>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>,3|H<1>}	H(C[6]C[6]2)	120.7182	0.291	4	120.5505	1.289	119	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Os<9>,2|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>,2|C<3>}	H(C[6]C[6]2)	119.9350	0.000	1	120.5505	1.289	119	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|C<4>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>,3|H<1>}	H(C[6]C[6]2)	120.5330	0.270	3	120.5505	1.289	119	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Pd<4>,2|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,2|H<1>,2|N<3>}	H(C[6]C[6]2)	120.8443	0.798	4	120.5505	1.289	119	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|C<4>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>,3|H<1>}	H(C[6]C[6]2)	119.8665	0.057	2	120.5505	1.289	119	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Pt<4>,2|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>,2|C<3>}	H(C[6]C[6]2)	119.9995	0.569	2	120.5505	1.289	119	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Re<5>,2|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,2|H<1>,2|N<3>}	H(C[6]C[6]2)	120.4940	0.000	1	120.5505	1.289	119	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Re<6>,2|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>,2|C<3>}	H(C[6]C[6]2)	121.4835	0.612	2	120.5505	1.289	119	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Rh<5>,2|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,2|H<1>,2|N<3>}	H(C[6]C[6]2)	120.3032	0.275	5	120.5505	1.289	119	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Rh<6>,2|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,2|H<1>,2|N<3>}	H(C[6]C[6]2)	120.0070	0.000	1	120.5505	1.289	119	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Rh<8>,2|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>,2|C<3>}	H(C[6]C[6]2)	120.3990	0.000	1	120.5505	1.289	119	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Ru<5>,2|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,2|H<1>,2|N<3>}	H(C[6]C[6]2)	120.4828	0.385	18	120.5505	1.289	119	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|C<4>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>,3|H<1>}	H(C[6]C[6]2)	119.5260	0.000	1	120.5505	1.289	119	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|C<4>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|N<3>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	120.3467	0.417	3	120.5505	1.289	119	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Ru<6>,2|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.6910	0.000	1	120.5505	1.289	119	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Ru<6>,2|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>,2|C<3>}	H(C[6]C[6]2)	119.8660	0.000	1	120.5505	1.289	119	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Ru<6>,2|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	116.5810	0.000	1	120.5505	1.289	119	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Ru<7>,1|C<3>,1|C<4>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|Ru<7>,1|C<3>,2|H<1>,2|N<3>}	H(C[6]C[6]2)	119.7890	0.000	1	120.5505	1.289	119	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Ru<8>,2|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,2|H<1>,2|N<3>}	H(C[6]C[6]2)	119.6390	0.000	1	120.5505	1.289	119	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Ru<9>,2|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>,2|C<3>}	H(C[6]C[6]2)	119.9340	0.000	1	120.5505	1.289	119	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Zn<6>,2|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>,2|C<3>}	H(C[6]C[6]2)	120.7845	0.494	6	120.5505	1.289	119	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Zn<6>,2|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	124.8730	0.000	1	120.5505	1.289	119	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](C[6,6]C[6,6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|N<3>}	C[6](C[6,6]C[6,6]N[6])(C[6]C[6]H)(H){1|Yb<12>,1|C<3>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	119.8075	0.414	2	119.9207	0.084	4	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](C[6,6]C[6,6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Pd<6>,1|C<3>,1|N<3>}	C[6](C[6,6]C[6,6]N[6])(C[6]C[6]H)(H){1|Yb<13>,1|C<3>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.0340	0.168	2	119.9207	0.084	4	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](C[6,6]C[6,6]O[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|O<2>}	C[6](C[6,6]C[6,6]O[6])(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8750	0.000	1	119.8750	0.000	1	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](C[6,6]C[6,6a]C[6,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Mn<6>,2|C<3>}	C[6](C[6,6]C[6,6a]C[6,6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.8670	0.000	1	119.8670	0.000	1	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]N)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]N)(H){1|Co<6>,2|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,3|N<3>}	H(C[6]C[6]2)	119.8670	0.014	2	120.5395	1.041	8	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]N)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]N)(H){1|Cu<3>,2|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<2>,2|N<3>}	H(C[6]C[6]2)	120.5180	0.000	1	120.5395	1.041	8	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]N)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]N)(H){1|Cu<3>,2|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,3|N<3>}	H(C[6]C[6]2)	120.1220	0.096	2	120.5395	1.041	8	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]N)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]N)(H){1|Cu<4>,2|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,3|N<3>}	H(C[6]C[6]2)	119.6780	0.000	1	120.5395	1.041	8	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]N)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]N)(H){1|Li<4>,1|C<3>,1|C<4>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|N<2>,1|N<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	122.0710	0.767	2	120.5395	1.041	8	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]O)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]O)(H){1|C<3>,2|C<4>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|N<3>,1|O<1>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.7700	0.000	1	120.1563	0.679	7	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]O)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]O)(H){1|Cu<4>,2|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>,2|N<3>}	H(C[6]C[6]2)	120.9345	0.443	2	120.1563	0.679	7	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]O)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]O)(H){1|Pt<4>,2|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>,2|N<3>}	H(C[6]C[6]2)	120.8320	0.000	1	120.1563	0.679	7	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]O)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]O)(H){2|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>,1|N<3>,1|O<1>}	H(C[6]C[6]2)	119.8743	0.154	3	120.1563	0.679	7	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)2(H)	C[6](C[6,6]C[6,6a]N[3x6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6,6]C[6,6a]N[3x6])(C[6]C[6]H)(H){1|B<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.7787	0.518	12	119.7632	0.249	13	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)2(H)	C[6](C[6,6]C[6,6a]N[3x6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6,6]C[6,6a]N[3x6])(C[6]C[6]H)(H){1|H<1>,1|P<3>,3|C<3>}	H(C[6]C[6]2)	119.5780	0.000	1	119.7632	0.249	13	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)2(H)	C[6](C[6,6]N[3x6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)2(H){1|N<3>,2|N<2>}	C[6](C[6,6]N[3x6]N[6])(C[6]C[6]H)(H){1|B<4>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.6000	0.117	6	119.6000	0.014	6	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6,6]H)(H){1|Cu<3>,1|N<3>,3|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	120.4060	0.000	1	120.2619	0.128	12	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6,6]H)(H){1|Cu<4>,1|N<3>,3|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	120.1150	0.000	1	120.2619	0.128	12	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6,6]H)(H){1|Pd<3>,1|N<3>,3|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	120.2180	0.130	2	120.2619	0.128	12	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6,6]H)(H){1|Pd<4>,1|N<3>,3|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	119.6970	0.000	1	120.2619	0.128	12	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6,6]H)(H){1|Re<5>,1|N<3>,3|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	120.0450	0.000	1	120.2619	0.128	12	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6,6]H)(H){1|Rh<5>,1|C<4>,3|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	120.3730	0.000	1	120.2619	0.128	12	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6,6]H)(H){1|Ru<5>,1|C<4>,1|N<3>,2|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,2|H<1>,2|N<3>}	H(C[6]C[6]2)	121.2050	0.000	1	120.2619	0.128	12	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6,6]H)(H){1|Ru<5>,1|N<3>,3|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	120.2165	0.146	4	120.2619	0.128	12	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6,6]H)(H){1|Ru<6>,2|C<3>,2|N<3>}	C[6](C[6,6]C[6,6]N[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.1860	0.336	3	120.1860	0.113	3	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6,6]H)(H)	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6,6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6,6]N[6,6]C[6])(C[6]C[6]H)(H){1|B<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.9080	0.000	1	119.9080	0.000	1	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6,6]H)(H){1|Ni<4>,1|C<4>,3|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.2343	0.448	3	119.5684	0.231	7	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6,6]H)(H){1|Pd<4>,1|C<4>,3|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9917	0.145	3	119.5684	0.231	7	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6,6]H)(H){1|Rh<5>,4|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){2|N<3>,3|C<3>}	H(C[6]C[6]2)	119.3010	0.000	1	119.5684	0.231	7	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6,6]H)(H){1|Ni<6>,1|N<3>,3|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,3|N<3>}	H(C[6]C[6]2)	120.6443	0.186	3	120.6443	0.034	3	120.1196	0.848	493	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]Br)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]Br)(H){1|C<3>,1|C<4>,1|O<1>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(O){1|Br<1>,1|C<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.6690	0.000	1	119.6690	0.000	1	119.0210	1.552	20	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]Br)(H)	C[6](C[6,6]C[6,6]O[6])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]Br)(H){1|C<3>,1|O<1>,1|O<2>}	C[6](C[6,6]C[6,6]O[6])(C[6]C[6]H)(O){1|Br<1>,1|C<3>,2|C<4>}	H(C[6]C[6]2)	120.0550	0.000	1	120.0550	0.000	1	119.0210	1.552	20	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]C)(H)	C[6](C[6,6]C[6,6]2)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]C)(H){1|C<3>,1|C<4>,1|O<1>}	C[6](C[6,6]C[6,6]2)(C[6]C[6]H)(O){1|H<1>,2|C<3>,3|C<4>}	H(C[6]C[6]2)	115.6760	0.000	1	115.6760	0.000	1	119.0210	1.552	20	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H)	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<1>}	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6]H)(O){1|H<1>,2|C<4>,3|C<3>}	H(C[6]C[6]2)	118.9890	0.000	2	118.4742	0.712	4	119.0210	1.552	20	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H)	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6]H)(O){1|C<3>,1|C<4>,1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	117.9595	1.037	2	118.4742	0.712	4	119.0210	1.552	20	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<1>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(O){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.5970	0.038	2	119.6287	0.067	7	119.0210	1.552	20	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(O){1|C<3>,1|H<1>,1|O<2>,2|C<4>}	H(C[6]C[6]2)	120.1460	0.000	1	119.6287	0.067	7	119.0210	1.552	20	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H){1|O<1>,2|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(O){1|C<4>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.4730	0.000	2	119.6287	0.067	7	119.0210	1.552	20	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H){1|O<2>,2|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(O){1|H<1>,1|O<1>,3|C<3>}	H(C[6]C[6]2)	119.3650	0.000	1	119.6287	0.067	7	119.0210	1.552	20	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H){2|C<3>,2|O<2>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(O){1|C<3>,1|H<1>,1|O<1>,2|C<4>}	H(C[6]C[6]2)	119.7500	0.000	1	119.6287	0.067	7	119.0210	1.552	20	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H)	C[6](C[6,6]C[6,6]N[6])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6,6]C[6,6]N[6])(C[6]C[6]H)(O){1|Pt<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	116.1410	0.000	1	116.1410	0.000	1	119.0210	1.552	20	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H)	C[6](C[6,6]C[6,6a]C[6,6])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6,6]C[6,6a]C[6,6])(C[6]C[6]H)(O){1|C<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.9280	0.000	1	119.9280	0.000	1	119.0210	1.552	20	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]O)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]O)(H){1|O<1>,2|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(O){1|N<3>,1|O<2>,3|C<3>}	H(C[6]C[6]2)	118.6900	0.000	1	118.6900	0.000	1	119.0210	1.552	20	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]O)(H)	C[6](C[6,6]C[6,6]O[6])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]O)(H){1|C<3>,1|O<1>,1|O<2>}	C[6](C[6,6]C[6,6]O[6])(C[6]C[6]H)(O){1|C<3>,1|O<2>,2|C<4>}	H(C[6]C[6]2)	119.6543	0.175	3	119.6543	0.031	3	119.0210	1.552	20	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6,6a]Br)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(Br)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]Br)(C[6]N[6]H)(H){1|Cu<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(Br){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6303	0.287	6	120.6303	0.082	6	120.6303	0.082	6	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6,6a]Cl)(C[6]C[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]Cl)(C[6]C[6]H)(H){1|O<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(Cl){1|N<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7810	0.000	1	119.7810	0.000	1	120.0281	0.184	13	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6,6a]Cl)(C[6]C[6a]N[6])(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]Cl)(C[6]C[6a]N[6])(H){1|Ir<8>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(Cl){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.3390	0.000	1	120.3390	0.000	1	120.0281	0.184	13	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6,6a]Cl)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]Cl)(C[6]N[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(Cl){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.5180	0.000	1	119.8824	0.288	5	120.0281	0.184	13	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6,6a]Cl)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]Cl)(C[6]N[6]C)(H){1|Re<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(Cl){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.7695	0.261	2	119.8824	0.288	5	120.0281	0.184	13	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6,6a]Cl)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]Cl)(C[6]N[6]C)(H){1|Re<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(Cl){1|N<3>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	119.6775	0.756	2	119.8824	0.288	5	120.0281	0.184	13	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6,6a]Cl)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]Cl)(C[6]N[6]H)(H){1|Ru<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(Cl){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1388	0.378	6	120.1388	0.143	6	120.0281	0.184	13	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,5,6]O)(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[5,6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,5,6]O)(C[6]C[6,6a]H)(H){1|C<4>,1|O<2>,2|C<3>}	C[6](C[6,6a]C[5,6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<1>,2|C<3>}	H(C[6]C[6]2)	118.4165	0.105	2	118.4165	0.011	2	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]C[5])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C[5])(C[6]C[6,6a]H)(H){1|N<3>,2|N<2>,3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.0090	0.000	1	119.0090	0.000	1	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]C[6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C[6])(C[6]C[6,6a]H)(H){1|N<3>,5|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	117.9550	0.000	1	117.9550	0.000	1	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6,6a]H)(H){1|O<1>,2|C<3>,2|S<2>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,3|C<3>}	H(C[6]C[6]2)	119.5610	0.000	1	119.5610	0.000	1	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H){1|Co<4>,1|N<3>,1|O<2>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	121.1045	0.008	2	120.6462	0.195	31	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H){1|Co<6>,1|H<1>,1|N<4>,1|O<2>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.6890	0.000	1	120.6462	0.195	31	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H){1|Cr<6>,1|N<3>,1|O<2>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.7530	0.000	1	120.6462	0.195	31	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H){1|Cr<6>,2|C<3>,2|N<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.8170	0.000	1	120.6462	0.195	31	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H){1|Cu<4>,1|N<2>,1|N<3>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	121.0493	0.442	3	120.6462	0.195	31	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H){1|Cu<4>,1|N<3>,1|O<2>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.7140	0.093	2	120.6462	0.195	31	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H){1|Cu<4>,2|C<3>,2|N<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.6500	0.000	1	120.6462	0.195	31	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H){1|Fe<10>,1|Pd<4>,2|C<3>,2|C<4>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.4170	0.000	1	120.6462	0.195	31	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H){1|Fe<6>,1|N<2>,1|N<3>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.5520	0.423	2	120.6462	0.195	31	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H){1|Fe<6>,2|C<3>,2|N<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.5280	0.000	1	120.6462	0.195	31	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H){1|H<1>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	119.4790	0.000	1	120.6462	0.195	31	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H){1|Ir<6>,2|C<3>,2|N<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.3130	0.392	2	120.6462	0.195	31	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H){1|Ir<8>,1|N<3>,1|O<2>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	121.1890	0.826	2	120.6462	0.195	31	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H){1|Mn<6>,1|N<3>,1|O<2>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.7980	0.000	1	120.6462	0.195	31	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H){1|Ni<6>,1|H<1>,1|N<4>,1|O<2>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.4870	0.000	1	120.6462	0.195	31	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H){1|Ni<6>,2|C<3>,2|N<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.7855	0.667	2	120.6462	0.195	31	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H){1|Pd<4>,1|C<4>,1|N<3>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.9720	0.000	1	120.6462	0.195	31	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H){1|Pd<4>,1|N<3>,1|O<2>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.7560	0.000	1	120.6462	0.195	31	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H){1|Zn<4>,1|N<3>,1|S<2>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.4510	0.000	1	120.6462	0.195	31	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H){1|Zn<5>,1|H<1>,1|N<4>,1|O<2>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.5370	0.000	1	120.6462	0.195	31	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H){1|Zn<5>,2|C<3>,2|N<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.4380	0.000	1	120.6462	0.195	31	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H){1|Zn<6>,2|C<3>,2|N<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.3985	0.035	2	120.6462	0.195	31	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]O[6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5]O[6])(C[6]C[6,6a]H)(H){4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|O<2>,3|C<3>}	H(C[6]C[6]2)	119.4120	0.000	1	119.4120	0.000	1	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(C[6]C[6,6a]H)(H)	C[6](C[6,6a]N[5a,6,6a]C[6a,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)(C[6]C[6,6a]H)(H){1|N<3>,2|C<3>}	C[6](C[6,6a]N[5a,6,6a]C[6a,6a])(C[6]C[6]H)(H){1|H<1>,4|C<3>}	H(C[6]C[6]2)	119.4100	0.000	1	119.4100	0.000	1	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6,6a]H)(H){1|Cu<4>,1|N<2>,1|N<3>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.6090	0.307	3	120.0444	0.190	13	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6,6a]H)(H){1|Cu<4>,1|N<3>,3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	119.7050	0.000	1	120.0444	0.190	13	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6,6a]H)(H){1|Fe<6>,1|N<2>,1|N<3>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.0292	0.148	5	120.0444	0.190	13	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6,6a]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.5730	0.000	1	120.0444	0.190	13	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6,6a]H)(H){1|Ir<6>,1|N<2>,1|N<3>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.2000	0.000	1	120.0444	0.190	13	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6,6a]H)(H){1|N<2>,1|O<1>,1|O<2>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	119.5630	0.472	2	120.0444	0.190	13	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[5,6]N)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[5,6]N)(H){4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<2>,2|C<3>}	H(C[6]C[6]2)	119.2200	0.000	1	119.2200	0.000	1	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[5,6]O)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[5,6]O)(H){1|C<4>,1|N<3>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<1>,2|C<3>}	H(C[6]C[6]2)	119.7550	0.000	1	119.2362	0.084	13	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[5,6]O)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[5,6]O)(H){1|C<4>,3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<1>,2|C<3>}	H(C[6]C[6]2)	119.2640	0.259	4	119.2362	0.084	13	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[5,6]O)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[5,6]O)(H){1|O<2>,3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<1>,2|C<3>}	H(C[6]C[6]2)	119.4740	0.000	1	119.2362	0.084	13	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[5,6]O)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[5,6]O)(H){4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<1>,2|C<3>}	H(C[6]C[6]2)	119.1121	0.250	7	119.2362	0.084	13	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6,6]O)(H)	C[6](C[6,6a]C[6,6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6,6]O)(H){1|O<2>,3|C<3>}	C[6](C[6,6a]C[6,6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<1>,2|C<3>}	H(C[6]C[6]2)	120.5165	0.443	2	120.5165	0.197	2	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6,6]O)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6,6]O)(H){1|C<4>,3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<1>,2|C<3>}	H(C[6]C[6]2)	122.2580	0.000	1	122.2580	0.000	1	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6,6a]O)(H)	C[6](C[6,6a]C[6,6a,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6,6a]O)(H){3|C<3>}	C[6](C[6,6a]C[6,6a,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|O<1>,3|C<3>}	H(C[6]C[6]2)	118.8912	0.417	6	118.8189	0.143	8	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6,6a]O)(H)	C[6](C[6,6a]C[6,6a,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6,6a]O)(H){3|C<3>}	C[6](C[6,6a]C[6,6a,6a]C[6a])(C[6]C[6]H)(H){1|O<1>,4|C<3>}	H(C[6]C[6]2)	118.6020	0.051	2	118.8189	0.143	8	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6,6a]O)(H)	C[6](C[6,6a]C[6,6a,6a]N[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6,6a]O)(H){1|N<2>,2|C<3>}	C[6](C[6,6a]C[6,6a,6a]N[6a])(C[6]C[6]H)(H){1|O<1>,3|C<3>}	H(C[6]C[6]2)	120.8975	2.289	2	120.8975	5.239	2	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]Br)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]Br)(H){2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Br<1>,1|C<2>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	117.1680	0.000	1	117.1680	0.000	1	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]C)(H){1|Li<3>,1|Li<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	119.6140	0.235	2	119.2590	0.074	7	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]C)(H){1|O<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,4|C<3>}	H(C[6]C[6]2)	119.1170	0.093	5	119.2590	0.074	7	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]C)(H)	C[6](C[6,6a]N[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]C)(H){1|C<3>,1|N<3>,1|O<2>}	C[6](C[6,6a]N[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,4|C<3>}	H(C[6]C[6]2)	118.7500	0.000	1	119.2370	0.474	2	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]C)(H)	C[6](C[6,6a]N[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]C)(H){1|N<3>,2|C<3>}	C[6](C[6,6a]N[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.7240	0.000	1	119.2370	0.474	2	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H)	C[6](C[6,6a]C[5,6a]N[6,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6,6a]C[5,6a]N[6,6a])(C[6]C[6]H)(H){1|H<1>,4|C<3>}	H(C[6]C[6]2)	120.1650	0.000	1	120.1650	0.000	1	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H){1|Ag<5>,1|H<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9615	0.016	2	118.6452	4.937	16	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H){1|H<1>,3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2340	0.219	2	118.6452	4.937	16	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H){1|O<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.1680	0.141	4	118.6452	4.937	16	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H){2|C<3>,2|H<1>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6220	0.000	1	118.6452	4.937	16	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H){2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Br<1>,1|C<2>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	116.2400	0.000	1	118.6452	4.937	16	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H){2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<2>,1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.3230	0.000	1	118.6452	4.937	16	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H){2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	116.2297	3.086	4	118.6452	4.937	16	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H){2|Li<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1560	0.000	1	118.6452	4.937	16	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H)	C[6](C[6,6a]C[6,6a]N[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H){1|C<3>,1|N<2>}	C[6](C[6,6a]C[6,6a]N[6a])(C[6]C[6]H)(H){1|C<2>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	117.7370	0.000	1	117.7370	0.000	1	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H)	C[6](C[6,6a]C[6a,6a]N[6,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6,6a]C[6a,6a]N[6,6a])(C[6]C[6]H)(H){1|B<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.9110	0.000	1	120.5440	0.269	2	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H)	C[6](C[6,6a]C[6a,6a]N[6,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6,6a]C[6a,6a]N[6,6a])(C[6]C[6]H)(H){1|B<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.1770	0.000	1	120.5440	0.269	2	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H)	C[6](C[6,6a]N[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6,6a]N[6,6a]C[6a])(C[6]C[6]H)(H){1|C<2>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.5040	0.000	1	120.2064	0.235	10	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H)	C[6](C[6,6a]N[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6,6a]N[6,6a]C[6a])(C[6]C[6]H)(H){1|Ge<3>,1|Si<4>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3030	0.000	1	120.2064	0.235	10	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H)	C[6](C[6,6a]N[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6,6a]N[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>,2|C<3>}	H(C[6]C[6]2)	119.8900	0.000	1	120.2064	0.235	10	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H)	C[6](C[6,6a]N[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6,6a]N[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7430	0.000	1	120.2064	0.235	10	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H)	C[6](C[6,6a]N[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6,6a]N[6,6a]C[6a])(C[6]C[6]H)(H){2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.4932	0.220	5	120.2064	0.235	10	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H)	C[6](C[6,6a]N[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H){1|Ru<7>,1|C<3>,1|N<4>}	C[6](C[6,6a]N[6,6a]C[6a])(C[6]C[6]H)(H){1|Ru<7>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.1580	0.000	1	120.2064	0.235	10	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H)	C[6](C[6,6a]N[6,6a]N[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6,6a]N[6,6a]N[6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,2|C<3>}	H(C[6]C[6]2)	123.3570	0.000	1	121.3030	3.175	3	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H)	C[6](C[6,6a]N[6,6a]N[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6,6a]N[6,6a]N[6a])(C[6]C[6]H)(H){1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.3820	0.000	1	121.3030	3.175	3	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H)	C[6](C[6,6a]N[6,6a]N[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[6,6a]N[6,6a]N[6a])(C[6]C[6]H)(H){2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.1700	0.000	1	121.3030	3.175	3	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]N)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]N)(H){1|O<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,3|C<3>}	H(C[6]C[6]2)	119.0795	0.144	2	119.1153	0.014	3	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]N)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]N)(H){1|Pd<4>,3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.1870	0.000	1	119.1153	0.014	3	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H)	C[6](C[6,6a]C[6,6a]2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H){1|Ir<6>,1|N<3>,3|C<3>}	C[6](C[6,6a]C[6,6a]2)(C[6]C[6]H)(H){1|N<3>,4|C<3>}	H(C[6]C[6]2)	119.9400	0.038	2	119.9400	0.001	2	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H){1|Ag<4>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	122.4090	0.000	1	120.2799	0.294	79	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H){1|Au<4>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	121.3880	0.000	1	120.2799	0.294	79	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H){1|Co<4>,1|N<3>,3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.3063	0.158	4	120.2799	0.294	79	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H){1|Cu<4>,1|N<3>,3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.4788	0.293	6	120.2799	0.294	79	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H){1|Cu<5>,1|N<2>,1|N<3>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.6880	0.000	1	120.2799	0.294	79	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H){1|Cu<5>,1|N<3>,3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.4145	0.120	4	120.2799	0.294	79	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H){1|Cu<6>,1|N<3>,3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.3360	0.240	5	120.2799	0.294	79	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H){1|Fe<4>,1|N<3>,3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.3935	0.023	2	120.2799	0.294	79	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H){1|Fe<6>,1|N<3>,3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.0124	0.189	5	120.2799	0.294	79	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H){1|H<1>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	119.4560	0.014	2	120.2799	0.294	79	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H){1|Ir<6>,1|N<3>,3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.3732	0.223	8	120.2799	0.294	79	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H){1|Ir<7>,1|N<3>,3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	121.4190	0.000	1	120.2799	0.294	79	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H){1|Ir<7>,1|N<3>,3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.0577	0.823	3	120.2799	0.294	79	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H){1|Mn<5>,1|N<3>,3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	119.9425	0.200	2	120.2799	0.294	79	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H){1|Mn<6>,1|N<3>,3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.0540	0.000	1	120.2799	0.294	79	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H){1|Mo<6>,1|N<3>,3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.0252	0.169	4	120.2799	0.294	79	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H){1|Pt<4>,1|N<3>,3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	119.9907	0.626	3	120.2799	0.294	79	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H){1|Pu<11>,1|N<2>,1|N<3>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.6347	0.355	3	120.2799	0.294	79	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H){1|Re<6>,1|H<1>,1|N<3>,1|N<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.5130	0.000	1	120.2799	0.294	79	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H){1|Re<6>,1|N<3>,3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.3873	0.308	7	120.2799	0.294	79	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H){1|Ru<6>,1|N<3>,3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.0810	0.783	6	120.2799	0.294	79	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H){1|Ru<8>,1|N<3>,3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.1665	0.131	2	120.2799	0.294	79	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H){1|Zn<4>,1|N<3>,3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.4346	0.231	5	120.2799	0.294	79	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H){1|Zn<6>,1|N<3>,3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	118.8590	0.247	2	120.2799	0.294	79	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H)	C[6](C[6,6a]C[6,6a]N[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H){1|Cu<5>,1|N<2>,1|N<3>,2|C<3>}	C[6](C[6,6a]C[6,6a]N[6a])(C[6]C[6]H)(H){1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.1660	0.000	1	120.0834	0.059	5	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H)	C[6](C[6,6a]C[6,6a]N[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H){1|Ru<6>,1|N<2>,1|N<3>,2|C<3>}	C[6](C[6,6a]C[6,6a]N[6a])(C[6]C[6]H)(H){1|N<3>,3|C<3>}	H(C[6]C[6]2)	119.9015	0.310	2	120.0834	0.059	5	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H)	C[6](C[6,6a]C[6,6a]N[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H){1|Zn<4>,1|N<2>,1|N<3>,2|C<3>}	C[6](C[6,6a]C[6,6a]N[6a])(C[6]C[6]H)(H){1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.1070	0.000	1	120.0834	0.059	5	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H)	C[6](C[6,6a]C[6,6a]N[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H){1|Zn<5>,1|N<2>,1|N<3>,2|C<3>}	C[6](C[6,6a]C[6,6a]N[6a])(C[6]C[6]H)(H){1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.3410	0.000	1	120.0834	0.059	5	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H)	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H){1|Re<6>,1|N<3>,3|C<3>}	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H){1|N<3>,4|C<3>}	H(C[6]C[6]2)	119.9577	0.171	6	120.0968	0.088	8	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H)	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H){1|Zn<5>,1|N<3>,3|C<3>}	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H){1|N<3>,4|C<3>}	H(C[6]C[6]2)	120.5140	0.068	2	120.0968	0.088	8	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(H){1|C<4>,1|H<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<2>,1|C<4>,1|O<1>,2|C<3>}	H(C[6]C[6]2)	119.7305	0.067	2	119.9456	1.735	147	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(H){1|C<4>,1|O<2>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<1>,2|C<3>}	H(C[6]C[6]2)	119.6990	0.000	1	119.9456	1.735	147	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(H){1|C<4>,1|O<2>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|O<1>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	119.4780	0.185	2	119.9456	1.735	147	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(H){1|C<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|O<1>,3|C<3>}	H(C[6]C[6]2)	120.1610	0.000	1	119.9456	1.735	147	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(H){1|C<4>,3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<1>,2|C<3>}	H(C[6]C[6]2)	119.4600	0.000	1	119.9456	1.735	147	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(H){1|Cl<1>,3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<1>,2|C<3>}	H(C[6]C[6]2)	119.0170	0.000	1	119.9456	1.735	147	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(H){1|H<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|O<1>,1|O<2>,2|C<3>}	H(C[6]C[6]2)	119.3600	0.024	2	119.9456	1.735	147	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(H){1|H<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|O<2>,2|C<3>,2|O<1>}	H(C[6]C[6]2)	120.3825	0.057	2	119.9456	1.735	147	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(H){1|N<2>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|O<1>,3|C<3>}	H(C[6]C[6]2)	120.5775	1.755	53	119.9456	1.735	147	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(H){1|O<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|O<1>,3|C<3>}	H(C[6]C[6]2)	120.0960	0.000	1	119.9456	1.735	147	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(H){1|O<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|O<1>,4|C<3>}	H(C[6]C[6]2)	119.4570	0.040	2	119.9456	1.735	147	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(H){2|C<3>,2|C<4>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<1>,2|C<3>}	H(C[6]C[6]2)	119.3570	0.000	1	119.9456	1.735	147	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(H){2|C<3>,2|O<2>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<1>,2|C<3>}	H(C[6]C[6]2)	120.2890	0.202	2	119.9456	1.735	147	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(H){3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|O<1>,1|O<2>,2|C<3>}	H(C[6]C[6]2)	119.5880	0.000	1	119.9456	1.735	147	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(H){3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|O<1>,3|C<3>}	H(C[6]C[6]2)	119.5642	0.876	74	119.9456	1.735	147	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(H){3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|O<1>,4|C<3>}	H(C[6]C[6]2)	118.8800	0.000	1	119.9456	1.735	147	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]P)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]P)(H){1|O<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|O<1>,1|P<3>,3|C<3>}	H(C[6]C[6]2)	119.1920	0.000	1	119.1920	0.000	1	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[5,6]C)(H)	C[6](C[6,6a]C[5,6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]C)(H){1|Ga<5>,2|C<3>}	C[6](C[6,6a]C[5,6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.4919	0.287	7	119.5089	0.073	8	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[5,6]C)(H)	C[6](C[6,6a]C[5,6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]C)(H){1|Ga<5>,2|C<3>}	C[6](C[6,6a]C[5,6,6a]C[6a])(C[6]C[6]H)(H){1|Cl<1>,1|C<4>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.6280	0.000	1	119.5089	0.073	8	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H)	C[6](C[6,6a]C[5,6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H){1|Ga<4>,2|C<3>}	C[6](C[6,6a]C[5,6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8910	0.000	1	120.3175	0.334	68	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H)	C[6](C[6,6a]C[5,6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H){1|Ga<5>,2|C<3>}	C[6](C[6,6a]C[5,6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1970	0.112	2	120.3175	0.334	68	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H)	C[6](C[6,6a]C[5,6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H){1|Ga<6>,2|C<3>}	C[6](C[6,6a]C[5,6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4236	0.688	11	120.3175	0.334	68	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H)	C[6](C[6,6a]C[5,6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H){1|Ge<2>,2|C<3>}	C[6](C[6,6a]C[5,6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9240	0.000	1	120.3175	0.334	68	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H)	C[6](C[6,6a]C[5,6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H){1|Ge<6>,2|C<3>}	C[6](C[6,6a]C[5,6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1300	0.116	2	120.3175	0.334	68	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H)	C[6](C[6,6a]C[5,6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H){1|In<5>,2|C<3>}	C[6](C[6,6a]C[5,6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6975	0.469	2	120.3175	0.334	68	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H)	C[6](C[6,6a]C[5,6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H){1|In<6>,2|C<3>}	C[6](C[6,6a]C[5,6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6013	0.563	29	120.3175	0.334	68	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H)	C[6](C[6,6a]C[5,6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H){1|Nb<7>,2|C<3>}	C[6](C[6,6a]C[5,6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3790	0.505	2	120.3175	0.334	68	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H)	C[6](C[6,6a]C[5,6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H){1|Si<6>,2|C<3>}	C[6](C[6,6a]C[5,6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8261	0.206	18	120.3175	0.334	68	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H){1|Cd<5>,1|N<3>,3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	120.7340	0.068	3	120.9894	0.199	35	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H){1|Cd<6>,1|N<3>,3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	121.1885	0.530	4	120.9894	0.199	35	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H){1|Cu<3>,1|N<2>,3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	121.2090	0.000	1	120.9894	0.199	35	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H){1|Cu<3>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	120.6923	0.231	4	120.9894	0.199	35	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H){1|Cu<4>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	121.0900	0.282	3	120.9894	0.199	35	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H){1|Cu<5>,1|N<3>,3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	120.9580	0.186	3	120.9894	0.199	35	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H){1|Cu<6>,1|N<3>,3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	120.9135	0.152	2	120.9894	0.199	35	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H){1|Ni<6>,1|N<3>,3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	121.0820	0.000	1	120.9894	0.199	35	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H){1|Pd<4>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	120.6230	0.723	2	120.9894	0.199	35	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H){1|Rh<8>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	121.2235	0.245	2	120.9894	0.199	35	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H){1|Ru<5>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<2>,2|N<3>}	H(C[6]C[6]2)	120.1670	0.000	1	120.9894	0.199	35	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H){1|Ru<6>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<2>,2|N<3>}	H(C[6]C[6]2)	120.2980	0.000	1	120.9894	0.199	35	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H){1|Ru<6>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	121.2607	0.576	3	120.9894	0.199	35	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H){1|Ru<9>,1|N<3>,3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>,2|N<3>}	H(C[6]C[6]2)	121.7540	0.000	1	120.9894	0.199	35	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H){1|W<6>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<2>,2|N<3>}	H(C[6]C[6]2)	120.4530	0.000	1	120.9894	0.199	35	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H){1|Zn<4>,1|N<3>,3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	121.4480	0.000	1	120.9894	0.199	35	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H){1|Zn<6>,1|N<3>,3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	121.5240	0.163	2	120.9894	0.199	35	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[5a,6]C)(H)	C[6](C[6,6a]C[5a,6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[5a,6]C)(H){1|B<4>,2|C<3>}	C[6](C[6,6a]C[5a,6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.0920	0.000	1	119.0920	0.000	1	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[5a,6]H)(H)	C[6](C[6,6a]C[5a,6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[5a,6]H)(H){1|B<4>,2|C<3>}	C[6](C[6,6a]C[5a,6,6a]C[6a])(C[6]C[6]H)(H){1|Br<1>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.4210	0.000	1	119.4988	1.374	45	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[5a,6]H)(H)	C[6](C[6,6a]C[5a,6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[5a,6]H)(H){1|B<4>,2|C<3>}	C[6](C[6,6a]C[5a,6,6a]C[6a])(C[6]C[6]H)(H){1|Cl<1>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.8880	0.000	1	119.4988	1.374	45	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[5a,6]H)(H)	C[6](C[6,6a]C[5a,6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[5a,6]H)(H){1|B<4>,2|C<3>}	C[6](C[6,6a]C[5a,6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|I<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	121.7905	4.021	2	119.4988	1.374	45	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[5a,6]H)(H)	C[6](C[6,6a]C[5a,6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[5a,6]H)(H){1|B<4>,2|C<3>}	C[6](C[6,6a]C[5a,6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.3794	0.909	41	119.4988	1.374	45	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6,6]C)(H)	C[6](C[6,6a]C[6,6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6,6]C)(H){1|C<4>,2|C<3>}	C[6](C[6,6a]C[6,6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.6620	0.000	1	119.6620	0.000	1	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6,6]H)(H)	C[6](C[6,6a]C[6,6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6,6]H)(H){1|B<4>,2|C<3>}	C[6](C[6,6a]C[6,6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	124.1115	5.185	2	120.6538	4.920	15	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6,6]H)(H)	C[6](C[6,6a]C[6,6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6,6]H)(H){1|C<4>,2|C<3>}	C[6](C[6,6a]C[6,6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9773	1.252	9	120.6538	4.920	15	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6,6]H)(H)	C[6](C[6,6a]C[6,6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6,6]H)(H){1|Ga<4>,2|C<3>}	C[6](C[6,6a]C[6,6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.9910	0.187	2	120.6538	4.920	15	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6,6]H)(H)	C[6](C[6,6a]C[6,6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6,6]H)(H){1|O<2>,2|C<3>}	C[6](C[6,6a]C[6,6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7870	0.000	1	120.6538	4.920	15	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6,6]H)(H)	C[6](C[6,6a]C[6,6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6,6]H)(H){3|C<3>}	C[6](C[6,6a]C[6,6,6a]C[6a])(C[6]C[6]H)(H){1|Cl<1>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.0190	0.000	1	120.6538	4.920	15	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6,6a]H)(H)	C[6](C[6,6a]C[6,6a,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6,6a]H)(H){3|C<3>}	C[6](C[6,6a]C[6,6a,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	122.7790	0.000	1	122.7790	0.000	1	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]2)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]2)(H){1|Cd<5>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	120.5040	0.000	1	120.4410	0.008	2	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]2)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]2)(H){1|Cu<5>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	120.3780	0.000	1	120.4410	0.008	2	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Ru<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]2)(C[6]C[6]H)(H){1|C<4>,1|N<3>,1|O<2>,2|C<3>}	H(C[6]C[6]2)	119.6455	0.484	2	119.6455	0.235	2	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Ag<3>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	123.9690	3.110	2	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Ag<3>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.2150	0.000	1	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Ag<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.1358	0.092	4	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Ag<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.0755	0.542	2	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Al<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.7873	0.119	4	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Al<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	119.4126	0.110	7	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Al<5>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.5756	0.157	16	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Al<5>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Cl<1>,1|C<4>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.3948	0.362	4	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Al<5>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	119.7320	0.337	2	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Ba<11>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|N<3>,1|S<4>,2|C<3>}	H(C[6]C[6]2)	119.8980	0.000	1	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Bi<5>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.3320	0.120	2	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Bi<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.5553	0.203	3	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|C<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<2>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.4090	0.000	1	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|C<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.4880	0.000	1	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|C<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	119.3070	1.203	30	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Ca<8>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.3215	0.303	4	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Cd<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.0057	0.103	3	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Cd<5>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.4737	0.736	3	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Cd<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	121.0930	1.849	14	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Cd<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	119.8913	0.271	6	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Cd<8>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.3490	0.231	3	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Co<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.8065	0.389	14	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Co<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	118.9150	0.000	1	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Co<5>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.8477	0.515	11	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Co<5>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	119.9562	1.144	4	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Co<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.8418	0.347	10	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Co<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.5923	0.114	3	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Co<7>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.6545	0.125	2	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Cr<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.5000	0.000	1	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Cu<3>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.8128	0.268	18	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Cu<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.9620	0.590	202	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Cu<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.4279	0.489	9	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Cu<5>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<2>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.7580	0.000	1	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Cu<5>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.4483	1.339	28	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Cu<5>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.2771	0.398	7	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Cu<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.7464	0.503	8	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Cu<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.5630	0.000	1	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Fe<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.7504	0.567	5	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Fe<5>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.5029	0.377	10	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Fe<5>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Cl<1>,1|C<4>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.4425	0.115	6	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Fe<5>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	122.5720	0.850	2	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Fe<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.1272	0.912	37	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Fe<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.9079	0.870	14	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<2>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	122.5560	0.611	2	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	119.8620	0.000	1	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.1474	1.042	35	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.4960	0.000	1	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.2900	0.000	1	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.3352	1.086	30	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Hg<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.4090	0.312	4	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Hg<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.4686	0.188	5	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Hg<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.3810	0.000	1	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Ir<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.3325	0.393	4	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Ir<7>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.3650	0.000	1	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Ir<7>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.9900	0.000	1	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Ir<8>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|I<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.1570	0.000	1	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Ir<8>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.4740	0.000	1	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Li<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	121.0655	0.931	4	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Li<5>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.0740	0.000	1	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Mg<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	119.3725	0.182	2	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Mg<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.1810	0.000	1	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Mn<5>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.3217	0.462	4	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Mn<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<1>,2|N<3>}	H(C[6]C[6]2)	120.0550	0.000	1	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Mn<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.3400	0.407	19	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Mn<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.5953	0.386	34	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Mn<7>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.8220	0.061	2	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Mn<8>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.5440	0.160	2	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Mo<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.4925	1.357	2	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Mo<8>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.7186	0.136	9	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Mo<9>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.2780	0.187	2	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Ni<3>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.5025	0.374	2	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Ni<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.3838	0.460	18	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Ni<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	119.3500	0.143	2	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Ni<5>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<2>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.8510	0.000	1	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Ni<5>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.7163	0.256	6	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Ni<5>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.7452	0.512	5	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Ni<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.9310	0.291	12	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Ni<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	121.9243	2.683	4	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Ni<7>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.6533	0.087	3	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|O<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	122.8020	0.000	1	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Os<7>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	119.3170	0.000	1	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Pb<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<1>,2|N<3>}	H(C[6]C[6]2)	120.1800	0.000	1	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Pb<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.0510	0.136	3	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Pd<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.7194	0.534	20	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Pd<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.6139	1.505	9	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Pd<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.7430	0.045	2	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Pt<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<2>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.7940	0.000	1	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Pt<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.3590	0.405	13	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Pt<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Cl<1>,1|C<4>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	118.8643	0.100	3	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Pt<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	119.2877	1.089	3	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Pt<5>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.4260	0.000	1	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Pt<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.6880	0.000	1	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Pt<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.4943	0.389	7	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Re<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.9786	0.552	23	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Re<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	119.9800	0.396	2	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Rh<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.0000	0.085	3	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Rh<5>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.7100	0.000	1	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Rh<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.7120	0.000	1	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Rh<8>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.6027	0.346	3	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Ru<10>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.5683	0.138	6	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Ru<5>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.1810	0.000	1	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Ru<5>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	119.4070	0.000	1	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Ru<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.6288	1.240	26	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Ru<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.1050	0.000	1	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Ru<8>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.6820	0.000	1	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Ru<9>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.5437	0.574	3	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Ru<9>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.5096	0.104	7	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Sn<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.7485	0.093	2	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Sn<5>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.6985	0.264	4	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Sn<5>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.8355	0.039	2	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Sn<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.8114	0.364	5	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Sn<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.5710	0.128	3	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Zn<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.9123	0.222	17	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Zn<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Cl<1>,1|C<4>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.9500	0.000	1	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Zn<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.6986	0.975	7	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Zn<5>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.0941	1.152	15	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Zn<5>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	121.3365	1.112	21	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Zn<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.2006	0.287	14	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Zn<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.4535	0.222	8	120.0720	0.807	975	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Cu<4>,2|C<3>}	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H){1|C<4>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	119.8983	0.257	6	119.8983	0.066	6	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]Cl)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]Cl)(H){1|Co<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Cl<1>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.8010	0.194	2	120.8744	0.220	7	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]Cl)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]Cl)(H){1|Re<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Cl<1>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.9530	0.000	1	120.8744	0.220	7	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]Cl)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]Cl)(H){1|Zn<5>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Cl<1>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.8915	0.649	4	120.8744	0.220	7	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[5,6,6a]C[6,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|C<4>,2|C<3>}	C[6](C[6,6a]C[5,6,6a]C[6,6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.7590	0.000	1	120.7590	0.000	1	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[5,6a]C[6,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Co<6>,2|C<3>}	C[6](C[6,6a]C[5,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.8510	0.000	1	120.1519	0.211	44	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[5,6a]C[6,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Cu<4>,2|C<3>}	C[6](C[6,6a]C[5,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.4998	0.281	6	120.1519	0.211	44	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[5,6a]C[6,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Cu<5>,2|C<3>}	C[6](C[6,6a]C[5,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.2627	0.136	6	120.1519	0.211	44	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[5,6a]C[6,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Cu<5>,2|C<3>}	C[6](C[6,6a]C[5,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	120.3610	0.134	2	120.1519	0.211	44	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[5,6a]C[6,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Fe<6>,2|C<3>}	C[6](C[6,6a]C[5,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.0384	0.539	17	120.1519	0.211	44	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[5,6a]C[6,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6,6a]C[5,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.5860	0.000	1	120.1519	0.211	44	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[5,6a]C[6,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6,6a]C[5,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	120.5970	0.373	2	120.1519	0.211	44	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[5,6a]C[6,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Pt<4>,2|C<3>}	C[6](C[6,6a]C[5,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	119.8047	0.170	3	120.1519	0.211	44	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[5,6a]C[6,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ru<6>,2|C<3>}	C[6](C[6,6a]C[5,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.4935	0.032	2	120.1519	0.211	44	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[5,6a]C[6,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ru<6>,2|C<3>}	C[6](C[6,6a]C[5,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	119.7835	0.326	2	120.1519	0.211	44	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[5,6a]C[6,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ru<9>,2|C<3>}	C[6](C[6,6a]C[5,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	119.5670	0.556	2	120.1519	0.211	44	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Cd<6>,2|C<3>}	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.5650	0.000	1	120.3171	0.372	77	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Cd<6>,2|C<3>}	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	120.4110	0.000	1	120.3171	0.372	77	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Co<6>,2|C<3>}	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.3290	0.000	1	120.3171	0.372	77	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Co<6>,2|C<3>}	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	120.3670	0.000	1	120.3171	0.372	77	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Cu<4>,2|C<3>}	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.4053	0.084	3	120.3171	0.372	77	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Cu<4>,2|C<3>}	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	120.3447	0.135	3	120.3171	0.372	77	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Cu<5>,2|C<3>}	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	122.3225	1.654	2	120.3171	0.372	77	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Cu<5>,2|C<3>}	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	122.6035	0.231	2	120.3171	0.372	77	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Cu<6>,2|C<3>}	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.3035	0.267	2	120.3171	0.372	77	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Fe<6>,2|C<3>}	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.2157	0.263	21	120.3171	0.372	77	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Fe<6>,2|C<3>}	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	120.1324	0.325	8	120.3171	0.372	77	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.3975	0.134	2	120.3171	0.372	77	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	120.4415	0.323	2	120.3171	0.372	77	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Hg<4>,2|C<3>}	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.7870	0.000	1	120.3171	0.372	77	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Hg<4>,2|C<3>}	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	119.6340	0.000	1	120.3171	0.372	77	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ir<6>,2|C<3>}	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.0746	0.195	5	120.3171	0.372	77	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ir<6>,2|C<3>}	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	119.8716	0.112	5	120.3171	0.372	77	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Mn<6>,2|C<3>}	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.3718	0.202	5	120.3171	0.372	77	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Mn<6>,2|C<3>}	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	120.2398	0.263	5	120.3171	0.372	77	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ni<6>,2|C<3>}	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.1320	0.049	2	120.3171	0.372	77	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ni<6>,2|C<3>}	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	120.3450	0.238	2	120.3171	0.372	77	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ru<9>,2|C<3>}	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.3620	0.000	1	120.3171	0.372	77	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ru<9>,2|C<3>}	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	119.2410	0.000	1	120.3171	0.372	77	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|C<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]2)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.0685	0.392	2	120.0769	0.052	9	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|C<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]2)(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.0727	0.286	3	120.0769	0.052	9	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Cu<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]2)(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.1810	0.072	2	120.0769	0.052	9	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ni<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]2)(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	119.9875	0.241	2	120.0769	0.052	9	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ag<3>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|S<4>,2|C<3>}	H(C[6]C[6]2)	120.9210	0.000	1	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ag<3>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3107	0.284	4	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ag<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.8428	0.422	12	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ag<5>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.7415	0.295	2	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Al<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4430	0.270	3	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Al<5>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2577	0.351	3	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Al<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	121.0687	1.375	7	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Au<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7610	0.000	1	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Au<5>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.5140	0.000	1	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|B<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6107	0.231	4	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ba<8>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5350	0.498	8	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Bi<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4447	0.442	6	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|C<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	120.2227	0.079	3	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|C<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6143	0.645	49	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ca<7>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6153	0.245	4	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ca<8>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5388	0.361	4	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Cd<5>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4548	0.283	5	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Cd<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>,2|N<3>}	H(C[6]C[6]2)	120.5020	0.000	1	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Cd<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5117	0.376	94	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Cd<7>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4082	0.217	20	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Cd<8>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4257	0.098	3	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Cm<8>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6900	0.255	2	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Co<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.9597	1.333	13	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Co<5>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1960	0.176	8	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Co<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.2563	0.470	12	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Co<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	119.5575	0.474	2	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Co<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3289	0.815	330	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Co<7>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0280	0.262	26	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Co<8>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3400	0.089	2	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Cr<5>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3620	0.000	1	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Cr<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3292	0.456	55	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Cr<8>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	121.9900	2.409	7	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Cu<3>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1735	0.248	15	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Cu<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.5905	0.392	2	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Cu<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Cl<1>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.7880	0.000	1	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Cu<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	120.1310	0.000	1	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Cu<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5072	0.677	194	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Cu<5>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.1685	0.108	8	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Cu<5>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2601	1.016	343	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Cu<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3944	0.412	32	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Eu<13>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5820	0.273	4	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Eu<8>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5657	0.344	10	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Fe<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<3>,1|N<2>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.1940	0.105	2	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Fe<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5980	0.018	2	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Fe<5>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.3210	0.453	2	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Fe<5>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.9287	1.107	6	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Fe<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Br<1>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.3175	0.185	2	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Fe<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<3>,1|N<2>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.5800	0.000	1	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Fe<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.7948	0.112	5	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Fe<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1337	0.693	485	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Fe<7>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9280	1.527	2	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Fe<8>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1070	0.000	1	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<3>,1|N<2>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.5321	0.288	8	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.3540	0.099	5	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Cl<1>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.3560	0.388	3	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<2>,2|C<3>}	H(C[6]C[6]2)	120.2870	0.000	1	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|S<4>,2|C<3>}	H(C[6]C[6]2)	120.7085	0.499	2	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	120.6760	0.335	5	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6527	1.115	194	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|In<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5670	0.190	2	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ir<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Br<1>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.3485	0.421	4	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ir<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<3>,1|N<2>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.3617	0.300	3	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ir<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|F<1>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.9350	0.283	4	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ir<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.6440	0.214	2	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ir<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.2687	0.217	3	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ir<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	120.0420	0.475	2	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ir<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0304	0.382	38	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ir<7>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<3>,1|N<2>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.3460	0.000	1	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ir<7>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0485	0.179	4	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ir<8>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	119.6400	0.000	1	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ir<8>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1775	0.588	11	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Li<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3696	0.204	5	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Mg<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|S<4>,2|C<3>}	H(C[6]C[6]2)	120.3800	0.000	1	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Mg<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3382	0.174	11	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Mn<5>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2489	0.347	10	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Mn<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Br<1>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.0260	0.000	1	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Mn<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>,2|N<3>}	H(C[6]C[6]2)	120.5640	0.000	1	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Mn<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<2>,2|C<3>}	H(C[6]C[6]2)	120.4750	0.038	2	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Mn<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.4400	0.000	1	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Mn<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5706	0.824	313	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Mn<7>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4380	0.229	20	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Mo<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1004	0.311	24	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Mo<8>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2135	0.091	2	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|N<2>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6110	0.000	1	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ni<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3249	0.729	31	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ni<5>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|I<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.0170	0.000	1	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ni<5>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	121.1765	2.406	6	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ni<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.5424	0.252	5	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ni<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|S<4>,2|C<3>}	H(C[6]C[6]2)	119.5025	0.800	2	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ni<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3811	0.778	367	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ni<7>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2511	0.237	8	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|O<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9958	0.940	20	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|O<2>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1407	0.461	4	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Os<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8740	0.000	1	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Os<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Cl<1>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.3810	0.000	1	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Os<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	119.7740	0.000	1	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Os<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9703	0.539	46	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Os<7>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0050	0.000	1	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Os<9>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9207	0.216	6	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Pd<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<3>,1|N<2>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.6060	0.427	5	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Pd<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<3>,2|H<1>,2|N<3>}	H(C[6]C[6]2)	119.7740	0.250	2	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Pd<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Cl<1>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.3150	0.000	1	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Pd<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<2>,2|C<3>}	H(C[6]C[6]2)	120.4646	0.915	12	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Pd<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1148	0.382	143	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Pd<5>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5269	1.270	17	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Pd<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4224	0.510	7	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Pd<7>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3605	0.066	2	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Pt<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<3>,1|N<2>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	123.2720	0.000	1	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Pt<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.6455	0.087	2	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Pt<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Cl<1>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.7910	0.036	3	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Pt<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|I<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.6030	0.228	3	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Pt<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|S<4>,2|C<3>}	H(C[6]C[6]2)	119.8985	0.035	2	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Pt<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	119.5347	0.190	3	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Pt<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9651	0.951	145	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Pt<5>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2116	0.363	22	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Pt<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0708	0.710	26	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Re<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Cl<1>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.8805	0.076	2	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Re<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|S<2>,2|C<3>}	H(C[6]C[6]2)	120.1710	0.338	2	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Re<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	120.2230	0.142	4	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Re<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0993	0.378	119	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Rh<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Cl<1>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.2660	0.000	1	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Rh<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2858	0.043	5	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Rh<5>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<3>,1|N<2>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.2620	0.000	1	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Rh<5>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5104	0.493	7	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Rh<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1043	0.320	7	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Rh<7>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0660	0.000	1	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Rh<8>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2880	0.457	6	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ru<5>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.8077	0.110	4	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ru<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<3>,1|N<2>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.4712	0.389	4	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ru<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	121.8840	1.080	2	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ru<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.7030	0.000	1	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ru<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	120.0790	0.000	1	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ru<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0144	0.540	130	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ru<7>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6340	0.000	1	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ru<8>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	121.7730	2.551	3	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ru<9>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Br<1>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.6480	0.000	1	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ru<9>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2239	0.333	8	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Sb<5>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3160	0.058	2	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Sb<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1815	0.399	4	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Si<5>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9250	0.000	1	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Sm<11>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5352	0.198	4	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Sm<13>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3940	0.535	4	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Sm<9>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.8028	0.691	4	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Sn<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5085	0.011	2	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Sn<5>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4218	0.103	5	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Sn<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Cl<1>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.1385	0.291	2	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Sn<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3168	0.269	31	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Sn<7>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3000	0.000	1	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Sr<7>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4980	0.156	2	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Sr<8>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5045	0.006	2	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|U<10>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2165	0.395	2	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|V<5>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2527	0.256	4	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|V<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4520	0.000	1	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|V<8>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2675	0.022	2	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|V<9>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	121.0070	0.382	2	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|W<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5874	0.294	8	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Zn<3>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	121.3390	0.713	2	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Zn<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<3>,1|N<2>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.5150	0.221	2	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Zn<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.1630	0.301	6	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Zn<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	121.3840	0.421	2	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Zn<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4159	0.435	16	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Zn<5>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Cl<1>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.2240	0.000	1	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Zn<5>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.1690	0.000	1	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Zn<5>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3639	0.333	81	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Zn<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.4922	0.263	6	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Zn<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4361	0.825	109	120.3207	0.598	4011	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]N[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Al<6>,1|C<3>,1|N<2>}	C[6](C[6,6a]C[6,6a]N[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.8033	0.149	3	120.0122	0.087	13	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]N[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Cr<8>,1|C<3>,1|N<2>}	C[6](C[6,6a]C[6,6a]N[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.0705	0.008	2	120.0122	0.087	13	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]N[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|N<2>}	C[6](C[6,6a]C[6,6a]N[6a])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	119.8380	0.103	3	120.0122	0.087	13	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]N[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Pd<6>,1|C<3>,1|N<2>}	C[6](C[6,6a]C[6,6a]N[6a])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.4580	0.552	2	120.0122	0.087	13	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]N[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Rh<5>,1|C<3>,1|N<2>}	C[6](C[6,6a]C[6,6a]N[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.9110	0.000	1	120.0122	0.087	13	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]N[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Rh<8>,1|C<3>,1|N<2>}	C[6](C[6,6a]C[6,6a]N[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.0760	0.000	1	120.0122	0.087	13	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]N[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Zr<10>,1|C<3>,1|N<2>}	C[6](C[6,6a]C[6,6a]N[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.1900	0.000	1	120.0122	0.087	13	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ag<4>,2|C<3>}	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.4620	0.226	4	120.3188	0.317	161	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Al<4>,2|C<3>}	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	123.2920	0.000	1	120.3188	0.317	161	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Bi<6>,2|C<3>}	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.7285	0.251	4	120.3188	0.317	161	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|C<4>,2|C<3>}	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.6750	0.055	2	120.3188	0.317	161	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Cd<6>,2|C<3>}	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.3885	0.094	2	120.3188	0.317	161	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Co<5>,2|C<3>}	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.5660	0.127	2	120.3188	0.317	161	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Co<6>,2|C<3>}	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.2279	0.394	15	120.3188	0.317	161	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Co<7>,2|C<3>}	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.4935	0.054	2	120.3188	0.317	161	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Cr<6>,2|C<3>}	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.1217	0.166	4	120.3188	0.317	161	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Cu<4>,2|C<3>}	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.3258	0.185	12	120.3188	0.317	161	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Cu<4>,2|C<3>}	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.4105	0.015	2	120.3188	0.317	161	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Cu<5>,2|C<3>}	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.3468	0.323	10	120.3188	0.317	161	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Eu<13>,2|C<3>}	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.2600	0.257	3	120.3188	0.317	161	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Fe<6>,2|C<3>}	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.3782	0.331	14	120.3188	0.317	161	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.4652	0.214	6	120.3188	0.317	161	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.3430	0.274	2	120.3188	0.317	161	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ir<6>,2|C<3>}	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.2913	0.223	4	120.3188	0.317	161	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ir<6>,2|C<3>}	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.3080	0.000	1	120.3188	0.317	161	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ir<8>,2|C<3>}	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.9370	0.369	4	120.3188	0.317	161	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Mn<6>,2|C<3>}	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	121.5462	1.546	5	120.3188	0.317	161	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ni<5>,2|C<3>}	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.0370	0.645	2	120.3188	0.317	161	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ni<6>,2|C<3>}	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.1825	0.089	4	120.3188	0.317	161	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Os<9>,2|C<3>}	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.1910	0.429	2	120.3188	0.317	161	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Pd<4>,2|C<3>}	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.5540	0.035	2	120.3188	0.317	161	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Pt<4>,2|C<3>}	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	119.5265	0.856	4	120.3188	0.317	161	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Re<6>,2|C<3>}	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.2487	0.226	9	120.3188	0.317	161	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Rh<4>,2|C<3>}	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.5465	0.331	4	120.3188	0.317	161	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Rh<5>,2|C<3>}	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.0445	0.137	4	120.3188	0.317	161	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Rh<8>,2|C<3>}	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.5057	0.786	4	120.3188	0.317	161	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ru<6>,2|C<3>}	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.9536	0.500	18	120.3188	0.317	161	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ru<9>,2|C<3>}	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.0395	0.062	2	120.3188	0.317	161	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Sn<6>,2|C<3>}	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.1170	0.000	1	120.3188	0.317	161	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Zn<5>,2|C<3>}	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.2490	0.106	2	120.3188	0.317	161	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Zn<6>,2|C<3>}	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.3833	0.270	4	120.3188	0.317	161	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]Ir)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]Ir)(H){1|H<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Ir<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	118.6815	0.474	2	118.6815	0.225	2	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]N)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]N)(H){1|Cd<5>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	120.0570	0.000	1	119.9830	0.374	22	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]N)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]N)(H){1|Cd<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	120.5510	0.000	1	119.9830	0.374	22	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]N)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]N)(H){1|Co<5>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.5470	0.000	1	119.9830	0.374	22	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]N)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]N)(H){1|Co<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	119.4870	0.000	1	119.9830	0.374	22	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]N)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]N)(H){1|Co<7>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	120.5654	0.226	5	119.9830	0.374	22	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]N)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]N)(H){1|Cu<3>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>,2|N<2>}	H(C[6]C[6]2)	120.4120	0.000	1	119.9830	0.374	22	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]N)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]N)(H){1|Cu<5>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.5270	0.000	1	119.9830	0.374	22	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]N)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]N)(H){1|H<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	119.7465	0.071	2	119.9830	0.374	22	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]N)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]N)(H){1|Ni<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	120.2400	0.000	1	119.9830	0.374	22	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]N)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]N)(H){1|Ni<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	119.9250	0.000	1	119.9830	0.374	22	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]N)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]N)(H){1|O<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	119.7940	0.000	1	119.9830	0.374	22	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]N)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]N)(H){1|Pt<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	118.9875	0.275	4	119.9830	0.374	22	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]N)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]N)(H){1|Pt<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	119.6220	0.000	1	119.9830	0.374	22	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]N)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]N)(H){1|Ru<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.1930	0.000	1	119.9830	0.374	22	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]O)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]O)(H){1|Cd<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<2>,2|C<3>}	H(C[6]C[6]2)	120.6845	0.306	2	120.3557	0.666	23	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]O)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]O)(H){1|Co<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<2>,2|C<3>}	H(C[6]C[6]2)	120.4450	0.639	2	120.3557	0.666	23	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]O)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]O)(H){1|Cu<3>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<2>,2|C<3>}	H(C[6]C[6]2)	121.1220	2.314	2	120.3557	0.666	23	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]O)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]O)(H){1|Cu<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<2>,2|C<3>}	H(C[6]C[6]2)	119.2837	0.316	3	120.3557	0.666	23	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]O)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]O)(H){1|Cu<5>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<2>,2|C<3>}	H(C[6]C[6]2)	120.6575	0.444	4	120.3557	0.666	23	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]O)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]O)(H){1|Mn<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<2>,2|C<3>}	H(C[6]C[6]2)	120.8000	0.000	1	120.3557	0.666	23	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]O)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]O)(H){1|Ni<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<2>,2|C<3>}	H(C[6]C[6]2)	120.3530	0.816	2	120.3557	0.666	23	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]O)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]O)(H){1|Ru<9>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<2>,2|C<3>}	H(C[6]C[6]2)	119.6540	0.000	1	120.3557	0.666	23	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]O)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]O)(H){1|Zn<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<2>,2|C<3>}	H(C[6]C[6]2)	120.5510	0.149	5	120.3557	0.666	23	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]O)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]O)(H){2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|O<1>,2|C<3>}	H(C[6]C[6]2)	119.2810	0.000	1	120.3557	0.666	23	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]Os)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]Os)(H){1|H<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Os<7>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	118.6295	0.021	2	118.6295	0.000	2	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]S)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]S)(H){1|H<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|S<1>,2|C<3>}	H(C[6]C[6]2)	119.3639	0.206	8	119.3639	0.042	8	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]Zr)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]Zr)(H){2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Zr<13>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.6200	0.000	1	119.6200	0.000	1	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]O[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]O[6]C)(H){2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|O<2>,3|C<3>}	H(C[6]C[6]2)	120.8130	3.079	4	120.8130	9.483	4	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]O[6]C)(H)	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]O[6]C)(H){2|C<3>}	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H){1|O<2>,4|C<3>}	H(C[6]C[6]2)	118.9600	0.120	2	118.9600	0.014	2	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]O[6]S)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]O[6]S)(H){2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|O<2>,1|S<1>,2|C<3>}	H(C[6]C[6]2)	120.3913	0.913	3	120.1850	0.726	4	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]O[6]S)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]O[6]S)(H){2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|O<2>,1|S<2>,2|C<3>}	H(C[6]C[6]2)	119.5660	0.000	1	120.1850	0.726	4	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]S[6]S)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]S[6]S)(H){2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|S<1>,1|S<2>,2|C<3>}	H(C[6]C[6]2)	118.4500	0.000	1	118.4500	0.000	1	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]Si[6]O)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]Si[6]O)(H){2|C<3>,2|C<4>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Si<4>,1|H<1>,1|O<1>,2|C<3>}	H(C[6]C[6]2)	117.7710	0.000	1	117.7710	0.000	1	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]N[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6,6a]H)(H){1|N<3>,4|C<3>}	C[6](C[6,6a]N[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,4|C<3>}	H(C[6]C[6]2)	119.8190	0.398	3	119.8190	0.158	3	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H){1|Ag<4>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	123.0210	0.000	1	119.8164	0.254	135	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H){1|Au<4>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	121.7060	0.000	1	119.8164	0.254	135	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H){1|Co<4>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	119.6788	0.404	6	119.8164	0.254	135	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H){1|Cr<6>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	119.7290	0.586	3	119.8164	0.254	135	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H){1|Cu<3>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.1083	0.311	3	119.8164	0.254	135	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H){1|Cu<4>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	119.9469	0.284	28	119.8164	0.254	135	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H){1|Fe<6>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	119.7105	0.384	4	119.8164	0.254	135	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H){1|H<1>,1|N<2>,3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.0630	0.407	2	119.8164	0.254	135	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H){1|H<1>,1|N<2>,3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	120.3450	0.000	1	119.8164	0.254	135	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H){1|H<1>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	119.6514	0.152	5	119.8164	0.254	135	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H){1|Ir<4>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.1977	0.385	3	119.8164	0.254	135	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H){1|Ir<5>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.1630	0.064	2	119.8164	0.254	135	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H){1|Ir<6>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.7360	0.406	2	119.8164	0.254	135	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H){1|Ir<6>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	119.7034	0.360	32	119.8164	0.254	135	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H){1|Ir<7>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	119.7350	0.595	2	119.8164	0.254	135	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H){1|Ir<8>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.3710	0.000	1	119.8164	0.254	135	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H){1|N<2>,1|O<1>,3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	119.3280	0.000	1	119.8164	0.254	135	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H){1|Ni<3>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	119.4986	0.141	7	119.8164	0.254	135	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H){1|Ni<4>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	119.6410	0.000	1	119.8164	0.254	135	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H){1|O<1>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	119.2137	0.278	3	119.8164	0.254	135	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H){1|Pd<4>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	119.7995	0.501	2	119.8164	0.254	135	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H){1|Pt<4>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	119.6088	0.288	9	119.8164	0.254	135	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H){1|Re<6>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.6405	0.276	2	119.8164	0.254	135	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H){1|Ru<6>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	119.5185	0.005	4	119.8164	0.254	135	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H){1|Zn<4>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.1503	0.134	3	119.8164	0.254	135	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H){1|Zn<5>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	119.8810	0.245	5	119.8164	0.254	135	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H){1|Zn<6>,1|N<2>,3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	118.8450	0.076	2	119.8164	0.254	135	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6a]N[6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6a]N[6])(C[6]C[6,6a]H)(H){1|Cd<6>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	120.6230	0.000	1	120.6230	0.000	1	120.2379	0.697	6057	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6,6]O)(C[6]C[6,6a]O)(H)	C[6](C[6,6a]C[6,6,6a]C[6a])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6,6]O)(C[6]C[6,6a]O)(H){2|C<3>,2|C<4>}	C[6](C[6,6a]C[6,6,6a]C[6a])(C[6]C[6]H)(O){1|C<4>,2|C<3>,2|O<2>}	H(C[6]C[6]2)	118.8690	0.000	1	118.8690	0.000	1	118.6023	1.129	182	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6]C[6a])(C[6]C[6,6a]O)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C[6a])(C[6]C[6,6a]O)(H){6|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(O){1|C<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	117.9065	0.204	2	117.9065	0.042	2	118.6023	1.129	182	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6,6a]O)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6,6a]O)(H){1|C<4>,1|O<1>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(O){1|C<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	118.6143	0.289	3	118.6143	0.083	3	118.6023	1.129	182	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6,6a]O)(H)	C[6](C[6,6a]C[6,6a,6a]C[6a])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6,6a]O)(H){1|N<2>,2|C<3>}	C[6](C[6,6a]C[6,6a,6a]C[6a])(C[6]C[6]H)(O){2|H<1>,3|C<3>}	H(C[6]C[6]2)	116.9615	3.263	2	118.4331	1.696	11	118.6023	1.129	182	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6,6a]O)(H)	C[6](C[6,6a]C[6,6a,6a]C[6a])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6,6a]O)(H){3|C<3>}	C[6](C[6,6a]C[6,6a,6a]C[6a])(C[6]C[6]H)(O){1|H<1>,1|I<1>,3|C<3>}	H(C[6]C[6]2)	118.2210	0.000	1	118.4331	1.696	11	118.6023	1.129	182	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6,6a]O)(H)	C[6](C[6,6a]C[6,6a,6a]C[6a])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6,6a]O)(H){3|C<3>}	C[6](C[6,6a]C[6,6a,6a]C[6a])(C[6]C[6]H)(O){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	118.9550	0.000	1	118.4331	1.696	11	118.6023	1.129	182	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6,6a]O)(H)	C[6](C[6,6a]C[6,6a,6a]C[6a])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6,6a]O)(H){3|C<3>}	C[6](C[6,6a]C[6,6a,6a]C[6a])(C[6]C[6]H)(O){1|H<1>,1|O<1>,3|C<3>}	H(C[6]C[6]2)	119.1970	0.000	1	118.4331	1.696	11	118.6023	1.129	182	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6,6a]O)(H)	C[6](C[6,6a]C[6,6a,6a]C[6a])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6,6a]O)(H){3|C<3>}	C[6](C[6,6a]C[6,6a,6a]C[6a])(C[6]C[6]H)(O){1|H<1>,1|O<2>,3|C<3>}	H(C[6]C[6]2)	118.6600	0.168	3	118.4331	1.696	11	118.6023	1.129	182	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6,6a]O)(H)	C[6](C[6,6a]C[6,6a,6a]C[6a])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6,6a]O)(H){3|C<3>}	C[6](C[6,6a]C[6,6a,6a]C[6a])(C[6]C[6]H)(O){2|H<1>,3|C<3>}	H(C[6]C[6]2)	118.8293	0.447	3	118.4331	1.696	11	118.6023	1.129	182	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[3,6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[3,6]H)(H){2|C<3>,2|C<4>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(O){1|C<4>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.3925	0.213	2	119.3925	0.045	2	118.6023	1.129	182	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[5,6]H)(H)	C[6](C[6,6a]C[5,6,6a]C[6a])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[5,6]H)(H){3|C<3>}	C[6](C[6,6a]C[5,6,6a]C[6a])(C[6]C[6]H)(O){1|H<1>,1|O<2>,3|C<3>}	H(C[6]C[6]2)	118.0496	0.347	5	118.0496	0.120	5	118.6023	1.129	182	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[5,6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[5,6]H)(H){1|C<4>,1|N<3>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(O){1|C<4>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	118.6785	0.383	2	118.8677	0.087	10	118.6023	1.129	182	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[5,6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[5,6]H)(H){1|C<4>,3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(O){1|C<4>,1|H<1>,1|O<2>,2|C<3>}	H(C[6]C[6]2)	118.5585	0.028	2	118.8677	0.087	10	118.6023	1.129	182	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[5,6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[5,6]H)(H){1|N<2>,3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(O){1|C<4>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	118.9650	0.053	4	118.8677	0.087	10	118.6023	1.129	182	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[5,6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[5,6]H)(H){4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(O){1|C<4>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.1715	0.383	2	118.8677	0.087	10	118.6023	1.129	182	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[5,6]O)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[5,6]O)(H){1|C<4>,1|O<2>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(O){1|C<4>,2|C<3>,2|O<2>}	H(C[6]C[6]2)	119.0880	0.000	1	119.0880	0.000	1	118.6023	1.129	182	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6,6]H)(H)	C[6](C[6,6a]C[6,6,6a]C[6a])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6,6]H)(H){2|C<3>,2|O<2>}	C[6](C[6,6a]C[6,6,6a]C[6a])(C[6]C[6]H)(O){1|C<4>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	118.2510	0.221	2	118.2510	0.049	2	118.6023	1.129	182	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6,6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6,6]H)(H){1|N<3>,3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(O){1|C<4>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	118.8130	0.000	1	118.8130	0.000	1	118.6023	1.129	182	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]2)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]2)(H){1|O<1>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(O){1|H<1>,4|C<3>}	H(C[6]C[6]2)	117.1210	0.000	1	117.1210	0.000	1	118.6023	1.129	182	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]Br)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]Br)(H){1|O<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(O){1|Br<1>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.2970	0.000	1	119.0565	0.116	2	118.6023	1.129	182	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]Br)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]Br)(H){1|O<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(O){1|Br<1>,1|I<1>,3|C<3>}	H(C[6]C[6]2)	118.8160	0.000	1	119.0565	0.116	2	118.6023	1.129	182	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]C)(H)	C[6](C[6,6a]C[6,6a]2)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]C)(H){1|O<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]2)(C[6]C[6]H)(O){1|C<4>,4|C<3>}	H(C[6]C[6]2)	117.6030	1.570	4	117.0727	3.695	7	118.6023	1.129	182	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]C)(H)	C[6](C[6,6a]C[6,6a]2)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]C)(H){1|O<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]2)(C[6]C[6]H)(O){2|C<4>,3|C<3>}	H(C[6]C[6]2)	116.3657	2.465	3	117.0727	3.695	7	118.6023	1.129	182	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]C)(H){1|O<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(O){1|C<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	118.4052	0.282	5	118.2463	0.193	9	118.6023	1.129	182	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]C)(H){1|O<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(O){1|C<4>,1|O<2>,3|C<3>}	H(C[6]C[6]2)	118.0400	0.143	2	118.2463	0.193	9	118.6023	1.129	182	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]C)(H){3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(O){1|C<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	118.0555	0.961	2	118.2463	0.193	9	118.6023	1.129	182	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]Cl)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]Cl)(H){1|O<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(O){1|Cl<1>,1|O<2>,3|C<3>}	H(C[6]C[6]2)	119.9700	0.000	1	119.9700	0.000	1	118.6023	1.129	182	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(H)	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(H){1|O<1>,2|C<3>}	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(O){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	118.8500	0.000	1	118.8500	0.000	1	118.6023	1.129	182	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(H)	C[6](C[6,6a]C[6,6a]2)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(H){1|O<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]2)(C[6]C[6]H)(O){1|H<1>,1|O<2>,3|C<3>}	H(C[6]C[6]2)	118.6530	0.000	1	118.6530	0.000	1	118.6023	1.129	182	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(O){2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.1250	0.000	1	118.8015	0.841	65	118.6023	1.129	182	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(O){1|H<1>,4|C<3>}	H(C[6]C[6]2)	119.0418	0.295	4	118.8015	0.841	65	118.6023	1.129	182	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(H){1|N<2>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(O){2|H<1>,3|C<3>}	H(C[6]C[6]2)	118.1900	0.000	1	118.8015	0.841	65	118.6023	1.129	182	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(H){1|O<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(O){1|Br<1>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	118.6810	0.000	1	118.8015	0.841	65	118.6023	1.129	182	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(H){1|O<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(O){1|Cl<1>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	118.6660	0.000	1	118.8015	0.841	65	118.6023	1.129	182	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(H){1|O<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(O){1|H<1>,1|I<1>,3|C<3>}	H(C[6]C[6]2)	118.8608	0.330	6	118.8015	0.841	65	118.6023	1.129	182	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(H){1|O<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(O){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	117.5485	2.427	2	118.8015	0.841	65	118.6023	1.129	182	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(H){1|O<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(O){1|H<1>,1|O<2>,3|C<3>}	H(C[6]C[6]2)	118.7249	1.156	9	118.8015	0.841	65	118.6023	1.129	182	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(H){1|O<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(O){1|H<1>,1|S<2>,3|C<3>}	H(C[6]C[6]2)	118.9928	0.265	6	118.8015	0.841	65	118.6023	1.129	182	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(H){1|O<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(O){1|H<1>,4|C<3>}	H(C[6]C[6]2)	119.2130	0.000	1	118.8015	0.841	65	118.6023	1.129	182	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(H){1|O<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(O){1|Se<2>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	118.8900	0.271	4	118.8015	0.841	65	118.6023	1.129	182	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(H){1|O<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(O){2|H<1>,3|C<3>}	H(C[6]C[6]2)	118.7973	1.069	27	118.8015	0.841	65	118.6023	1.129	182	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(H){2|C<3>,2|O<2>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(O){1|C<4>,1|H<1>,1|O<2>,2|C<3>}	H(C[6]C[6]2)	118.4300	0.000	1	118.8015	0.841	65	118.6023	1.129	182	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(H){3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(O){2|H<1>,3|C<3>}	H(C[6]C[6]2)	118.7970	0.000	1	118.8015	0.841	65	118.6023	1.129	182	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(H)	C[6](C[6,6a]C[6,6a]N[6a])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(H){1|C<3>,2|N<2>}	C[6](C[6,6a]C[6,6a]N[6a])(C[6]C[6]H)(O){1|H<1>,3|C<3>}	H(C[6]C[6]2)	118.9080	0.000	1	118.8920	0.001	2	118.6023	1.129	182	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(H)	C[6](C[6,6a]C[6,6a]N[6a])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(H){1|Cl<1>,1|C<3>,1|N<2>}	C[6](C[6,6a]C[6,6a]N[6a])(C[6]C[6]H)(O){1|H<1>,3|C<3>}	H(C[6]C[6]2)	118.8760	0.000	1	118.8920	0.001	2	118.6023	1.129	182	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(H)	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(H){1|O<1>,2|C<3>}	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(O){1|H<1>,4|C<3>}	H(C[6]C[6]2)	119.7180	0.542	2	119.7180	0.293	2	118.6023	1.129	182	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]I)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]I)(H){1|O<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(O){1|H<1>,1|I<1>,3|C<3>}	H(C[6]C[6]2)	118.8730	0.000	1	118.8730	0.000	1	118.6023	1.129	182	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]N)(H)	C[6](C[6,6a]C[5,6a]C[6,6a])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]N)(H){1|O<1>,2|C<3>}	C[6](C[6,6a]C[5,6a]C[6,6a])(C[6]C[6]H)(O){1|N<3>,4|C<3>}	H(C[6]C[6]2)	119.4135	0.591	6	119.4135	0.349	6	118.6023	1.129	182	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]N)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]N)(H){1|O<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(O){1|C<4>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	116.5560	0.000	1	118.7192	0.398	24	118.6023	1.129	182	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]N)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]N)(H){1|O<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(O){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	118.7811	0.338	14	118.7192	0.398	24	118.6023	1.129	182	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]N)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]N)(H){1|O<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(O){1|N<3>,1|O<2>,3|C<3>}	H(C[6]C[6]2)	119.1910	0.225	3	118.7192	0.398	24	118.6023	1.129	182	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]N)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]N)(H){1|O<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(O){1|N<3>,4|C<3>}	H(C[6]C[6]2)	118.8913	0.413	3	118.7192	0.398	24	118.6023	1.129	182	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]N)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]N)(H){1|O<2>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(O){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	118.5070	0.897	3	118.7192	0.398	24	118.6023	1.129	182	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]O)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]O)(H){1|O<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(O){1|H<1>,1|O<1>,3|C<3>}	H(C[6]C[6]2)	118.0045	0.162	2	118.5778	0.756	14	118.6023	1.129	182	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]O)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]O)(H){1|O<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(O){1|H<1>,1|O<2>,3|C<3>}	H(C[6]C[6]2)	119.0510	0.268	7	118.5778	0.756	14	118.6023	1.129	182	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]O)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]O)(H){1|O<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(O){2|O<2>,3|C<3>}	H(C[6]C[6]2)	118.9710	0.000	1	118.5778	0.756	14	118.6023	1.129	182	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]O)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]O)(H){1|O<2>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(O){1|H<1>,1|O<2>,3|C<3>}	H(C[6]C[6]2)	117.9380	1.337	4	118.5778	0.756	14	118.6023	1.129	182	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]S)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]S)(H){1|O<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(O){1|H<1>,1|S<2>,3|C<3>}	H(C[6]C[6]2)	118.4420	0.000	1	118.5205	0.012	2	118.6023	1.129	182	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]S)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]S)(H){1|O<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(O){1|O<2>,1|S<2>,3|C<3>}	H(C[6]C[6]2)	118.5990	0.000	1	118.5205	0.012	2	118.6023	1.129	182	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]S)(H)	C[6](C[6,6a]C[6,6a]N[6a])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]S)(H){1|C<3>,1|N<2>,1|O<1>}	C[6](C[6,6a]C[6,6a]N[6a])(C[6]C[6]H)(O){1|S<2>,3|C<3>}	H(C[6]C[6]2)	115.4670	3.177	3	115.4670	10.094	3	118.6023	1.129	182	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]Se)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]Se)(H){1|O<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(O){1|Se<2>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.1210	0.000	1	119.1210	0.000	1	118.6023	1.129	182	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]N[6]C)(H){2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(O){1|C<3>,2|C<4>,2|N<2>}	H(C[6]C[6]2)	118.7810	0.000	1	118.7810	0.000	1	118.6023	1.129	182	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6,6a]O)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6,6a]O)(H){1|O<1>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(O){1|O<2>,4|C<3>}	H(C[6]C[6]2)	118.4250	0.000	1	118.4250	0.000	1	118.6023	1.129	182	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]Br)(H)	C[6](C[6]C[6]H)2(Br)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]Br)(H){1|Tb<12>,1|C<3>,1|H<1>,1|N<2>,1|N<3>,1|O<3>}	C[6](C[6]C[6]H)2(Br){1|C<3>,1|C<4>,1|O<3>}	H(C[6]C[6]2)	120.5630	0.000	1	120.5630	0.000	1	120.5357	1.262	345	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]Br)(H)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(Br)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]Br)(H){1|C<3>,1|C<4>,1|O<1>}	C[6](C[6]C[6,6]O)(C[6]C[6]H)(Br){1|C<3>,1|C<4>,1|O<1>}	H(C[6]C[6]2)	119.7590	0.000	1	121.2653	5.444	3	120.5357	1.262	345	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]Br)(H)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(Br)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]Br)(H){1|C<3>,1|O<1>,1|O<2>}	C[6](C[6]C[6,6]O)(C[6]C[6]H)(Br){1|C<3>,1|C<4>,1|O<1>}	H(C[6]C[6]2)	120.0840	0.000	1	121.2653	5.444	3	120.5357	1.262	345	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]Br)(H)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(Br)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]Br)(H){1|H<1>,1|O<1>,2|C<4>}	C[6](C[6]C[6,6]O)(C[6]C[6]H)(Br){1|O<1>,3|C<4>}	H(C[6]C[6]2)	123.9530	0.000	1	121.2653	5.444	3	120.5357	1.262	345	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]Br)(H)	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(Br)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]Br)(H){1|O<1>,2|C<3>}	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(Br){1|O<1>,2|C<3>}	H(C[6]C[6]2)	119.0580	0.239	2	119.0580	0.057	2	120.5357	1.262	345	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(Br)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]C)(H){1|C<2>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(Br){1|C<3>,1|C<4>}	H(C[6]C[6]2)	124.5270	0.000	1	124.5270	0.000	1	120.5357	1.262	345	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(Br)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(Br){1|Br<1>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	118.4375	0.670	2	119.3339	2.238	9	120.5357	1.262	345	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(Br)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(Br){1|Br<1>,2|C<3>}	H(C[6]C[6]2)	119.1505	0.074	2	119.3339	2.238	9	120.5357	1.262	345	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(Br)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(Br){1|C<2>,1|C<3>,1|O<2>}	H(C[6]C[6]2)	120.9480	0.000	1	119.3339	2.238	9	120.5357	1.262	345	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(Br)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(Br){1|C<4>,2|C<3>}	H(C[6]C[6]2)	118.9590	0.048	2	119.3339	2.238	9	120.5357	1.262	345	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(Br)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]C)(H){1|C<3>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(Br){1|Br<1>,1|C<2>,1|C<4>}	H(C[6]C[6]2)	122.4360	0.000	1	119.3339	2.238	9	120.5357	1.262	345	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(Br)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]C)(H){1|C<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(Br){1|Br<1>,1|C<2>,1|C<4>}	H(C[6]C[6]2)	117.5270	0.000	1	119.3339	2.238	9	120.5357	1.262	345	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(Br)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]C)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(Br){1|C<4>,2|C<3>}	H(C[6]C[6]2)	120.6835	0.180	2	120.6835	0.033	2	120.5357	1.262	345	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Br)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]C)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Br){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.7880	0.000	1	120.7850	0.000	2	120.5357	1.262	345	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Br)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]C)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Br){1|Zn<6>,2|C<3>}	H(C[6]C[6]2)	120.7820	0.000	1	120.7850	0.000	2	120.5357	1.262	345	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(Br)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(Br){1|Br<1>,2|C<3>}	H(C[6]C[6]2)	120.1613	0.384	7	120.1110	0.388	31	120.5357	1.262	345	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(Br)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(Br){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.7890	0.000	1	120.1110	0.388	31	120.5357	1.262	345	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(Br)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(Br){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.2091	1.091	8	120.1110	0.388	31	120.5357	1.262	345	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(Br)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(Br){1|O<2>,2|C<3>}	H(C[6]C[6]2)	120.5380	0.208	2	120.1110	0.388	31	120.5357	1.262	345	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(Br)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]C)(H){1|Dy<16>,1|C<3>,1|H<1>,1|O<3>}	C[6](C[6]C[6]H)2(Br){3|C<4>}	H(C[6]C[6]2)	119.8797	0.273	12	120.1110	0.388	31	120.5357	1.262	345	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(Br)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]C)(H){1|Zr<7>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(Br){1|Br<1>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	120.2180	0.000	1	120.1110	0.388	31	120.5357	1.262	345	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]Cl)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(Br)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]Cl)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(Br){1|Cl<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5260	0.000	1	120.5260	0.000	1	120.5357	1.262	345	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(Br)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(Br){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1320	0.000	1	120.1320	0.000	1	120.5357	1.262	345	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Br)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]H)(H){1|Br<1>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Br){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.6310	0.363	3	120.6786	0.340	103	120.5357	1.262	345	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Br)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]H)(H){1|Br<1>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Br){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8490	0.000	1	120.6786	0.340	103	120.5357	1.262	345	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Br)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Br){1|Ir<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1888	0.895	6	120.6786	0.340	103	120.5357	1.262	345	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Br)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Br){1|Re<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.8160	0.543	2	120.6786	0.340	103	120.5357	1.262	345	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Br)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Br){1|Ru<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.9795	0.486	2	120.6786	0.340	103	120.5357	1.262	345	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Br)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Br){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	121.2850	0.110	2	120.6786	0.340	103	120.5357	1.262	345	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Br)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Br){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.1968	0.201	5	120.6786	0.340	103	120.5357	1.262	345	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Br)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Br){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.9414	0.498	5	120.6786	0.340	103	120.5357	1.262	345	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Br)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]H)(H){1|H<1>,1|I<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Br){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.2700	0.000	1	120.6786	0.340	103	120.5357	1.262	345	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Br)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Br){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3730	0.003	2	120.6786	0.340	103	120.5357	1.262	345	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Br)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Br){1|Os<9>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.0320	0.292	3	120.6786	0.340	103	120.5357	1.262	345	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Br)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Br){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1072	0.140	16	120.6786	0.340	103	120.5357	1.262	345	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Br)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Br){1|Re<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3060	0.000	1	120.6786	0.340	103	120.5357	1.262	345	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Br)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Br){1|Zn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4030	0.000	1	120.6786	0.340	103	120.5357	1.262	345	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Br)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Br){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.8458	0.276	15	120.6786	0.340	103	120.5357	1.262	345	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Br)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Br){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	121.7412	1.239	4	120.6786	0.340	103	120.5357	1.262	345	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Br)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Br){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5536	0.422	25	120.6786	0.340	103	120.5357	1.262	345	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Br)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Br){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.1050	0.000	1	120.6786	0.340	103	120.5357	1.262	345	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Br)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Br){1|Cu<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.0060	0.000	1	120.6786	0.340	103	120.5357	1.262	345	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Br)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Br){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.4030	0.000	1	120.6786	0.340	103	120.5357	1.262	345	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Br)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Br){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.0175	0.187	2	120.6786	0.340	103	120.5357	1.262	345	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Br)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Br){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.2327	0.141	3	120.6786	0.340	103	120.5357	1.262	345	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Br)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Br){1|Pt<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.8880	0.000	1	120.6786	0.340	103	120.5357	1.262	345	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(Br)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(Br){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9680	0.000	1	120.8037	103.556	3	120.5357	1.262	345	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(Br)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]H)(H){1|N<3>,2|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]N)(Br){1|C<3>,2|H<1>}	H(C[6]C[6]2)	121.2215	14.355	2	120.8037	103.556	3	120.5357	1.262	345	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(Br)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]H)(H){1|C<2>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(Br){1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3170	0.000	1	119.6981	2.184	12	120.5357	1.262	345	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(Br)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(Br){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.6860	0.000	1	119.6981	2.184	12	120.5357	1.262	345	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(Br)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(Br){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.3194	1.670	8	119.6981	2.184	12	120.5357	1.262	345	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(Br)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(Br){1|C<2>,2|H<1>}	H(C[6]C[6]2)	120.4095	0.995	2	119.6981	2.184	12	120.5357	1.262	345	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(Br)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(Br){1|Br<1>,1|C<3>,1|N<3>}	H(C[6]C[6]2)	120.2485	0.206	2	120.2485	0.042	2	120.5357	1.262	345	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(Br)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]O)(H){1|O<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]C[6]O)(Br){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	119.4430	0.000	1	119.4430	0.000	1	120.5357	1.262	345	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(Br)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(Br){1|O<2>,2|C<3>}	H(C[6]C[6]2)	120.3560	0.075	2	120.4120	0.012	3	120.5357	1.262	345	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(Br)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]O)(H){1|Tb<12>,1|C<3>,1|H<1>,1|O<3>}	C[6](C[6]C[6]H)2(Br){1|C<3>,1|C<4>,1|O<3>}	H(C[6]C[6]2)	120.5240	0.000	1	120.4120	0.012	3	120.5357	1.262	345	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]S)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(Br)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]S)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(Br){1|Br<1>,1|C<3>,1|S<4>}	H(C[6]C[6]2)	120.4820	0.393	7	120.2555	0.543	8	120.5357	1.262	345	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]S)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(Br)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]S)(H){1|C<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(Br){1|Br<1>,1|C<2>,1|S<4>}	H(C[6]C[6]2)	118.6700	0.000	1	120.2555	0.543	8	120.5357	1.262	345	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(Br)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|U<9>}	C[6](C[6]C[6]H)2(Br){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.0790	0.000	1	120.7987	0.168	77	120.5357	1.262	345	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(Br)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(Br){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.7049	0.441	46	120.7987	0.168	77	120.5357	1.262	345	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(Br)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(Br){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.9153	0.294	20	120.7987	0.168	77	120.5357	1.262	345	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(Br)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(Br){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.1420	0.000	1	120.7987	0.168	77	120.5357	1.262	345	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(Br)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(Br){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7235	0.202	2	120.7987	0.168	77	120.5357	1.262	345	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(Br)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(Br){1|N<3>,2|H<1>}	H(C[6]C[6]2)	121.2490	0.396	2	120.7987	0.168	77	120.5357	1.262	345	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(Br)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(Br){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.9210	0.462	5	120.7987	0.168	77	120.5357	1.262	345	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)2(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(Br)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)2(H){1|C<3>,1|N<3>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]N)(Br){1|Br<1>,2|C<3>}	H(C[6]C[6]2)	119.9040	0.000	1	119.9040	0.000	1	120.5357	1.262	345	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(Br)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)2(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(Br){1|Br<1>,2|C<3>}	H(C[6]C[6]2)	119.9779	0.735	7	119.9648	0.465	8	120.5357	1.262	345	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(Br)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)2(H){1|C<3>,1|N<3>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(Br){1|Br<1>,2|C<3>}	H(C[6]C[6]2)	119.8730	0.000	1	119.9648	0.465	8	120.5357	1.262	345	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Br)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)2(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Br){1|Br<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2400	0.000	1	120.9986	0.346	39	120.5357	1.262	345	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Br)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Br){1|Br<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8543	0.348	3	120.9986	0.346	39	120.5357	1.262	345	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Br)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Br){1|Br<1>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	121.1143	0.603	14	120.9986	0.346	39	120.5357	1.262	345	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Br)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Br){1|Br<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.8090	0.057	3	120.9986	0.346	39	120.5357	1.262	345	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Br)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Br){1|Br<1>,1|Co<6>,1|C<3>}	H(C[6]C[6]2)	121.1732	0.409	18	120.9986	0.346	39	120.5357	1.262	345	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(Br)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)2(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(Br){1|Br<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3760	0.000	1	119.5248	0.180	17	120.5357	1.262	345	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(Br)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(Br){1|Br<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8570	0.454	3	119.5248	0.180	17	120.5357	1.262	345	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(Br)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)2(H){3|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(Br){1|Br<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.3826	0.309	13	119.5248	0.180	17	120.5357	1.262	345	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)2(H)	C[6](C[6]C[6]H)2(Br)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)2(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(Br){1|Br<1>,2|C<3>}	H(C[6]C[6]2)	120.4107	0.485	7	120.4564	0.219	8	120.5357	1.262	345	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)2(H)	C[6](C[6]C[6]H)2(Br)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)2(H){1|Zr<7>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(Br){1|Br<1>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	120.7760	0.000	1	120.4564	0.219	8	120.5357	1.262	345	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]Br)(H)	C[6](C[6]C[6]H)2(Br)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]Br)(H){1|Cu<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(Br){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.1130	0.000	1	120.9217	0.113	10	120.5357	1.262	345	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]Br)(H)	C[6](C[6]C[6]H)2(Br)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]Br)(H){1|Cu<5>,1|C<3>,1|C<4>,1|N<4>,2|H<1>}	C[6](C[6]C[6]H)2(Br){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.2065	0.161	2	120.9217	0.113	10	120.5357	1.262	345	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]Br)(H)	C[6](C[6]C[6]H)2(Br)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]Br)(H){1|H<1>,1|N<3>,1|U<9>,2|C<3>}	C[6](C[6]C[6]H)2(Br){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5875	0.028	2	120.9217	0.113	10	120.5357	1.262	345	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]Br)(H)	C[6](C[6]C[6]H)2(Br)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]Br)(H){1|Pt<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(Br){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.9032	0.375	5	120.9217	0.113	10	120.5357	1.262	345	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[5,6]Cl)(C[6]C[6]Cl)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(Cl)	H(C[6]C[6]2)	C[6](C[6]C[5,6]Cl)(C[6]C[6]Cl)(H){1|H<1>,2|N<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(Cl){1|Cl<1>,2|C<3>}	H(C[6]C[6]2)	119.9300	0.000	1	119.9300	0.000	1	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]Cl)(H)	C[6](C[6]C[6]H)2(Cl)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]Cl)(H){1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(Cl){1|C<4>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	117.6150	0.000	1	117.6150	0.000	1	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[5,6]O)(C[6]C[6]Cl)(H)	C[6](C[6]C[6]H)2(Cl)	H(C[6]C[6]2)	C[6](C[6]C[5,6]O)(C[6]C[6]Cl)(H){1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(Cl){1|C<4>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	122.8550	0.000	1	122.8550	0.000	1	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]Cl)(H)	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]Cl)(H){1|O<1>,2|C<3>}	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(Cl){1|O<1>,2|C<3>}	H(C[6]C[6]2)	119.9240	0.000	1	119.9240	0.000	1	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]Cl)(H)	C[6](C[6]C[6]H)2(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]Cl)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(Cl){1|Br<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3870	0.000	1	120.3870	0.000	1	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]C)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]C)(H){1|C<3>,1|C<4>,1|O<1>}	C[6](C[6]C[6]C)(C[6]C[6]H)(Cl){1|H<1>,2|C<3>}	H(C[6]C[6]2)	117.5820	1.772	2	117.5820	3.140	2	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(Cl){1|Cl<1>,2|C<3>}	H(C[6]C[6]2)	119.2844	0.188	16	119.2844	0.035	16	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(Cl){1|Cl<1>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	119.9040	0.000	1	120.2736	0.914	16	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(Cl){1|Cl<1>,2|C<3>}	H(C[6]C[6]2)	120.4662	1.043	6	120.2736	0.914	16	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(Cl){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.2003	1.141	7	120.2736	0.914	16	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]C)(H){1|Zr<7>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(Cl){1|Cl<1>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	120.1375	0.138	2	120.2736	0.914	16	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]F)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]F)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(Cl){1|C<3>,1|F<1>,1|H<1>}	H(C[6]C[6]2)	121.1700	0.385	4	121.1700	0.148	4	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|Cl<1>,1|C<3>,1|O<1>}	C[6](C[6]C[6]Cl)(C[6]C[6]H)(Cl){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.2655	0.151	2	119.2655	0.023	2	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(Cl){1|Cl<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	116.8610	0.000	1	118.4400	4.986	2	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|Cl<1>,1|C<3>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(Cl){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0190	0.000	1	118.4400	4.986	2	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|C<3>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(Cl){1|Cd<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.5480	0.000	1	119.5576	0.007	5	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|C<3>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(Cl){1|Cu<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.4920	0.085	2	119.5576	0.007	5	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|C<3>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(Cl){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.6280	0.041	2	119.5576	0.007	5	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Cl){1|Re<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7207	0.545	3	120.6918	0.716	101	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Cl){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.9700	0.071	2	120.6918	0.716	101	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Cl){1|Os<9>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.9085	0.354	2	120.6918	0.716	101	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Cl){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5328	0.301	6	120.6918	0.716	101	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Cl){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8313	1.350	21	120.6918	0.716	101	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Cl){1|B<3>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.2730	0.000	1	120.6918	0.716	101	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Cl){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.8987	0.285	3	120.6918	0.716	101	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Cl){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4841	0.411	16	120.6918	0.716	101	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Cl){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.2765	0.238	2	120.6918	0.716	101	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Cl){1|Cu<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.9360	0.375	2	120.6918	0.716	101	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Cl){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.2422	0.073	4	120.6918	0.716	101	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Cl){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.2946	0.097	7	120.6918	0.716	101	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Cl){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.1157	0.418	25	120.6918	0.716	101	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Cl){1|Ru<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.1030	0.000	1	120.6918	0.716	101	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Cl){1|Zn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.9644	0.068	5	120.6918	0.716	101	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|Y<15>,1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Cl){1|Y<15>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.3130	0.000	1	120.6918	0.716	101	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|C<2>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(Cl){1|C<3>,1|H<1>}	H(C[6]C[6]2)	113.3870	0.000	1	120.3087	7.727	17	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|C<2>,1|H<1>,1|P<4>}	C[6](C[6]C[6]H)2(Cl){1|C<3>,1|H<1>}	H(C[6]C[6]2)	127.4160	0.000	1	120.3087	7.727	17	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(Cl){1|Br<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0070	0.000	1	120.3087	7.727	17	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(Cl){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.6720	0.000	1	120.3087	7.727	17	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(Cl){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2055	0.425	2	120.3087	7.727	17	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(Cl){1|Cl<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0915	0.087	2	120.3087	7.727	17	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(Cl){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.0447	1.894	7	120.3087	7.727	17	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|Cl<1>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(Cl){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	121.2310	0.000	1	120.3087	7.727	17	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|H<1>,2|C<2>}	C[6](C[6]C[6]H)2(Cl){1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6280	0.000	1	120.3087	7.727	17	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	C[6](C[6]N[6a]C[6])(C[6]C[6]H)(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|C<3>,1|N<3>}	C[6](C[6]N[6a]C[6])(C[6]C[6]H)(Cl){1|C<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.6840	0.000	1	119.6840	0.000	1	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(Cl){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.2890	0.000	1	119.9055	3.828	2	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(Cl){1|Cl<1>,1|C<3>,1|N<2>}	H(C[6]C[6]2)	118.5220	0.000	1	119.9055	3.828	2	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]Ni)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]Ni)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Cl){2|Ni<4>,1|C<3>}	H(C[6]C[6]2)	120.4420	0.000	1	120.4420	0.000	1	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]O)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]O)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(Cl){1|Cl<1>,1|C<3>,1|O<1>}	H(C[6]C[6]2)	119.7680	0.206	4	119.7680	0.043	4	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]O)(H)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]O)(H){1|Cl<1>,1|C<3>,1|H<1>}	C[6](C[6]C[6]Cl)(C[6]C[6]H)(Cl){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	119.9675	0.292	2	119.9675	0.085	2	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(Cl){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	119.5730	0.000	1	119.5730	0.000	1	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]O)(H){1|Cl<1>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(Cl){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	119.9030	0.000	1	119.9030	0.000	1	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]S)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]S)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(Cl){1|Cl<1>,1|C<3>,1|S<4>}	H(C[6]C[6]2)	120.5181	0.342	8	120.5181	0.117	8	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]N[6]C)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(Cl){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.1080	0.000	1	121.0288	0.161	19	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]N[6]C)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(Cl){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7425	0.332	2	121.0288	0.161	19	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]N[6]C)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(Cl){1|N<3>,2|C<3>}	H(C[6]C[6]2)	121.4820	0.106	2	121.0288	0.161	19	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(Cl){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7150	0.000	1	121.0288	0.161	19	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(Cl){1|N<3>,2|C<4>}	H(C[6]C[6]2)	120.9817	0.242	3	121.0288	0.161	19	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]N[6]C)(H){1|Mn<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(Cl){1|N<3>,2|C<3>}	H(C[6]C[6]2)	121.1555	0.295	2	121.0288	0.161	19	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]N[6]C)(H){1|Ni<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(Cl){1|N<3>,2|C<3>}	H(C[6]C[6]2)	121.6675	0.501	2	121.0288	0.161	19	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]N[6]C)(H){1|Ni<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(Cl){1|N<3>,2|C<4>}	H(C[6]C[6]2)	121.0085	0.296	2	121.0288	0.161	19	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(Cl){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3460	0.000	1	121.0288	0.161	19	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]N[6]C)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(Cl){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7737	0.125	3	121.0288	0.161	19	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]S)(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|S<4>}	C[6](C[6]C[6]H)(C[6]C[6]S)(Cl){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.7610	0.000	1	120.7610	0.000	1	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(Cl){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.9212	0.312	129	120.9198	0.091	153	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(Cl){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.1040	0.000	1	120.9198	0.091	153	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(Cl){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.6887	0.104	4	120.9198	0.091	153	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]N[6]H)(H){1|Cu<2>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(Cl){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.9635	0.088	2	120.9198	0.091	153	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(Cl){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.3320	0.270	2	120.9198	0.091	153	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(Cl){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.9700	0.033	2	120.9198	0.091	153	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(Cl){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.2540	0.000	1	120.9198	0.091	153	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(Cl){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5240	0.000	1	120.9198	0.091	153	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]N[6]H)(H){1|Os<9>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(Cl){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.7150	0.000	1	120.9198	0.091	153	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(Cl){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.9225	0.129	2	120.9198	0.091	153	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(Cl){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6823	0.071	3	120.9198	0.091	153	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(Cl){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.8450	0.178	2	120.9198	0.091	153	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(Cl){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.1200	0.000	1	120.9198	0.091	153	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(Cl){1|N<3>,2|H<1>}	H(C[6]C[6]2)	121.1575	0.059	2	120.9198	0.091	153	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)2(H)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)2(H){2|Cl<1>,1|C<3>}	C[6](C[6]C[6]Cl)(C[6]C[6]H)(Cl){1|Cl<1>,1|C<3>,1|O<1>}	H(C[6]C[6]2)	120.8605	0.061	4	120.8605	0.004	4	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)2(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(Cl){1|Cl<1>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	121.1320	0.000	1	120.2086	1.373	13	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)2(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(Cl){1|Cl<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1825	0.416	2	120.2086	1.373	13	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)2(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(Cl){1|Cl<1>,1|C<3>,1|N<2>}	H(C[6]C[6]2)	118.2660	0.000	1	120.2086	1.373	13	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)2(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(Cl){1|Cl<1>,2|C<3>}	H(C[6]C[6]2)	120.2058	1.484	6	120.2086	1.373	13	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)2(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(Cl){2|Cl<1>,1|C<3>}	H(C[6]C[6]2)	120.5713	0.362	3	120.2086	1.373	13	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)2(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Cl){1|Cl<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4520	0.000	1	120.8227	1.126	33	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Cl){1|Cl<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0880	0.472	2	120.8227	1.126	33	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Cl){1|Cl<1>,1|Cu<5>,1|C<3>}	H(C[6]C[6]2)	121.3710	0.000	1	120.8227	1.126	33	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Cl){1|Cl<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7456	1.145	25	120.8227	1.126	33	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Cl){1|Cl<1>,1|Co<6>,1|C<3>}	H(C[6]C[6]2)	121.6270	0.162	4	120.8227	1.126	33	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)2(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(Cl){1|Cl<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4530	0.000	1	120.7832	0.182	4	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(Cl){1|Cl<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6985	0.416	2	120.7832	0.182	4	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(Cl){1|Cl<1>,1|Cu<5>,1|C<3>}	H(C[6]C[6]2)	121.2830	0.000	1	120.7832	0.182	4	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)2(H)	C[6](C[6]C[6]H)(C[6]N[6]O)(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)2(H){1|Cl<1>,1|N<2>,1|O<1>}	C[6](C[6]C[6]H)(C[6]N[6]O)(Cl){1|Cl<1>,1|C<3>}	H(C[6]C[6]2)	120.2575	0.161	2	120.2575	0.026	2	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)2(H)	C[6](C[6]C[6]H)2(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)2(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(Cl){1|Cl<1>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	121.1600	0.000	1	120.4389	1.467	15	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)2(H)	C[6](C[6]C[6]H)2(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)2(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(Cl){1|Cl<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3080	0.277	2	120.4389	1.467	15	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)2(H)	C[6](C[6]C[6]H)2(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)2(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(Cl){1|Cl<1>,1|C<3>,1|N<2>}	H(C[6]C[6]2)	122.4200	0.000	1	120.4389	1.467	15	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)2(H)	C[6](C[6]C[6]H)2(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)2(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(Cl){1|Cl<1>,2|C<3>}	H(C[6]C[6]2)	119.9927	1.698	6	120.4389	1.467	15	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)2(H)	C[6](C[6]C[6]H)2(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)2(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(Cl){2|Cl<1>,1|C<3>}	H(C[6]C[6]2)	120.6330	0.325	3	120.4389	1.467	15	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)2(H)	C[6](C[6]C[6]H)2(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)2(H){1|Zr<7>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(Cl){1|Cl<1>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	120.2660	0.010	2	120.4389	1.467	15	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)2(H)	C[6](C[6]N[6]Cl)(C[6]C[6]H)(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)2(H){1|Cl<1>,1|N<2>,1|O<1>}	C[6](C[6]N[6]Cl)(C[6]C[6]H)(Cl){1|Cl<1>,1|C<3>}	H(C[6]C[6]2)	120.1540	0.116	2	120.1540	0.013	2	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]Cl)(H)	C[6](C[6]C[6]H)2(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]Cl)(H){1|Al<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(Cl){1|N<3>,2|C<3>}	H(C[6]C[6]2)	121.4075	0.105	2	121.4366	1.249	27	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]Cl)(H)	C[6](C[6]C[6]H)2(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]Cl)(H){1|Co<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(Cl){1|N<3>,2|C<3>}	H(C[6]C[6]2)	121.8667	2.012	8	121.4366	1.249	27	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]Cl)(H)	C[6](C[6]C[6]H)2(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]Cl)(H){1|Cu<5>,1|C<3>,1|C<4>,1|N<4>,2|H<1>}	C[6](C[6]C[6]H)2(Cl){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.2830	0.188	2	121.4366	1.249	27	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]Cl)(H)	C[6](C[6]C[6]H)2(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]Cl)(H){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(Cl){1|N<3>,2|C<3>}	H(C[6]C[6]2)	121.2325	0.145	2	121.4366	1.249	27	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]Cl)(H)	C[6](C[6]C[6]H)2(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]Cl)(H){1|Pt<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(Cl){1|N<3>,2|C<3>}	H(C[6]C[6]2)	121.2028	0.264	6	121.4366	1.249	27	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]Cl)(H)	C[6](C[6]C[6]H)2(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]Cl)(H){1|Ru<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(Cl){1|N<3>,2|C<3>}	H(C[6]C[6]2)	121.2557	0.508	7	121.4366	1.249	27	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]Cl)(H)	C[6](C[6]C[6]H)2(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]Cl)(H){1|Ru<6>,1|H<1>,1|N<2>,2|C<3>}	C[6](C[6]C[6]H)2(Cl){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.8450	0.000	1	120.3590	0.472	2	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]Cl)(H)	C[6](C[6]C[6]H)2(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]Cl)(H){1|Ru<6>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(Cl){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8730	0.000	1	120.3590	0.472	2	120.6640	1.033	465	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:F-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]F)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(F)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]F)(H){1|H<1>,2|N<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(F){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4430	0.000	1	120.4430	0.000	1	120.8934	1.323	46	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:F-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(C[6]C[6]F)(H)	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(F)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)(C[6]C[6]F)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(F){1|H<1>,2|C<3>}	H(C[6]C[6]2)	117.6530	0.000	1	117.6530	0.000	1	120.8934	1.323	46	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:F-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]F)(H)	C[6](C[6]C[6]F)(C[6]C[6]H)(F)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]F)(H){1|C<2>,2|F<1>}	C[6](C[6]C[6]F)(C[6]C[6]H)(F){1|C<3>,1|C<4>}	H(C[6]C[6]2)	125.1200	0.000	1	125.1200	0.000	1	120.8934	1.323	46	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:F-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]F)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(F)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]F)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(F){1|Co<6>,2|C<3>}	H(C[6]C[6]2)	121.3100	0.000	1	121.3100	0.000	1	120.8934	1.323	46	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:F-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]F)(H)	C[6](C[6]C[6]H)2(F)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]F)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(F){1|Cl<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.1080	0.450	4	121.1080	0.202	4	120.8934	1.323	46	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:F-1:	C[6]-3:	C[6](C[6]C[6]F)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(F)	H(C[6]C[6]2)	C[6](C[6]C[6]F)(C[6]C[6]H)(H){1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(F){1|C<2>,1|F<1>,1|H<1>}	H(C[6]C[6]2)	117.3810	0.000	1	119.1000	5.910	2	120.8934	1.323	46	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:F-1:	C[6]-3:	C[6](C[6]C[6]F)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(F)	H(C[6]C[6]2)	C[6](C[6]C[6]F)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(F){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	120.8190	0.000	1	119.1000	5.910	2	120.8934	1.323	46	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:F-1:	C[6]-3:	C[6](C[6]C[6]F)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(F)	H(C[6]C[6]2)	C[6](C[6]C[6]F)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(F){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.8300	0.000	1	119.8300	0.000	1	120.8934	1.323	46	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:F-1:	C[6]-3:	C[6](C[6]C[6]F)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(F)	H(C[6]C[6]2)	C[6](C[6]C[6]F)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(F){1|Ru<9>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.3374	0.244	5	121.3384	0.036	11	120.8934	1.323	46	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:F-1:	C[6]-3:	C[6](C[6]C[6]F)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(F)	H(C[6]C[6]2)	C[6](C[6]C[6]F)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(F){1|Zn<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.4640	0.000	1	121.3384	0.036	11	120.8934	1.323	46	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:F-1:	C[6]-3:	C[6](C[6]C[6]F)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(F)	H(C[6]C[6]2)	C[6](C[6]C[6]F)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(F){1|Os<9>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.3700	0.000	1	121.3384	0.036	11	120.8934	1.323	46	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:F-1:	C[6]-3:	C[6](C[6]C[6]F)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(F)	H(C[6]C[6]2)	C[6](C[6]C[6]F)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(F){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	121.2670	0.000	1	121.3384	0.036	11	120.8934	1.323	46	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:F-1:	C[6]-3:	C[6](C[6]C[6]F)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(F)	H(C[6]C[6]2)	C[6](C[6]C[6]F)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(F){1|Zn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.3113	0.226	3	121.3384	0.036	11	120.8934	1.323	46	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:F-1:	C[6]-3:	C[6](C[6]C[6]F)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(F)	H(C[6]C[6]2)	C[6](C[6]C[6]F)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(F){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.7875	1.187	2	120.6990	0.452	6	120.8934	1.323	46	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:F-1:	C[6]-3:	C[6](C[6]C[6]F)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(F)	H(C[6]C[6]2)	C[6](C[6]C[6]F)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(F){1|Cl<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6547	0.525	4	120.6990	0.452	6	120.8934	1.323	46	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:F-1:	C[6]-3:	C[6](C[6]C[6]F)(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(F)	H(C[6]C[6]2)	C[6](C[6]C[6]F)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(F){1|Ru<9>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.7552	0.235	6	120.7552	0.055	6	120.8934	1.323	46	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:F-1:	C[6]-3:	C[6](C[6]C[6]F)(C[6]C[6]H)(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(F)	H(C[6]C[6]2)	C[6](C[6]C[6]F)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(F){1|Pt<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.2400	0.632	2	120.2400	0.400	2	120.8934	1.323	46	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:F-1:	C[6]-3:	C[6](C[6]C[6]F)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(F)	H(C[6]C[6]2)	C[6](C[6]C[6]F)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(F){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.2205	0.370	2	121.2205	0.137	2	120.8934	1.323	46	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:F-1:	C[6]-3:	C[6](C[6]C[6]F)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(F)	H(C[6]C[6]2)	C[6](C[6]C[6]F)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(F){1|Zn<6>,1|C<3>,1|F<1>}	H(C[6]C[6]2)	121.9390	0.338	2	121.9390	0.114	2	120.8934	1.323	46	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:F-1:	C[6]-3:	C[6](C[6]C[6]F)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(F)	H(C[6]C[6]2)	C[6](C[6]C[6]F)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(F){1|Zn<6>,1|C<3>,1|F<1>}	H(C[6]C[6]2)	121.9420	0.337	2	121.9420	0.113	2	120.8934	1.323	46	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:F-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]F)(H)	C[6](C[6]C[6]H)2(F)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]F)(H){1|Ir<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(F){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3710	0.226	2	120.3710	0.051	2	120.8934	1.323	46	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:F-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]F)(H)	C[6](C[6]C[6]H)2(F)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]F)(H){1|H<1>,1|O<1>,3|C<3>}	C[6](C[6]C[6]H)2(F){3|C<3>}	H(C[6]C[6]2)	119.6185	1.025	2	119.6185	1.050	2	120.8934	1.323	46	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]As[6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]As[6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|W<6>}	C[6](C[6]C[6]H)2(H){1|As<3>,2|H<1>}	H(C[6]C[6]2)	117.4072	0.429	11	117.4072	0.184	11	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]B[5x3,5x5,20x6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]B[5x3,5x5,20x6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|C<6>,1|H<1>,4|B<6>}	C[6](C[6]C[6]H)2(H){1|Ir<8>,1|B<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	118.5580	0.000	1	118.5580	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]B[6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]B[6]C[6])(C[6]C[6]H)(H){1|B<3>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|B<3>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	117.9870	2.517	2	117.9870	6.337	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]B[6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]B[6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|B<3>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8060	0.000	1	119.1051	1.029	14	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]B[6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]B[6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|B<3>,2|H<1>}	H(C[6]C[6]2)	118.8730	0.000	1	119.1051	1.029	14	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]B[6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]B[6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<3>}	C[6](C[6]C[6]H)2(H){1|B<3>,2|H<1>}	H(C[6]C[6]2)	119.6160	1.682	4	119.1051	1.029	14	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]B[6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]B[6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<4>}	C[6](C[6]C[6]H)2(H){1|B<3>,2|H<1>}	H(C[6]C[6]2)	118.8480	0.904	4	119.1051	1.029	14	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]B[6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]B[6]H)(C[6]C[6]H)(H){1|Pt<6>,1|C<3>,1|H<1>,1|P<4>}	C[6](C[6]C[6]H)2(H){1|Pt<6>,1|B<4>,1|H<1>}	H(C[6]C[6]2)	118.7100	0.000	1	119.1051	1.029	14	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]B[6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]B[6]H)(C[6]C[6]H)(H){1|Pt<6>,1|C<4>,1|H<1>,1|P<4>}	C[6](C[6]C[6]H)2(H){1|Pt<6>,1|B<4>,2|H<1>}	H(C[6]C[6]2)	118.7420	0.116	3	119.1051	1.029	14	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]B[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]B[6]N[6])(C[6]C[6]H)(H){1|Ir<8>,1|C<3>,1|H<1>,1|O<3>,2|O<2>}	C[6](C[6]C[6]H)2(H){1|B<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.4420	0.133	2	119.4420	0.018	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]B[6]Pt)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]B[6]Pt)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<4>}	C[6](C[6]C[6]H)2(H){1|Pt<6>,1|B<4>,1|H<1>}	H(C[6]C[6]2)	119.1910	0.000	1	119.1910	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]B[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]B[6a]C[6])(C[6]C[6]H)(H){1|N<3>,2|H<1>,3|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	118.8847	0.173	3	118.8847	0.030	3	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[3,5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[3,5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[3,5,6]H)(C[6]C[6]H)(H){1|H<1>,3|C<4>}	C[6](C[6]C[3,5,6]H)(C[6]C[6]H)(H){1|H<1>,3|C<4>}	H(C[6]C[6]2)	118.9540	0.075	2	118.9540	0.006	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[3,6]C)(C[6]C[6]H)(H)	C[6](C[6]C[3,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[3,6]C)(C[6]C[6]H)(H){2|C<4>,2|H<1>}	C[6](C[6]C[3,6]H)(C[6]C[6]H)(H){1|H<1>,3|C<4>}	H(C[6]C[6]2)	119.1380	0.000	1	119.1380	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[3,6]C)(C[6]C[6]H)(H)	C[6](C[6]C[3,6]O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[3,6]C)(C[6]C[6]H)(H){1|H<1>,1|O<2>,2|C<4>}	C[6](C[6]C[3,6]O)(C[6]C[6]H)(H){1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	118.5620	0.000	1	118.5620	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[3,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[3,6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[3,6]H)(C[6]C[6]H)(H){1|H<1>,3|C<4>}	C[6](C[6]C[3,6]C)(C[6]C[6]H)(H){2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.8330	0.000	1	118.8330	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[3,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[3,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[3,6]H)(C[6]C[6]H)(H){2|C<4>,2|H<1>}	C[6](C[6]C[3,6]H)(C[6]C[6]H)(H){2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.2550	0.253	3	119.2550	0.064	3	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[3,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[3,6]H)(C[6]C[6]H)(H){1|Nb<6>,1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.8605	0.128	2	119.8605	0.016	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[3,6]N)(C[6]C[6]H)(H)	C[6](C[6]C[3,6]N)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[3,6]N)(C[6]C[6]H)(H){1|H<1>,1|N<2>,2|C<4>}	C[6](C[6]C[3,6]N)(C[6]C[6]H)(H){1|H<1>,1|N<2>,2|C<4>}	H(C[6]C[6]2)	118.5520	0.000	1	118.5520	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[3,6]O)(C[6]C[6]H)(H)	C[6](C[6]C[3,6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[3,6]O)(C[6]C[6]H)(H){1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[3,6]C)(C[6]C[6]H)(H){1|H<1>,1|O<2>,2|C<4>}	H(C[6]C[6]2)	119.7510	0.000	1	119.7510	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[3]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[3]C[6])(C[6]C[6]H)(H){1|C<2>,2|C<4>,3|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>}	H(C[6]C[6]2)	120.6290	0.000	1	119.5450	2.350	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[3]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[3]C[6])(C[6]C[6]H)(H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<2>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	118.4610	0.000	1	119.5450	2.350	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[3x3,3x5,12x6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[3x3,3x5,12x6]C[6])(C[6]C[6]H)(H){1|Rh<10>,1|H<1>,2|C<3>,4|B<6>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|C<6>,1|H<1>}	H(C[6]C[6]2)	119.6115	5.525	2	119.6115	30.521	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[3x3,3x5,12x6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[3x3,3x5,12x6]N[6])(C[6]C[6]H)(H){1|B<5>,1|C<3>,1|C<5>,2|B<6>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<5>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	116.3140	0.000	1	118.3765	8.508	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[3x3,3x5,12x6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[3x3,3x5,12x6]N[6])(C[6]C[6]H)(H){1|Ir<7>,1|C<3>,1|C<5>,1|H<1>,3|B<6>}	C[6](C[6]C[6]H)2(H){1|C<5>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4390	0.000	1	118.3765	8.508	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[3x3,4,3x5,14x6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[3x3,4,3x5,14x6]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>,4|B<6>}	C[6](C[6]C[6]H)2(H){1|C<5>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	118.9320	0.000	1	118.9320	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[3x6]H)(C[6]C[6]H)(H)	C[6](C[6]N[3x6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[3x6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]N[3x6]C)(C[6]C[6]H)(H){1|Ge<3>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.3730	0.000	1	119.3730	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[3x6]H)(C[6]C[6]H)(H)	C[6](C[6]N[3x6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[3x6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]N[3x6]H)(C[6]C[6]H)(H){1|Nb<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2710	0.000	1	120.3126	0.060	9	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[3x6]H)(C[6]C[6]H)(H)	C[6](C[6]N[3x6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[3x6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]N[3x6]H)(C[6]C[6]H)(H){1|Nb<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3650	0.000	1	120.3126	0.060	9	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[3x6]H)(C[6]C[6]H)(H)	C[6](C[6]N[3x6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[3x6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]N[3x6]H)(C[6]C[6]H)(H){1|Nb<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5002	0.188	4	120.3126	0.060	9	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[3x6]H)(C[6]C[6]H)(H)	C[6](C[6]N[3x6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[3x6]H)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|P<3>}	C[6](C[6]N[3x6]H)(C[6]C[6]H)(H){1|As<3>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0587	0.134	3	120.3126	0.060	9	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[3x6]O)(C[6]C[6]H)(H)	C[6](C[6]C[3x6]O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[3x6]O)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<1>}	C[6](C[6]C[3x6]O)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<1>}	H(C[6]C[6]2)	119.0249	0.267	9	119.1684	0.360	21	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[3x6]O)(C[6]C[6]H)(H)	C[6](C[6]C[3x6]O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[3x6]O)(C[6]C[6]H)(H){1|H<1>,1|O<1>,2|C<4>}	C[6](C[6]C[3x6]O)(C[6]C[6]H)(H){1|H<1>,1|O<1>,2|C<4>}	H(C[6]C[6]2)	119.2761	0.757	12	119.1684	0.360	21	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[4,4,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[4,4,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(H){1|C<4>,2|H<1>}	H(C[6]C[6]2)	120.1895	0.474	2	120.1895	0.225	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[4,5,6,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[4,5,6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[4,5,6,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[4,5,6,6]H)(C[6]C[6]H)(H){1|H<1>,1|O<2>,2|C<4>}	H(C[6]C[6]2)	118.7840	0.000	1	118.7760	0.000	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[4,5,6,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[4,5,6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[4,5,6,6]H)(C[6]C[6]H)(H){1|H<1>,1|O<2>,2|C<4>}	C[6](C[6]C[4,5,6,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	118.7680	0.000	1	118.7760	0.000	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[4,5,6,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,5,6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[4,5,6,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[5,5,6,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	118.8370	0.000	1	118.8370	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[4,5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[4,5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[4,5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[4,5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	117.9573	1.862	4	117.9573	3.465	4	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[4,5]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[4,5]C[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,2|C<3>,2|O<2>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|O<1>}	H(C[6]C[6]2)	120.6440	0.000	1	120.6440	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[4,6]C)(C[6]C[6]H)(H)	C[6](C[6]C[4,6]O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[4,6]C)(C[6]C[6]H)(H){1|H<1>,1|O<1>,2|C<4>}	C[6](C[6]C[4,6]O)(C[6]C[6]H)(H){1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	118.2595	0.161	2	118.2595	0.026	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[4,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[4,6]H)(C[6]C[6]H)(H){1|C<6>,1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|C<5>,2|H<1>}	H(C[6]C[6]2)	119.9640	0.000	1	119.9670	0.000	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[4,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[4,6]H)(C[6]C[6]H)(H){1|C<6>,1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|C<6>,2|H<1>}	H(C[6]C[6]2)	119.9700	0.000	1	119.9670	0.000	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[4,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[4,6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[4,6]H)(C[6]C[6]H)(H){1|C<4>,2|N<3>}	C[6](C[6]N[4,6]C)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	118.4680	0.000	1	119.1100	0.129	6	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[4,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[4,6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[4,6]H)(C[6]C[6]H)(H){1|C<4>,2|N<3>}	C[6](C[6]N[4,6]C)(C[6]C[6]H)(H){1|Ge<3>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.0700	0.139	2	119.1100	0.129	6	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[4,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[4,6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[4,6]H)(C[6]C[6]H)(H){1|N<3>,2|C<4>}	C[6](C[6]N[4,6]C)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.2960	0.133	2	119.1100	0.129	6	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[4,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[4,6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[4,6]H)(C[6]C[6]H)(H){1|N<3>,2|C<4>}	C[6](C[6]N[4,6]C)(C[6]C[6]H)(H){1|Si<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.4600	0.000	1	119.1100	0.129	6	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[4,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[4,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[4,6]H)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]N[4,6]H)(C[6]C[6]H)(H){1|Si<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.6833	0.108	4	119.6782	0.011	6	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[4,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[4,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[4,6]H)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]N[4,6]H)(C[6]C[6]H)(H){1|Si<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.6680	0.146	2	119.6782	0.011	6	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[4,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[4,6]N)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[4,6]H)(C[6]C[6]H)(H){3|N<3>}	C[6](C[6]N[4,6]N)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	118.7960	0.174	2	118.7960	0.030	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[4,6]O)(C[6]C[6]H)(H)	C[6](C[6]C[4,6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[4,6]O)(C[6]C[6]H)(H){1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[4,6]C)(C[6]C[6]H)(H){1|H<1>,1|O<1>,2|C<4>}	H(C[6]C[6]2)	118.7990	0.190	2	118.7990	0.036	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[4,6]O)(C[6]C[6]H)(H)	C[6](C[6]C[4,6]O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[4,6]O)(C[6]C[6]H)(H){1|C<3>,1|O<1>,2|C<4>}	C[6](C[6]C[4,6]O)(C[6]C[6]H)(H){1|H<1>,1|O<1>,2|C<4>}	H(C[6]C[6]2)	117.9410	0.000	1	118.4105	0.441	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[4,6]O)(C[6]C[6]H)(H)	C[6](C[6]C[4,6]O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[4,6]O)(C[6]C[6]H)(H){1|H<1>,1|O<1>,2|C<4>}	C[6](C[6]C[4,6]O)(C[6]C[6]H)(H){1|C<3>,1|O<1>,2|C<4>}	H(C[6]C[6]2)	118.8800	0.000	1	118.4105	0.441	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[4]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[4]C[6])(C[6]C[6]H)(H){1|N<3>,2|C<4>,3|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.4385	0.281	2	119.4385	0.079	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[4]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[4]C[6])(C[6]C[6]H)(H){1|C<2>,1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>}	H(C[6]C[6]2)	116.9710	0.000	1	118.5243	1.838	3	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[4]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[4]C[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<1>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.3010	0.239	2	118.5243	1.838	3	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[4]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[4]N[6])(C[6]C[6]H)(H){1|C<3>,2|C<4>,3|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0900	0.077	3	120.0800	0.303	23	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[4]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[4]N[6])(C[6]C[6]H)(H){1|C<3>,2|H<1>,3|C<4>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5940	1.212	2	120.0800	0.303	23	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[4]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[4]N[6])(C[6]C[6]H)(H){1|C<4>,2|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1700	0.000	1	120.0800	0.303	23	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[4]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[4]N[6])(C[6]C[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>,3|C<4>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8314	0.260	12	120.0800	0.303	23	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[4]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[4]N[6])(C[6]C[6]H)(H){1|Ir<4>,1|C<3>,1|C<4>,1|N<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9090	0.000	1	120.0800	0.303	23	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[4]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[4]N[6])(C[6]C[6]H)(H){1|Ni<4>,1|C<3>,1|H<1>,3|C<4>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.8200	0.000	1	120.0800	0.303	23	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[4]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[4]N[6])(C[6]C[6]H)(H){1|Os<7>,1|C<3>,1|C<4>,1|N<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3480	0.000	1	120.0800	0.303	23	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[4]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[4]N[6])(C[6]C[6]H)(H){1|Os<8>,1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9450	0.000	1	120.0800	0.303	23	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[4]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[4]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|C<3>,1|C<4>,1|N<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2130	0.000	1	120.0800	0.303	23	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,3x6]H)(C[6]C[6]H)(H)	C[6](C[6]P[5,6,6]Si)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,3x6]H)(C[6]C[6]H)(H){1|Si<4>,1|C<3>,1|C<4>,1|P<3>}	C[6](C[6]P[5,6,6]Si)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|P<3>}	H(C[6]C[6]2)	116.4230	0.000	1	116.9998	0.178	4	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,3x6]H)(C[6]C[6]H)(H)	C[6](C[6]P[5,6,6]Si)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,3x6]H)(C[6]C[6]H)(H){1|Si<4>,1|C<3>,1|C<4>,1|P<4>}	C[6](C[6]P[5,6,6]Si)(C[6]C[6]H)(H){1|Au<2>,1|C<4>,1|H<1>,1|P<3>}	H(C[6]C[6]2)	116.9960	0.000	1	116.9998	0.178	4	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,3x6]H)(C[6]C[6]H)(H)	C[6](C[6]P[5,6,6]Si)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,3x6]H)(C[6]C[6]H)(H){1|Si<4>,1|C<3>,1|C<4>,1|P<4>}	C[6](C[6]P[5,6,6]Si)(C[6]C[6]H)(H){1|Cu<3>,1|C<4>,1|H<1>,1|P<3>}	H(C[6]C[6]2)	117.2900	0.182	2	116.9998	0.178	4	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,5,6,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[4,5,6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,5,6,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|O<2>}	C[6](C[6]C[4,5,6,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.3360	0.000	1	119.3360	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,5,6,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,5,6,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,2|C<3>}	C[6](C[6]C[5,6,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	117.2990	0.000	1	117.2990	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,5]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,5]C[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>,2|C<4>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.1795	0.046	2	119.1795	0.002	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,5,6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[5,5,6,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.3100	0.000	1	119.3100	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|O<2>}	C[6](C[6]C[5,6,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.1935	0.056	2	119.1935	0.003	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<4>,1|O<2>,2|H<1>}	H(C[6]C[6]2)	119.5650	0.000	1	119.5650	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6,6]O)(C[6]C[6]H)(H)	C[6](C[6]C[5,6,6]O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6,6]O)(C[6]C[6]H)(H){1|H<1>,1|O<1>,2|C<4>}	C[6](C[6]C[5,6,6]O)(C[6]C[6]H)(H){1|H<1>,1|O<1>,2|C<4>}	H(C[6]C[6]2)	118.6112	0.215	8	118.6112	0.046	8	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]Br)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]Br)(C[6]C[6]H)(H){1|Fe<10>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Fe<10>,1|Br<1>,2|C<4>}	H(C[6]C[6]2)	119.8590	0.000	1	120.1067	0.143	3	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]Br)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]Br)(C[6]C[6]H)(H){1|Hf<12>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Hf<12>,1|Br<1>,2|C<4>}	H(C[6]C[6]2)	120.2305	0.441	2	120.1067	0.143	3	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]Br)(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]Br)(C[6]C[6]H)(H){1|C<4>,1|N<3>,2|H<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Br<1>,2|C<4>}	H(C[6]C[6]2)	119.7045	0.316	2	119.7045	0.100	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H){1|Co<10>,3|C<4>}	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H){1|Co<10>,3|C<4>}	H(C[6]C[6]2)	118.6880	0.245	2	118.6151	0.294	109	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H){1|Cr<10>,3|C<4>}	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H){1|Cr<10>,3|C<4>}	H(C[6]C[6]2)	118.6494	0.391	19	118.6151	0.294	109	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H){1|Cr<7>,3|C<4>}	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H){1|Cr<7>,3|C<4>}	H(C[6]C[6]2)	118.7773	0.536	4	118.6151	0.294	109	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H){1|Cr<8>,3|C<4>}	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H){1|Cr<8>,3|C<4>}	H(C[6]C[6]2)	118.6687	2.024	6	118.6151	0.294	109	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H){1|Fe<10>,3|C<4>}	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H){1|Fe<10>,3|C<4>}	H(C[6]C[6]2)	118.4721	0.303	10	118.6151	0.294	109	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H){1|Mo<10>,3|C<4>}	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H){1|Mo<10>,3|C<4>}	H(C[6]C[6]2)	118.8470	0.334	2	118.6151	0.294	109	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H){1|Mo<9>,3|C<4>}	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H){1|Mo<9>,3|C<4>}	H(C[6]C[6]2)	118.6336	0.222	10	118.6151	0.294	109	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H){1|Ru<10>,3|C<4>}	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H){1|Ru<10>,3|C<4>}	H(C[6]C[6]2)	118.7745	0.226	10	118.6151	0.294	109	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H){1|Ru<7>,3|C<4>}	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H){1|Ru<7>,3|C<4>}	H(C[6]C[6]2)	118.4865	0.281	2	118.6151	0.294	109	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H){1|Ru<8>,3|C<4>}	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H){1|Ru<8>,3|C<4>}	H(C[6]C[6]2)	118.5250	0.586	6	118.6151	0.294	109	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H){1|Zr<12>,3|C<4>}	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H){1|Zr<12>,3|C<4>}	H(C[6]C[6]2)	118.5618	0.319	16	118.6151	0.294	109	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H){1|Zr<13>,3|C<4>}	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H){1|Zr<13>,3|C<4>}	H(C[6]C[6]2)	118.6045	0.288	12	118.6151	0.294	109	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H){1|Zr<14>,3|C<4>}	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H){1|Zr<14>,3|C<4>}	H(C[6]C[6]2)	118.5245	0.279	8	118.6151	0.294	109	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H){1|Zr<15>,3|C<4>}	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H){1|Zr<15>,3|C<4>}	H(C[6]C[6]2)	118.5780	0.103	2	118.6151	0.294	109	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<2>,1|O<2>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){4|C<4>}	H(C[6]C[6]2)	119.0030	0.000	1	118.9635	0.003	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	118.9240	0.000	1	118.9635	0.003	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H){1|H<1>,1|O<1>,2|C<4>}	C[6](C[6]C[5,6]O)(C[6]C[6]H)(H){1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	118.3295	0.009	2	118.3295	0.000	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|In<6>,2|C<3>}	H(C[6]C[6]2)	120.0790	0.061	2	119.2330	1.018	4	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|N<2>,2|C<3>}	H(C[6]C[6]2)	118.3870	0.434	2	119.2330	1.018	4	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]C[6,6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C[6,6])(C[6]C[6]H)(H){1|H<1>,1|P<4>,2|C<3>,2|C<4>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	117.9840	0.000	1	117.9840	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C[6a])(C[6]C[6]H)(H){1|C<4>,1|O<2>,4|C<3>}	C[6](C[6]C[5,6]C[6a])(C[6]C[6]H)(H){2|C<4>,4|C<3>}	H(C[6]C[6]2)	118.8140	0.000	1	118.5675	0.122	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C[6a])(C[6]C[6]H)(H){2|C<4>,4|C<3>}	C[6](C[6]C[5,6]C[6a])(C[6]C[6]H)(H){1|C<4>,1|O<2>,4|C<3>}	H(C[6]C[6]2)	118.3210	0.000	1	118.5675	0.122	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C[6a])(C[6]C[6]H)(H){1|Zr<12>,1|H<1>,2|C<3>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Zr<12>,1|C<3>,2|C<4>}	H(C[6]C[6]2)	118.5830	0.000	1	118.8083	0.124	3	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C[6a])(C[6]C[6]H)(H){1|Zr<13>,1|H<1>,2|C<3>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Zr<13>,1|C<3>,2|C<4>}	H(C[6]C[6]2)	118.9210	0.414	2	118.8083	0.124	3	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C[6a])(C[6]C[6]H)(H){1|Ti<13>,1|O<2>,2|C<3>,2|C<4>}	C[6](C[6]C[5,6]O)(C[6]C[6]H)(H){1|Ti<13>,1|C<3>,2|C<4>}	H(C[6]C[6]2)	118.5150	0.120	5	118.5150	0.014	5	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,4|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	122.7660	0.000	1	122.7660	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]Cl)(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]Cl)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Cl<1>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	119.8350	0.000	1	119.8350	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]Br)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Fe<10>,1|Br<1>,2|C<4>}	C[6](C[6]C[5,6]Br)(C[6]C[6]H)(H){1|Fe<10>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.7990	0.000	1	119.3780	0.216	3	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]Br)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Hf<12>,1|Br<1>,2|C<4>}	C[6](C[6]C[5,6]Br)(C[6]C[6]H)(H){1|Hf<12>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.1675	0.408	2	119.3780	0.216	3	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.5350	0.000	1	119.3330	0.082	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){4|C<4>}	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<2>,1|O<2>}	H(C[6]C[6]2)	119.1310	0.000	1	119.3330	0.082	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Zr<12>,1|C<3>,2|C<4>}	C[6](C[6]C[5,6]C[6a])(C[6]C[6]H)(H){1|Zr<12>,1|H<1>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	119.0100	0.000	1	119.1863	0.027	3	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Zr<13>,1|C<3>,2|C<4>}	C[6](C[6]C[5,6]C[6a])(C[6]C[6]H)(H){1|Zr<13>,1|H<1>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	119.2745	0.090	2	119.1863	0.027	3	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|O<2>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<4>,1|O<2>,2|H<1>}	H(C[6]C[6]2)	119.0360	0.000	1	119.2732	0.476	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Si<4>,1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8280	0.093	2	119.2732	0.476	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<4>}	H(C[6]C[6]2)	118.5390	0.000	1	119.2732	0.476	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<4>,1|O<2>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.1340	0.000	1	119.2732	0.476	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<4>,1|P<4>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){2|C<4>,2|H<1>}	H(C[6]C[6]2)	117.7130	0.000	1	119.2732	0.476	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Co<10>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Co<10>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.3594	0.208	14	119.2732	0.476	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Co<11>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Co<11>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.0995	0.164	21	119.2732	0.476	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Co<9>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Co<9>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.3414	0.080	8	119.2732	0.476	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Cr<10>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Cr<10>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.3481	0.179	20	119.2732	0.476	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Cr<8>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Cr<8>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.5280	0.040	2	119.2732	0.476	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Cr<9>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Cr<9>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.2035	0.034	4	119.2732	0.476	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Eu<12>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Eu<12>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.4030	0.879	8	119.2732	0.476	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Eu<13>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Eu<13>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.7447	0.254	4	119.2732	0.476	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Fe<10>,1|C<4>,1|H<1>,1|P<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Fe<10>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.4120	0.000	1	119.2732	0.476	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Fe<10>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Fe<10>,1|C<4>,1|H<1>,1|P<3>}	H(C[6]C[6]2)	119.3570	0.000	1	119.2732	0.476	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Fe<10>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Fe<10>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.1353	0.635	26	119.2732	0.476	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Fe<11>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Fe<11>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.0300	0.313	2	119.2732	0.476	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Fe<8>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Fe<8>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.1150	0.303	14	119.2732	0.476	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Fe<9>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Fe<9>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.4500	0.000	1	119.2732	0.476	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Gd<16>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Gd<16>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.3842	0.202	4	119.2732	0.476	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	117.5190	0.000	1	119.2732	0.476	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Os<8>,1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.5070	0.000	1	119.2732	0.476	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Hf<11>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Hf<11>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.1814	0.192	7	119.2732	0.476	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Hf<12>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Hf<12>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.2385	0.189	15	119.2732	0.476	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Hf<13>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Hf<13>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.4618	0.877	6	119.2732	0.476	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ho<14>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ho<14>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.2360	0.117	2	119.2732	0.476	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ir<9>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ir<9>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.1822	0.161	4	119.2732	0.476	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Li<7>,1|C<4>,1|C<5>,1|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Li<7>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.2090	0.000	1	119.2732	0.476	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Li<7>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Li<7>,1|C<4>,1|C<5>,1|H<1>}	H(C[6]C[6]2)	119.6540	0.000	1	119.2732	0.476	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Li<7>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Li<7>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.3585	0.005	2	119.2732	0.476	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Li<8>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Li<8>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.3845	0.323	2	119.2732	0.476	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Lu<16>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Lu<16>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.6150	2.667	2	119.2732	0.476	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Mn<10>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Mn<10>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.3722	0.216	21	119.2732	0.476	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Mn<8>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Mn<8>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.4959	2.099	16	119.2732	0.476	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Mo<10>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Mo<10>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.8359	1.441	16	119.2732	0.476	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Mo<11>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Mo<11>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.3235	0.086	2	119.2732	0.476	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Mo<12>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Mo<12>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	118.8810	0.525	30	119.2732	0.476	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Mo<8>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Mo<8>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.3440	0.007	2	119.2732	0.476	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Mo<9>,1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Mo<9>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	120.0690	0.000	1	119.2732	0.476	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Mo<9>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Mo<9>,1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	118.8140	0.000	1	119.2732	0.476	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Mo<9>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Mo<9>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	120.0885	0.968	4	119.2732	0.476	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Nd<19>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Nd<19>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.5600	0.532	2	119.2732	0.476	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ni<7>,1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ni<7>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.2690	0.000	1	119.2732	0.476	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ni<7>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ni<7>,1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.3560	0.000	1	119.2732	0.476	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ni<7>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ni<7>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.3148	0.320	20	119.2732	0.476	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ni<8>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ni<8>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.2802	0.186	4	119.2732	0.476	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Os<8>,1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.3400	0.000	1	119.2732	0.476	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Pd<7>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Pd<7>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.4038	0.168	8	119.2732	0.476	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Re<8>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Re<8>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.1086	0.332	12	119.2732	0.476	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Rh<10>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Rh<10>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.3637	1.198	8	119.2732	0.476	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Rh<7>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Rh<7>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.3639	0.232	14	119.2732	0.476	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Rh<8>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Rh<8>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.1135	0.295	13	119.2732	0.476	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Rh<9>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Rh<9>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.3773	0.233	4	119.2732	0.476	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ru<10>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ru<10>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.2302	0.141	10	119.2732	0.476	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ru<11>,1|C<4>,1|H<1>,1|P<5>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ru<11>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.1937	0.652	3	119.2732	0.476	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ru<11>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ru<11>,1|C<4>,1|H<1>,1|P<5>}	H(C[6]C[6]2)	118.9313	0.523	3	119.2732	0.476	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ru<11>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ru<11>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.0722	0.155	16	119.2732	0.476	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ru<7>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ru<7>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.1754	0.444	42	119.2732	0.476	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ru<8>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ru<8>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.2810	0.334	48	119.2732	0.476	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ru<9>,1|B<4>,1|C<4>,1|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ru<9>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.4430	0.010	2	119.2732	0.476	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ru<9>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ru<9>,1|B<4>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.4965	0.043	2	119.2732	0.476	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ru<9>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ru<9>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.8350	1.047	4	119.2732	0.476	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Sc<13>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Sc<13>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.1460	0.400	2	119.2732	0.476	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Sc<15>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Sc<15>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.3227	0.123	4	119.2732	0.476	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Si<4>,1|C<3>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.4045	0.203	2	119.2732	0.476	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Sm<14>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Sm<14>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.3975	0.868	2	119.2732	0.476	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Sm<16>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Sm<16>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	118.8834	1.285	8	119.2732	0.476	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ti<11>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ti<11>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.1385	0.238	8	119.2732	0.476	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ti<12>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ti<12>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.3290	0.276	14	119.2732	0.476	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ti<13>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ti<13>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.3038	0.293	4	119.2732	0.476	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ti<8>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ti<8>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.1430	0.155	5	119.2732	0.476	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ti<9>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ti<9>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.9133	2.054	6	119.2732	0.476	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Y<12>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Y<12>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.5815	1.244	4	119.2732	0.476	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Y<16>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Y<16>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	118.9025	2.682	2	119.2732	0.476	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Yb<12>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Yb<12>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.2875	1.176	12	119.2732	0.476	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Zr<10>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Zr<10>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.2498	0.118	4	119.2732	0.476	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Zr<12>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Zr<12>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.3654	0.758	82	119.2732	0.476	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Zr<13>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Zr<13>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.1648	0.548	63	119.2732	0.476	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Zr<14>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Zr<14>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.2567	0.615	14	119.2732	0.476	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Zr<15>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Zr<15>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	120.0520	1.118	4	119.2732	0.476	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Zr<9>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Zr<9>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.2583	0.428	8	119.2732	0.476	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){2|C<4>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<4>,1|P<4>,2|H<1>}	H(C[6]C[6]2)	117.5970	0.000	1	119.2732	0.476	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]N[5a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Zr<13>,1|N<3>,2|C<4>}	C[6](C[6]C[5,6]N[5a])(C[6]C[6]H)(H){1|Zr<13>,1|H<1>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	119.0305	0.009	2	119.0305	0.000	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<1>}	C[6](C[6]C[5,6]O)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.4880	0.000	1	119.4550	0.047	6	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<1>}	C[6](C[6]C[5,6]O)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.4484	0.243	5	119.4550	0.047	6	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<4>,3|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	119.2700	0.000	1	119.2700	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|O<2>,2|H<1>}	H(C[6]C[6]2)	118.9750	0.000	1	119.2426	0.222	14	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	118.9240	0.000	1	119.2426	0.222	14	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	119.2546	0.309	9	119.2426	0.222	14	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	119.9590	0.102	2	119.2426	0.222	14	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	118.2880	0.000	1	119.2426	0.222	14	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[5,6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]N[5,6]C)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.9903	0.198	3	119.9416	0.110	21	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[5,6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]N[5,6]C)(C[6]C[6]H)(H){1|Ga<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.5220	0.206	2	119.9416	0.110	21	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[5,6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<4>,1|N<3>,1|O<2>}	C[6](C[6]N[5,6]C)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.4720	0.078	2	119.9416	0.110	21	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[5,6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<4>,2|N<3>}	C[6](C[6]N[5,6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	H(C[6]C[6]2)	119.5970	0.020	2	119.9416	0.110	21	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[5,6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|N<3>,2|C<3>}	C[6](C[6]N[5,6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<2>}	H(C[6]C[6]2)	120.0835	0.418	2	119.9416	0.110	21	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[5,6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|N<3>,2|C<3>}	C[6](C[6]N[5,6]C)(C[6]C[6]H)(H){1|In<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.7410	0.000	1	119.9416	0.110	21	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[5,6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|N<3>,2|C<3>}	C[6](C[6]N[5,6]C)(C[6]C[6]H)(H){1|In<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2474	0.168	5	119.9416	0.110	21	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[5,6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|N<3>,2|C<4>}	C[6](C[6]N[5,6]C)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1188	0.158	4	119.9416	0.110	21	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[5,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|N<3>,2|C<3>}	C[6](C[6]N[5,6]C[6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<2>}	H(C[6]C[6]2)	119.8410	0.000	1	119.8410	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[5,6]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|N<3>,2|C<3>}	C[6](C[6]N[5,6]C[6a])(C[6]C[6]H)(H){1|Ga<4>,1|H<1>,1|N<2>,2|C<3>}	H(C[6]C[6]2)	119.9860	0.096	2	119.9860	0.009	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[5,6]Cl)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Cl<1>,1|N<3>,1|O<2>}	C[6](C[6]N[5,6]Cl)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.3848	0.130	6	119.3848	0.017	6	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|B<3>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4680	0.000	1	120.0602	0.180	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1385	0.239	20	120.0602	0.180	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.4840	0.228	3	120.0602	0.180	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	119.3595	0.122	4	120.0602	0.180	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<2>}	H(C[6]C[6]2)	119.7040	0.000	1	120.0602	0.180	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<3>}	H(C[6]C[6]2)	119.7330	0.000	1	120.0602	0.180	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<4>}	H(C[6]C[6]2)	119.3945	0.435	2	120.0602	0.180	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<6>}	H(C[6]C[6]2)	120.0400	0.147	2	120.0602	0.180	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ga<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.7567	0.644	3	120.0602	0.180	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ga<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2922	0.255	10	120.0602	0.180	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ga<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2005	0.353	37	120.0602	0.180	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ge<2>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2130	0.153	2	120.0602	0.180	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ge<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9905	0.095	2	120.0602	0.180	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.9083	0.310	33	120.0602	0.180	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|In<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8820	0.000	1	120.0602	0.180	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|In<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2016	0.225	13	120.0602	0.180	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|In<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4180	0.000	1	120.0602	0.180	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Nb<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2115	0.202	2	120.0602	0.180	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Se<2>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.7160	0.000	1	120.0602	0.180	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Si<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8824	0.347	5	120.0602	0.180	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Si<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2285	0.140	4	120.0602	0.180	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Si<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3512	0.096	14	120.0602	0.180	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0346	0.234	5	120.0602	0.180	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|B<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.7545	0.148	2	120.0602	0.180	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.0487	0.296	3	120.0602	0.180	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ga<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9660	0.160	2	120.0602	0.180	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ga<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3577	0.070	7	120.0602	0.180	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ge<3>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0680	0.219	2	120.0602	0.180	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.9114	0.443	5	120.0602	0.180	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|In<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2793	0.307	4	120.0602	0.180	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Si<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2595	0.139	10	120.0602	0.180	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.2980	0.129	2	120.0602	0.180	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	118.7590	0.000	1	120.0602	0.180	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|In<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2600	0.000	1	120.0602	0.180	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.6082	0.204	4	120.0602	0.180	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	118.9405	0.480	2	120.0602	0.180	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|P<2>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.1403	0.361	6	120.0602	0.180	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|P<6>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.0690	0.000	1	120.0602	0.180	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.1605	0.449	2	120.0602	0.180	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.3760	0.000	1	120.0602	0.180	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.4397	1.928	3	120.0602	0.180	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<2>}	H(C[6]C[6]2)	119.9180	0.000	2	120.0602	0.180	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<6>}	H(C[6]C[6]2)	119.8830	0.000	1	120.0602	0.180	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.6292	0.507	6	120.0602	0.180	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Se<2>,1|H<1>,1|N<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.8890	0.000	1	120.0602	0.180	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Si<4>,1|H<1>,1|N<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ga<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2777	0.106	3	120.0602	0.180	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Si<4>,1|H<1>,1|N<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ga<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5860	0.448	2	120.0602	0.180	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Si<4>,1|H<1>,1|N<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|In<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4635	0.057	2	120.0602	0.180	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[5,6]N)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,2|N<3>}	C[6](C[6]N[5,6]N)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9660	0.000	1	119.9660	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[5,6]P)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|N<3>,1|P<3>}	C[6](C[6]N[5,6]P)(C[6]C[6]H)(H){1|Ga<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9950	0.260	2	119.7538	0.125	12	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[5,6]P)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|N<3>,1|P<3>}	C[6](C[6]N[5,6]P)(C[6]C[6]H)(H){1|In<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2610	0.300	2	119.7538	0.125	12	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[5,6]P)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|N<3>,1|P<4>}	C[6](C[6]N[5,6]P)(C[6]C[6]H)(H){1|Ga<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.6685	0.095	2	119.7538	0.125	12	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[5,6]P)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|N<3>,1|P<4>}	C[6](C[6]N[5,6]P)(C[6]C[6]H)(H){1|In<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.5782	0.265	4	119.7538	0.125	12	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[5,6]P)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|N<3>,1|P<4>}	C[6](C[6]N[5,6]P)(C[6]C[6]H)(H){1|In<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.4415	0.170	2	119.7538	0.125	12	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]N)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]N)(C[6]C[6]H)(H){1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	119.2140	0.011	2	119.2140	0.000	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]N[5a])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]N[5a])(C[6]C[6]H)(H){1|Zr<13>,1|H<1>,2|C<3>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Zr<13>,1|N<3>,2|C<4>}	H(C[6]C[6]2)	119.7420	0.078	2	119.7420	0.006	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]N[6])(C[6]C[6]H)(H){1|C<3>,1|O<1>,2|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	119.2530	0.000	1	119.2530	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]O)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]O)(C[6]C[6]H)(H){1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H){1|H<1>,1|O<1>,2|C<4>}	H(C[6]C[6]2)	118.8665	0.087	2	118.8665	0.008	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]O)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]O)(C[6]C[6]H)(H){1|Ti<13>,1|C<3>,2|C<4>}	C[6](C[6]C[5,6]C[6a])(C[6]C[6]H)(H){1|Ti<13>,1|O<2>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	119.5374	0.091	5	119.5374	0.008	5	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]O)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]O)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<1>}	H(C[6]C[6]2)	119.3530	0.000	1	119.2617	0.017	6	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]O)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]O)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<1>}	H(C[6]C[6]2)	119.2434	0.136	5	119.2617	0.017	6	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]O)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]O)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<4>,1|O<1>,2|H<1>}	H(C[6]C[6]2)	118.2130	0.000	1	118.2130	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]O)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]O)(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	119.4888	0.341	9	119.8433	1.360	10	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]O)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]O)(C[6]C[6]H)(H){1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	123.0340	0.000	1	119.8433	1.360	10	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>,2|N<2>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Co<6>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	120.0810	0.000	1	120.0810	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]Br)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H){1|Br<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6]Br)(C[6]C[6]H)(H){1|C<2>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.0540	0.000	1	120.0540	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H){1|Fe<10>,1|H<1>,2|C<2>,2|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|C<4>}	H(C[6]C[6]2)	119.0820	0.000	1	119.5835	0.503	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H){1|Ir<6>,1|C<2>,1|C<4>,2|N<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){2|C<3>}	H(C[6]C[6]2)	120.0850	0.000	1	119.5835	0.503	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]F)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H){1|C<2>,1|F<1>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]F)(C[6]C[6]H)(H){1|C<3>,1|C<4>}	H(C[6]C[6]2)	122.2810	0.000	1	122.2810	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.9075	0.043	2	119.9075	0.002	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H){1|C<4>,1|N<3>,1|N<4>,3|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.5575	0.595	2	119.9530	0.791	22	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H){1|C<4>,2|N<3>,3|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|W<6>}	H(C[6]C[6]2)	120.7010	0.000	1	119.9530	0.791	22	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H){1|C<4>,2|N<3>,3|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	119.9795	0.200	2	119.9530	0.791	22	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H){1|N<2>,2|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.9040	0.000	1	119.9530	0.791	22	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cd<6>,2|C<3>}	H(C[6]C[6]2)	120.9615	0.272	2	119.9530	0.791	22	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H){1|N<3>,2|H<1>,2|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.8817	0.189	4	119.9530	0.791	22	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H){1|N<3>,2|H<1>,2|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<6>,2|C<3>}	H(C[6]C[6]2)	120.6640	0.000	1	119.9530	0.791	22	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H){1|N<3>,2|H<1>,2|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<6>,2|C<3>}	H(C[6]C[6]2)	120.3500	0.000	1	119.9530	0.791	22	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H){2|H<1>,3|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.9685	0.373	4	119.9530	0.791	22	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H){2|H<1>,3|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<6>,2|C<3>}	H(C[6]C[6]2)	117.8945	1.619	2	119.9530	0.791	22	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H){2|H<1>,3|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<8>,2|C<3>}	H(C[6]C[6]2)	120.5800	0.385	2	119.9530	0.791	22	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H){1|N<3>,1|O<2>,2|C<4>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.9170	0.000	1	120.9170	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H){1|C<2>,1|N<2>,1|N<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){2|C<3>}	H(C[6]C[6]2)	118.0680	0.000	1	119.4488	1.199	10	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>,2|N<3>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.3203	0.360	3	119.4488	1.199	10	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H){1|C<3>,2|C<4>,4|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.6600	0.000	1	119.4488	1.199	10	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H){1|C<3>,2|H<1>,2|O<2>}	C[6](C[6]C[6]H)2(H){1|C<2>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	121.5840	0.000	1	119.4488	1.199	10	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<2>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<2>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	117.6280	0.000	1	119.4488	1.199	10	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|O<1>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|O<2>,2|C<3>}	H(C[6]C[6]2)	119.6760	0.000	1	119.4488	1.199	10	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H){1|Rh<8>,2|H<1>,3|C<4>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.7450	0.000	1	119.4488	1.199	10	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H){2|Li<4>,1|C<3>,1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.1660	0.000	1	119.4488	1.199	10	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H){1|Fe<10>,1|C<3>,1|H<1>,1|N<3>,2|C<4>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|C<3>,1|C<4>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.0140	0.000	1	119.8762	0.029	6	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H){1|Fe<10>,1|C<3>,1|H<1>,1|N<3>,2|C<4>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|C<4>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.9455	0.029	2	119.8762	0.029	6	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H){1|Fe<10>,1|C<3>,1|H<1>,1|N<3>,2|C<4>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|C<4>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.7840	0.211	3	119.8762	0.029	6	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Co<6>,2|C<3>,2|N<3>}	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>,2|N<2>}	H(C[6]C[6]2)	120.3170	0.000	1	120.3170	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|C<3>,1|C<4>,2|N<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5920	0.042	2	120.1236	0.748	14	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<5>,1|C<3>,1|C<4>,1|N<2>,1|N<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8250	0.000	1	120.1236	0.748	14	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|C<2>,1|C<3>,1|N<2>,1|N<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7040	0.000	1	120.1236	0.748	14	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Os<6>,1|C<3>,1|C<4>,2|N<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8229	0.962	9	120.1236	0.748	14	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Zn<6>,1|N<2>,1|N<3>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6120	0.000	1	120.1236	0.748	14	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|N<2>}	H(C[6]C[6]2)	118.2660	0.000	1	118.2660	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ag<4>,1|C<3>,1|H<1>,2|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4730	0.085	2	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ag<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3075	0.195	10	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ag<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.9205	0.363	2	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ag<6>,1|C<3>,1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.6165	0.354	4	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Al<4>,1|C<3>,1|H<1>,2|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.8240	0.000	1	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Al<5>,1|C<3>,1|H<1>,2|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.6580	0.000	1	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>,2|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.9995	2.556	2	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>,2|N<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	122.0650	0.000	1	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|C<3>,2|C<4>,3|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8370	0.000	1	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<2>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0110	0.000	1	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7750	0.042	2	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.0220	0.000	1	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cd<5>,1|C<3>,1|H<1>,2|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6065	0.661	6	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cd<5>,1|C<3>,1|H<1>,2|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.6690	0.000	1	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cd<5>,1|C<3>,1|N<3>,1|N<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3760	0.000	1	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cd<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9995	0.350	2	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cd<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.4270	0.000	1	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cd<6>,1|C<3>,1|C<4>,1|N<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0750	0.000	1	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cd<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8410	0.000	1	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cd<6>,1|C<3>,1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.9530	0.337	2	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cd<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6803	0.215	3	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cd<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	121.1552	0.044	4	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cd<6>,1|C<3>,1|N<3>,1|N<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	117.8670	0.000	1	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cd<6>,1|C<3>,1|N<4>,1|O<2>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3050	0.000	1	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cd<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4381	0.145	7	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Co<4>,1|C<3>,1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	121.2855	0.166	2	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Co<4>,1|C<3>,1|H<1>,2|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	121.3640	0.000	1	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Co<4>,1|C<3>,1|H<1>,2|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5810	0.000	1	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Co<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3795	0.146	2	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Co<5>,1|C<3>,1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	H(C[6]C[6]2)	121.5050	0.000	1	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Co<5>,1|C<3>,1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	121.1783	0.084	3	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Co<5>,1|C<3>,1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.9558	0.170	5	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Co<5>,1|C<3>,1|H<1>,2|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5980	0.000	1	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Co<5>,1|C<3>,1|H<1>,2|N<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.8357	0.306	9	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Co<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6236	0.269	8	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Co<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.6803	0.051	3	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Co<6>,1|C<3>,1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.9340	0.111	5	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Co<6>,1|C<3>,1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5967	0.527	6	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Co<6>,1|C<3>,1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	121.1860	0.093	2	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Co<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8130	0.147	23	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Co<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	121.1296	0.245	5	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Co<6>,1|H<1>,1|N<3>,1|O<2>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8459	0.226	16	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Co<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3236	0.400	10	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Co<8>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5540	0.000	1	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cr<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	H(C[6]C[6]2)	121.3645	0.069	2	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cr<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.9267	0.289	4	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7369	0.211	11	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.3135	0.272	2	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.7195	0.583	16	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.9920	0.247	2	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.6919	0.207	8	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>,2|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.5277	0.108	3	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>,2|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6691	0.326	14	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.7911	0.284	11	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5998	0.763	13	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|H<1>,1|P<4>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2362	0.500	12	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|H<1>,1|P<5>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2600	0.151	3	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|H<1>,1|S<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.7560	0.146	2	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|H<1>,1|S<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4670	0.332	2	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<5>,1|C<2>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>}	H(C[6]C[6]2)	117.8210	0.000	1	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8525	0.332	8	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6475	0.090	2	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	121.2260	0.000	1	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>,2|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.7155	0.164	4	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>,2|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.9776	0.429	11	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>,2|N<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.9430	0.000	1	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<5>,1|C<3>,1|N<3>,1|N<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1760	0.122	2	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4296	0.328	26	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6767	0.109	3	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<6>,1|C<3>,1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7780	0.000	1	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7580	0.361	2	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<6>,1|C<3>,1|N<4>,1|O<2>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	H(C[6]C[6]2)	120.7165	0.122	2	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5200	0.121	3	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Eu<13>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.8967	0.072	4	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<10>,1|C<3>,1|H<1>,1|W<6>,2|C<4>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	119.8090	0.000	1	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<10>,1|Cd<4>,1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8445	0.344	2	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<10>,1|Cr<6>,1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	119.8060	0.000	1	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<10>,1|Mo<6>,1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	119.9500	0.000	1	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<10>,1|Pd<4>,1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7975	0.278	2	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<10>,1|Pt<4>,1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1305	0.333	2	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<10>,1|Ru<6>,1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3287	0.099	3	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<10>,1|Zn<4>,1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9827	0.203	3	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<4>,1|H<1>,1|N<2>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.5110	0.000	1	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.9118	0.065	9	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<5>,1|C<3>,1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	121.4923	0.699	6	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<5>,1|C<3>,1|H<1>,2|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.9790	0.000	1	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<5>,1|C<3>,1|H<1>,2|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5855	0.158	2	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<5>,1|C<3>,1|H<1>,2|N<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.5030	0.488	2	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.7053	0.275	11	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|C<3>,1|C<4>,1|N<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.5410	0.000	1	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6548	0.082	4	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.9647	0.394	3	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.9144	0.361	89	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5716	0.111	7	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.8165	0.153	4	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.9109	0.493	91	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.7226	0.236	8	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|C<3>,1|N<3>,1|N<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4350	0.000	1	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|C<3>,1|N<4>,1|O<2>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5853	0.291	4	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|C<3>,2|H<1>,2|N<4>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	H(C[6]C[6]2)	121.2260	0.000	1	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|H<1>,1|N<3>,1|O<2>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6740	0.180	6	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7656	1.350	28	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	H(C[6]C[6]2)	121.0836	0.898	8	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.8873	0.364	108	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|V<6>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5280	0.000	1	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|V<7>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5940	0.000	1	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Hg<4>,1|C<3>,1|H<1>,2|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3050	0.000	1	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Hg<5>,1|C<3>,1|H<1>,2|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7010	0.000	1	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4465	0.158	2	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1233	1.719	3	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7480	0.000	1	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5619	0.422	16	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.7055	0.333	6	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|C<4>,1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0150	0.000	1	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3640	0.566	26	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.5500	0.165	2	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ir<7>,1|C<3>,1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	121.7210	0.000	1	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ir<7>,1|C<4>,1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1050	0.185	2	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ir<8>,1|C<3>,1|H<1>,2|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.7380	0.000	1	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ir<8>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5958	0.137	6	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ir<8>,1|H<1>,1|O<2>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1590	0.000	1	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ir<9>,1|C<3>,1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.6860	0.139	2	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Li<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1750	0.000	1	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Mn<5>,1|C<3>,1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	121.1090	0.030	2	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Mn<5>,1|C<3>,1|H<1>,2|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5020	0.000	1	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Mn<5>,1|C<3>,1|H<1>,2|N<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.9700	0.215	2	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Mn<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6570	0.000	1	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6655	0.365	11	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5987	0.149	3	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5932	0.235	11	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	H(C[6]C[6]2)	120.4970	0.000	1	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	121.4706	0.650	7	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Mn<6>,1|C<3>,1|N<3>,1|N<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2690	0.146	2	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Mn<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5502	0.203	9	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Mn<8>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.9685	0.067	2	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Mn<8>,1|C<3>,1|H<1>,2|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5740	0.000	1	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Mo<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6330	0.120	5	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Mo<7>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5290	0.000	1	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Nd<12>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2423	0.058	3	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ni<4>,1|C<3>,1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.7740	0.512	4	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ni<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.8230	0.000	1	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ni<5>,1|C<3>,1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	121.3065	0.081	4	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ni<5>,1|C<3>,1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	121.3175	0.470	2	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ni<5>,1|C<3>,1|H<1>,2|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	121.1510	0.000	1	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ni<5>,1|C<3>,1|H<1>,2|N<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.6367	0.087	3	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ni<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.8360	0.153	2	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|C<3>,1|C<4>,1|N<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4820	0.182	2	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.9142	0.122	4	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	121.5750	0.000	1	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	121.3245	0.100	2	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6390	0.068	3	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.8663	0.182	3	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6535	0.115	2	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.7264	0.835	18	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|C<3>,1|N<4>,1|O<2>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8830	0.000	1	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|H<1>,1|N<3>,1|O<2>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.1235	0.392	4	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4432	0.355	5	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ni<7>,1|C<3>,1|H<1>,2|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.1010	0.963	4	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ni<7>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7600	0.000	1	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Os<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.6670	0.968	6	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Os<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7460	0.000	1	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	121.2220	0.468	11	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>,2|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3604	0.190	5	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>,2|N<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.7190	0.000	1	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|C<3>,1|N<3>,1|S<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9140	0.000	1	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|C<3>,1|N<4>,1|O<2>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7467	0.209	4	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1893	0.378	12	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	H(C[6]C[6]2)	120.8620	0.000	1	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.1345	0.129	2	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,1|P<4>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3480	0.000	1	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7190	0.000	1	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,4|C<3>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.6220	0.000	1	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|P<4>,2|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8520	0.081	2	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|Re<8>,1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6060	0.180	2	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>,2|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2960	0.832	4	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>,2|N<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	121.1003	0.341	4	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8485	0.105	2	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|C<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	H(C[6]C[6]2)	120.5510	0.000	1	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6977	0.428	7	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.8680	0.572	27	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,4|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	119.5410	0.088	2	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|Re<8>,1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7195	0.592	2	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|Se<2>,1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3500	0.104	3	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Pt<6>,1|C<3>,1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7267	0.634	3	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Pt<6>,1|C<3>,1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.9150	0.000	1	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Pt<6>,1|H<1>,1|N<3>,1|O<2>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2880	0.004	2	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Re<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8000	0.286	2	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Re<6>,1|C<3>,1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.9265	0.170	2	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Re<6>,1|C<3>,1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4338	0.217	4	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Re<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.6200	1.887	8	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Re<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.4750	0.325	2	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Re<6>,1|C<3>,1|O<2>,1|O<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	H(C[6]C[6]2)	120.8930	0.000	1	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Re<6>,1|C<3>,2|H<1>,2|O<2>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	H(C[6]C[6]2)	121.9340	0.000	1	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Re<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4355	0.292	11	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Re<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.3860	0.000	1	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Re<6>,1|H<1>,1|P<4>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7390	0.181	2	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Rh<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.9465	0.971	2	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Rh<6>,1|C<3>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.8455	0.180	2	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Rh<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	122.1090	0.000	1	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ru<10>,1|Pt<4>,1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.2720	0.000	1	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ru<4>,1|C<3>,1|H<1>,1|O<3>,2|C<4>}	C[6](C[6]C[6]H)2(H){1|Br<1>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	119.7360	0.000	1	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ru<5>,1|C<3>,1|H<1>,1|O<3>,2|C<4>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.5590	0.000	1	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ru<5>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6510	0.000	1	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ru<5>,1|Ru<7>,1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(H){1|Br<1>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	119.8250	0.000	1	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ru<5>,1|Ru<7>,1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8845	0.339	4	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	H(C[6]C[6]2)	121.2800	0.000	1	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.5930	0.000	1	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.1710	0.000	1	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.7480	0.000	1	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	H(C[6]C[6]2)	121.9740	0.000	1	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|C<4>,1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9825	0.111	2	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4736	0.259	20	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.6608	0.260	8	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|H<1>,2|C<3>,2|C<4>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.5270	0.000	1	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|H<1>,2|C<3>,2|C<4>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	H(C[6]C[6]2)	119.9720	0.000	1	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9515	0.209	4	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|Ru<8>,1|C<3>,1|N<3>}	H(C[6]C[6]2)	120.1060	0.000	1	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|Ru<7>,1|C<3>,1|C<4>,1|C<5>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Br<1>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	119.5620	0.000	1	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|Ru<7>,1|C<3>,1|C<4>,1|C<5>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1193	0.180	10	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|Ru<7>,1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.6260	0.000	1	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|Ru<8>,1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(H){1|Br<1>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.0500	0.000	1	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ru<8>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6030	0.000	1	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ru<9>,1|C<3>,1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6900	0.000	1	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ru<9>,1|C<3>,1|H<1>,2|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4324	0.432	5	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ru<9>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5450	0.222	10	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Sm<13>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.4370	0.218	4	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Sn<4>,1|C<3>,1|H<1>,2|N<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.6270	0.014	2	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Yb<12>,1|H<1>,1|S<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.5360	0.000	1	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Zn<4>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.9030	0.122	3	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Zn<4>,1|C<3>,1|H<1>,2|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7838	0.257	5	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Zn<4>,1|C<3>,1|H<1>,2|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.2735	1.001	2	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Zn<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.9146	0.132	13	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Zn<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6182	0.164	10	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Zn<4>,1|H<1>,1|S<2>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.5290	0.000	1	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Zn<5>,1|C<3>,1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	121.1640	0.240	2	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Zn<5>,1|C<3>,1|H<1>,2|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.0016	0.170	5	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Zn<5>,1|C<3>,1|H<1>,2|N<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	121.0625	0.654	11	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Zn<5>,1|C<3>,1|N<3>,1|N<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5790	0.000	1	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Zn<5>,1|C<3>,1|N<4>,1|O<2>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2905	0.220	2	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Zn<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8680	0.000	1	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Zn<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.7105	0.226	6	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Zn<6>,1|C<2>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.0030	0.000	1	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Zn<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7660	0.297	2	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Zn<6>,1|C<3>,1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	121.6890	0.074	2	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Zn<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8305	0.043	2	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Zn<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	121.1346	0.075	10	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Zn<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4807	0.180	3	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){2|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	119.7760	0.000	1	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){2|Ru<7>,1|C<3>,1|C<4>,1|C<5>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9008	0.241	4	120.6936	0.331	1276	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|N<3>,3|C<3>}	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.4440	0.049	2	120.4440	0.002	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]O[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5]O[6])(C[6]C[6]H)(H){1|C<4>,3|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|O<2>,2|H<1>}	H(C[6]C[6]2)	120.0007	0.172	3	120.0007	0.030	3	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]C)(C[6]C[6]H)(H)	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]C)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	H(C[6]C[6]2)	119.8690	0.000	1	119.2040	0.884	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]C)(C[6]C[6]H)(H)	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]C)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	H(C[6]C[6]2)	118.5390	0.000	1	119.2040	0.884	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[5a,6]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H){1|N<3>,2|C<3>}	C[6](C[6]N[5a,6]C[6a])(C[6]C[6]H)(H){1|H<1>,4|C<3>}	H(C[6]C[6]2)	120.7800	0.000	1	120.7800	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.4557	0.905	10	119.7017	1.199	41	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	118.8060	0.000	1	119.7017	1.199	41	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	H(C[6]C[6]2)	119.9550	0.000	1	119.7017	1.199	41	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.7348	0.283	11	119.7017	1.199	41	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.5630	0.178	4	119.7017	1.199	41	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.4104	0.141	5	119.7017	1.199	41	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.2296	2.095	9	119.7017	1.199	41	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]O)(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]O)(C[6]C[6]H)(H){1|C<3>,1|N<3>,1|O<1>}	C[6](C[6]C[5a,6]O)(C[6]C[6]H)(H){1|O<1>,2|C<3>}	H(C[6]C[6]2)	118.7000	0.000	1	118.8020	0.021	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]O)(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]O)(C[6]C[6]H)(H){1|O<1>,2|C<3>}	C[6](C[6]C[5a,6]O)(C[6]C[6]H)(H){1|C<3>,1|N<3>,1|O<1>}	H(C[6]C[6]2)	118.9040	0.000	1	118.8020	0.021	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>,2|N<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Co<6>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.3310	0.041	2	120.3310	0.002	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.8965	1.375	2	120.8965	1.892	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H){1|C<2>,1|N<2>,2|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<2>,1|C<3>}	H(C[6]C[6]2)	127.0740	0.000	1	127.0740	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<4>,2|C<3>}	H(C[6]C[6]2)	120.3010	0.000	1	120.3202	0.219	24	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H){1|C<3>,2|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.8528	0.135	4	120.3202	0.219	24	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H){1|N<2>,1|N<3>,1|O<2>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<6>,2|C<3>}	H(C[6]C[6]2)	121.1270	0.000	1	120.3202	0.219	24	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H){1|N<2>,1|N<3>,1|O<2>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.8480	0.000	1	120.3202	0.219	24	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H){1|N<2>,1|N<3>,1|O<2>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<6>,2|C<3>}	H(C[6]C[6]2)	120.9540	0.000	1	120.3202	0.219	24	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H){1|N<2>,1|N<3>,1|S<2>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<6>,2|C<3>}	H(C[6]C[6]2)	120.8130	0.000	1	120.3202	0.219	24	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H){1|N<2>,2|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<6>,2|C<3>}	H(C[6]C[6]2)	120.5450	0.403	2	120.3202	0.219	24	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H){1|N<2>,2|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<5>,2|C<3>}	H(C[6]C[6]2)	120.6420	0.000	1	120.3202	0.219	24	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H){1|N<2>,2|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.8533	0.089	3	120.3202	0.219	24	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H){1|N<2>,2|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|O<1>,2|C<3>}	H(C[6]C[6]2)	120.7795	0.029	2	120.3202	0.219	24	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H){1|N<2>,2|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<6>,2|C<3>}	H(C[6]C[6]2)	120.6690	0.000	1	120.3202	0.219	24	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H){1|N<3>,2|H<1>,2|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<6>,2|C<3>}	H(C[6]C[6]2)	120.4555	0.111	2	120.3202	0.219	24	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H){1|N<3>,2|H<1>,2|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.9603	0.329	3	120.3202	0.219	24	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H){1|N<3>,2|H<1>,2|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<6>,2|C<3>}	H(C[6]C[6]2)	120.9180	0.000	1	120.3202	0.219	24	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<2>,3|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.4953	0.097	3	119.4953	0.009	3	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|N<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){2|C<3>}	H(C[6]C[6]2)	121.5650	0.000	1	119.1997	2.176	9	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H){1|C<2>,1|N<2>,1|O<2>,2|H<1>}	C[6](C[6]C[6]H)2(H){2|C<3>}	H(C[6]C[6]2)	118.3880	0.000	1	119.1997	2.176	9	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H){1|C<2>,2|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){2|C<3>}	H(C[6]C[6]2)	119.3180	0.000	1	119.1997	2.176	9	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H){1|Cu<4>,1|N<2>,2|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.9800	0.000	1	119.1997	2.176	9	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<2>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<2>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.6930	0.000	1	119.1997	2.176	9	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|O<2>,2|C<3>}	H(C[6]C[6]2)	119.9320	0.000	1	119.1997	2.176	9	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H){1|H<1>,1|O<2>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<2>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8430	0.000	1	119.1997	2.176	9	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H){1|N<3>,2|C<3>,3|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	117.0390	0.000	2	119.1997	2.176	9	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Co<6>,1|N<2>,1|N<3>,2|C<3>}	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>,2|N<3>}	H(C[6]C[6]2)	120.1240	0.000	1	120.1240	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]Br)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Br<1>,1|Ir<6>,1|C<3>,1|N<2>,1|N<3>}	C[6](C[6]C[6]Br)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6690	0.000	1	120.6690	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Cd<6>,1|N<2>,1|N<3>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5310	0.000	1	120.3470	0.025	3	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|C<4>,1|S<2>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2550	0.014	2	120.3470	0.025	3	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|N<3>,1|O<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|N<2>,2|C<3>}	H(C[6]C[6]2)	120.0870	0.000	1	120.0870	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Ag<3>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9460	0.000	1	120.4416	0.714	372	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Al<4>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.7845	0.134	2	120.4416	0.714	372	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Al<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.6230	0.000	1	120.4416	0.714	372	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Al<5>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.8420	0.000	1	120.4416	0.714	372	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Au<4>,1|H<1>,1|S<2>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8110	0.000	1	120.4416	0.714	372	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|B<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.3145	0.128	2	120.4416	0.714	372	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|C<2>,1|H<1>,1|N<2>,1|S<2>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<2>}	H(C[6]C[6]2)	128.2120	0.000	1	120.4416	0.714	372	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9748	0.165	4	120.4416	0.714	372	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>,1|N<3>,1|O<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.3110	0.000	1	120.4416	0.714	372	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	118.5670	0.000	1	120.4416	0.714	372	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|C<3>,1|N<2>,1|N<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2662	0.400	6	120.4416	0.714	372	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|C<3>,1|N<2>,1|S<2>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1860	0.000	1	120.4416	0.714	372	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|C<3>,2|H<1>,2|N<2>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4550	0.132	4	120.4416	0.714	372	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<2>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.4680	0.000	1	120.4416	0.714	372	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Co<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.5410	0.052	2	120.4416	0.714	372	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Co<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4105	0.617	2	120.4416	0.714	372	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Co<5>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6890	0.000	1	120.4416	0.714	372	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Co<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6102	0.287	12	120.4416	0.714	372	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Co<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.4350	0.000	1	120.4416	0.714	372	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Cu<3>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2630	0.000	1	120.4416	0.714	372	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Cu<3>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4125	0.047	2	120.4416	0.714	372	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.8590	0.000	1	120.4416	0.714	372	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6843	0.178	8	120.4416	0.714	372	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2155	0.306	4	120.4416	0.714	372	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.7510	0.386	2	120.4416	0.714	372	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|H<1>,1|O<2>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8890	0.000	1	120.4416	0.714	372	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|H<1>,1|O<2>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	121.7840	0.000	1	120.4416	0.714	372	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.9850	0.000	1	120.4416	0.714	372	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Cu<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7580	1.399	9	120.4416	0.714	372	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Cu<5>,1|H<1>,1|N<4>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7850	0.397	2	120.4416	0.714	372	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Cu<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.0540	0.000	1	120.4416	0.714	372	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Cu<6>,1|C<3>,1|H<1>,1|N<2>,1|O<2>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	127.0860	0.000	1	120.4416	0.714	372	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Fe<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.8157	0.251	3	120.4416	0.714	372	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Fe<5>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.8455	0.098	2	120.4416	0.714	372	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Fe<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3805	0.062	2	120.4416	0.714	372	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Fe<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.9310	0.000	1	120.4416	0.714	372	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4928	0.238	9	120.4416	0.714	372	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	H(C[6]C[6]2)	121.0470	1.873	4	120.4416	0.714	372	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.6600	0.000	1	120.4416	0.714	372	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.7930	0.000	1	120.4416	0.714	372	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Fe<8>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.8989	0.342	12	120.4416	0.714	372	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	118.9977	0.282	3	120.4416	0.714	372	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Ir<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7940	0.000	1	120.4416	0.714	372	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4112	0.350	23	120.4416	0.714	372	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1089	0.232	15	120.4416	0.714	372	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|H<1>,1|S<2>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0108	0.305	17	120.4416	0.714	372	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Ir<7>,1|H<1>,1|S<2>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0947	0.060	3	120.4416	0.714	372	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6728	0.092	4	120.4416	0.714	372	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.5243	0.667	3	120.4416	0.714	372	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Mn<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3270	0.000	1	120.4416	0.714	372	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|N<2>,2|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0400	0.730	6	120.4416	0.714	372	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6540	0.000	1	120.4416	0.714	372	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Ni<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3663	0.344	3	120.4416	0.714	372	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Ni<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.7210	0.139	3	120.4416	0.714	372	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Ni<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2767	0.113	3	120.4416	0.714	372	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6790	0.000	1	120.4416	0.714	372	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7027	0.869	4	120.4416	0.714	372	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Os<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4526	0.362	5	120.4416	0.714	372	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Os<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9763	0.123	3	120.4416	0.714	372	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Os<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	H(C[6]C[6]2)	120.4105	0.284	2	120.4416	0.714	372	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Os<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.5600	0.222	4	120.4416	0.714	372	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Os<7>,1|H<1>,1|N<2>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.6970	0.000	1	120.4416	0.714	372	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Os<7>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0565	0.351	4	120.4416	0.714	372	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5875	0.343	2	120.4416	0.714	372	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0633	0.269	22	120.4416	0.714	372	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.8490	0.045	2	120.4416	0.714	372	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,1|S<2>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.1223	1.452	7	120.4416	0.714	372	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.6687	0.179	3	120.4416	0.714	372	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Pd<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1255	0.255	2	120.4416	0.714	372	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Pt<3>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	121.0250	0.076	2	120.4416	0.714	372	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	121.0416	0.113	5	120.4416	0.714	372	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.7745	0.466	2	120.4416	0.714	372	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3576	0.330	12	120.4416	0.714	372	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.8688	0.434	8	120.4416	0.714	372	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,1|S<2>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.7074	0.276	7	120.4416	0.714	372	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,1|S<2>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1318	0.299	13	120.4416	0.714	372	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.5780	0.473	4	120.4416	0.714	372	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Pt<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3386	0.572	5	120.4416	0.714	372	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Re<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6250	0.000	1	120.4416	0.714	372	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Re<6>,1|H<1>,1|N<2>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.7290	0.000	1	120.4416	0.714	372	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Re<6>,1|H<1>,1|S<2>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9270	0.000	1	120.4416	0.714	372	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Rh<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7630	0.000	1	120.4416	0.714	372	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5475	0.052	2	120.4416	0.714	372	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	H(C[6]C[6]2)	120.9310	0.249	5	120.4416	0.714	372	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2260	0.000	1	120.4416	0.714	372	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Ru<8>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1044	0.263	10	120.4416	0.714	372	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Sn<3>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4461	0.617	14	120.4416	0.714	372	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Sn<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3517	0.252	3	120.4416	0.714	372	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Zn<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2823	0.174	3	120.4416	0.714	372	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Zn<5>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6808	0.153	5	120.4416	0.714	372	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Zn<5>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	124.5500	0.000	1	120.4416	0.714	372	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Zn<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5980	0.192	2	120.4416	0.714	372	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Zn<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.8230	0.000	1	120.4416	0.714	372	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Zn<6>,1|C<3>,1|H<1>,1|N<2>,1|O<2>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	123.9180	0.000	1	120.4416	0.714	372	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5x3,5x5,20x6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5x3,5x5,20x6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<5>,1|H<1>,1|N<3>,4|B<6>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|C<6>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.2260	0.000	1	120.4673	0.168	3	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5x3,5x5,20x6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5x3,5x5,20x6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<6>,1|H<1>,1|N<3>,4|B<6>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|C<6>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.5880	0.499	2	120.4673	0.168	3	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5x3,5x5,20x6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5x3,5x5,20x6]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|C<3>,1|C<6>,1|H<1>,4|B<6>}	C[6](C[6]C[6]H)2(H){1|C<6>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.4100	0.000	1	119.4100	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]B)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]N)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]B)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6,6]N)(C[6]C[6]H)(H){1|B<3>,1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	117.6070	0.000	1	117.6070	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]C)(C[6]C[6]H)(H){1|O<2>,3|C<4>}	C[6](C[6]C[6,6]C)(C[6]C[6]H)(H){2|C<3>,2|C<4>}	H(C[6]C[6]2)	119.2180	0.000	1	119.2155	0.000	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]C)(C[6]C[6]H)(H){2|C<3>,2|C<4>}	C[6](C[6]C[6,6]C)(C[6]C[6]H)(H){1|O<2>,3|C<4>}	H(C[6]C[6]2)	119.2130	0.000	1	119.2155	0.000	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]C)(C[6]C[6]H)(H){1|Ru<11>,1|H<1>,2|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Ru<11>,1|C<2>,2|C<4>}	H(C[6]C[6]2)	118.8415	0.021	2	119.0350	0.113	3	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]C)(C[6]C[6]H)(H){2|C<4>,2|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<3>,3|C<4>}	H(C[6]C[6]2)	119.4220	0.000	1	119.0350	0.113	3	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]C)(C[6]C[6]H)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	119.0530	0.000	1	119.0530	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]C[5])(C[6]C[6]H)(H){1|Zr<11>,1|C<3>,1|H<1>,1|N<3>,2|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){3|C<4>}	H(C[6]C[6]2)	123.6510	0.000	1	123.6510	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<4>,1|N<3>,1|N<4>,3|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.7065	0.145	2	119.7065	0.021	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]C[6a])(C[6]C[6]H)(H){1|Ru<11>,1|H<1>,2|C<3>,2|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Ru<11>,1|C<3>,2|C<4>}	H(C[6]C[6]2)	118.7370	0.000	1	118.7370	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]Cl)(C[6]C[6]H)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]Cl)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|Cl<1>,2|C<3>}	H(C[6]C[6]2)	120.4430	0.000	1	120.4430	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<4>,1|O<2>,2|H<1>}	C[6](C[6]C[5,6,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.1750	0.000	1	119.1750	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<3>,3|C<4>}	C[6](C[6]C[6,6]C)(C[6]C[6]H)(H){2|C<4>,2|H<1>}	H(C[6]C[6]2)	120.1930	0.000	1	119.9040	0.226	3	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Ru<11>,1|C<2>,2|C<4>}	C[6](C[6]C[6,6]C)(C[6]C[6]H)(H){1|Ru<11>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.7595	0.572	2	119.9040	0.226	3	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){3|C<4>}	C[6](C[6]C[6,6]C[5])(C[6]C[6]H)(H){1|Zr<11>,1|C<3>,1|H<1>,1|N<3>,2|C<4>}	H(C[6]C[6]2)	121.4330	0.000	1	121.4330	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Ru<11>,1|C<3>,2|C<4>}	C[6](C[6]C[6,6]C[6a])(C[6]C[6]H)(H){1|Ru<11>,1|H<1>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	120.1630	0.000	1	120.1630	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|As<3>,1|Mo<9>,1|C<4>,1|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Mo<9>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	120.1020	0.000	1	119.3715	2.903	71	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Ce<16>,1|H<1>,2|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Ce<16>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	120.2005	0.125	2	119.3715	2.903	71	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Cr<9>,1|H<1>,2|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Cr<9>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.5225	0.059	2	119.3715	2.903	71	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Dy<16>,1|H<1>,2|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Dy<16>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	120.0760	0.232	2	119.3715	2.903	71	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Fe<11>,1|H<1>,2|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Fe<11>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.7215	0.166	2	119.3715	2.903	71	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Rh<7>,1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.0700	0.000	1	119.3715	2.903	71	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Zr<14>,1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1880	0.000	1	119.3715	2.903	71	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Mo<9>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Mo<9>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7860	0.498	4	119.3715	2.903	71	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Mo<9>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Mo<9>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.5250	0.000	1	119.3715	2.903	71	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Mo<9>,1|H<1>,2|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|As<3>,1|Mo<9>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	118.0530	0.000	1	119.3715	2.903	71	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Mo<9>,1|H<1>,2|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Mo<9>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9780	0.000	1	119.3715	2.903	71	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Mo<9>,1|H<1>,2|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Mo<9>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	114.5810	5.642	4	119.3715	2.903	71	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Re<12>,1|H<1>,2|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Re<12>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.4670	0.077	3	119.3715	2.903	71	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Re<9>,1|H<1>,2|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Re<9>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.5065	0.042	2	119.3715	2.903	71	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Rh<7>,1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.7170	0.000	1	119.3715	2.903	71	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Rh<8>,1|H<1>,2|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Rh<8>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.4010	0.035	2	119.3715	2.903	71	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Rh<9>,1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Rh<9>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.0900	0.000	1	119.3715	2.903	71	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Rh<9>,1|H<1>,2|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Rh<9>,1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.1820	0.000	1	119.3715	2.903	71	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Ru<10>,1|H<1>,2|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Ru<10>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.6720	0.322	8	119.3715	2.903	71	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Ru<11>,1|H<1>,2|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Ru<11>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.5458	0.331	22	119.3715	2.903	71	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Y<16>,1|H<1>,2|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Y<16>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	120.0410	0.437	2	119.3715	2.903	71	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Zr<14>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.5450	0.000	1	119.3715	2.903	71	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){2|Li<7>,1|B<5>,1|C<5>,1|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){2|Li<7>,1|B<5>,1|C<5>,1|H<1>}	H(C[6]C[6]2)	120.0215	0.121	2	119.3715	2.903	71	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){2|Li<8>,1|B<5>,1|C<5>,1|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){2|Li<8>,1|B<5>,1|C<5>,1|H<1>}	H(C[6]C[6]2)	119.9228	0.061	4	119.3715	2.903	71	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<1>}	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.1055	1.438	4	118.6180	2.738	5	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|O<1>,2|C<3>}	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	116.6680	0.000	1	118.6180	2.738	5	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]Os)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Os<8>,1|C<3>,1|C<4>}	C[6](C[6]C[6,6]Os)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	118.2940	0.532	2	118.2940	0.283	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|H<1>,1|P<4>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.2570	0.000	1	120.2570	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[6,6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]N[6,6]C)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2375	0.298	2	120.0172	0.096	5	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[6,6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|N<3>,2|C<3>}	C[6](C[6]N[6,6]C)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.8703	0.257	3	120.0172	0.096	5	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|N<3>,2|C<3>}	C[6](C[6]N[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,2|N<2>}	H(C[6]C[6]2)	120.3660	0.000	1	120.3660	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[6,6]Cl)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Cl<1>,1|N<2>,1|N<3>}	C[6](C[6]N[6,6]Cl)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1610	0.000	1	120.1610	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2319	0.261	63	120.1934	0.262	150	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.9238	0.954	24	120.1934	0.262	150	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|Ge<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1718	0.135	4	120.1934	0.262	150	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.6053	0.138	3	120.1934	0.262	150	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|Nb<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4080	0.000	1	120.1934	0.262	150	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5616	0.339	9	120.1934	0.262	150	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.1357	0.293	3	120.1934	0.262	150	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<3>}	H(C[6]C[6]2)	121.1410	0.000	1	120.1934	0.262	150	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|Ga<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3630	0.007	2	120.1934	0.262	150	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|Ga<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3485	0.187	2	120.1934	0.262	150	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|Ge<3>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1605	0.193	2	120.1934	0.262	150	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.9950	0.000	1	120.1934	0.262	150	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|In<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3415	0.204	2	120.1934	0.262	150	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<4>,1|N<3>,2|H<1>}	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.5965	0.084	2	120.1934	0.262	150	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1539	0.204	12	120.1934	0.262	150	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.4437	0.279	3	120.1934	0.262	150	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|Ge<3>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1277	0.193	3	120.1934	0.262	150	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|N<4>}	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.4570	0.000	1	120.1934	0.262	150	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8780	0.000	1	120.1934	0.262	150	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.9280	0.000	1	120.1934	0.262	150	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1880	0.252	3	120.1934	0.262	150	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.5675	1.401	2	120.1934	0.262	150	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.4190	0.000	1	120.1934	0.262	150	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|In<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5095	0.005	2	120.1934	0.262	150	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){2|H<1>,2|N<3>}	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.5715	0.189	2	120.1934	0.262	150	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[6,6]O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<4>,1|N<3>,1|O<2>}	C[6](C[6]N[6,6]O)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.5355	0.422	2	119.5355	0.178	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[6,6]S)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<4>,1|N<3>,1|S<1>}	C[6](C[6]N[6,6]S)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	121.4700	0.000	1	121.4700	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]N)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]B)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]N)(C[6]C[6]H)(H){1|B<3>,1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6,6]B)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0350	0.000	1	120.0350	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]N)(C[6]C[6]H)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]N)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	119.4450	0.000	1	119.8855	0.388	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]N)(C[6]C[6]H)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]N)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.3260	0.000	1	119.8855	0.388	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|O<1>,2|C<3>}	H(C[6]C[6]2)	121.7590	0.000	1	120.1602	1.826	5	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<1>}	H(C[6]C[6]2)	119.7605	1.170	4	120.1602	1.826	5	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<1>}	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<1>}	H(C[6]C[6]2)	119.5395	0.016	2	119.9061	2.125	12	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<1>}	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H){1|O<1>,2|C<3>}	H(C[6]C[6]2)	119.1410	0.000	2	119.9061	2.125	12	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H){1|Cr<9>,1|O<1>,2|C<4>}	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H){1|Cr<9>,1|O<1>,2|C<4>}	H(C[6]C[6]2)	122.9050	1.162	2	119.9061	2.125	12	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H){1|H<1>,1|O<1>,2|C<4>}	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H){1|H<1>,1|O<1>,2|C<4>}	H(C[6]C[6]2)	119.0375	0.296	2	119.9061	2.125	12	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H){1|O<1>,2|C<3>}	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<1>}	H(C[6]C[6]2)	119.3750	0.000	2	119.9061	2.125	12	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H){1|O<1>,2|C<3>}	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H){1|O<2>,2|C<3>}	H(C[6]C[6]2)	119.4170	0.000	1	119.9061	2.125	12	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H){1|O<2>,2|C<3>}	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H){1|O<1>,2|C<3>}	H(C[6]C[6]2)	119.4600	0.000	1	119.9061	2.125	12	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H){1|C<3>,1|O<2>,2|C<4>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<4>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	119.5050	0.000	1	119.5050	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|O<2>}	H(C[6]C[6]2)	120.3640	0.252	2	119.9844	0.143	7	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|O<2>,2|C<3>}	H(C[6]C[6]2)	119.7313	0.249	4	119.9844	0.143	7	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|O<3>,2|C<3>}	H(C[6]C[6]2)	120.2380	0.000	1	119.9844	0.143	7	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]Os)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]Os)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Os<8>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	120.0260	0.249	2	120.0260	0.062	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]C[6]H)(H)	C[6](C[6]N[6,6a]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6,6a]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	119.5090	0.000	1	119.5555	0.004	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]C[6]H)(H)	C[6](C[6]N[6,6a]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]N[6,6a]H)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	H(C[6]C[6]2)	119.6020	0.000	1	119.5555	0.004	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]C[6,6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C[6,6])(C[6]C[6]H)(H){1|O<1>,2|C<3>,2|C<4>}	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(H){3|C<3>}	H(C[6]C[6]2)	118.4430	0.000	1	118.4430	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<1>,3|C<3>}	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	H(C[6]C[6]2)	118.6560	0.000	1	118.6560	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]N[6,6a]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]N[6,6a]H)(C[6]C[6]H)(H){3|C<3>}	H(C[6]C[6]2)	119.6945	0.056	2	119.6945	0.003	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]Cl)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]Cl)(C[6]C[6]H)(H){1|O<1>,2|C<3>}	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(H){1|Cl<1>,1|C<3>,1|N<2>}	H(C[6]C[6]2)	119.8420	0.000	1	119.8420	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H){1|O<1>,2|C<3>}	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.1910	0.154	4	119.1910	0.024	4	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H)	C[6](C[6]N[6,6a]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]N[6,6a]C)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.8710	0.000	1	120.8710	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H)	C[6](C[6]N[6,6a]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6,6a]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1610	0.000	1	120.1489	0.506	14	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H)	C[6](C[6]N[6,6a]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6,6a]H)(C[6]C[6]H)(H){1|Ge<3>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1660	0.000	1	120.1489	0.506	14	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H)	C[6](C[6]N[6,6a]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6,6a]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3583	0.344	9	120.1489	0.506	14	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H)	C[6](C[6]N[6,6a]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]N[6,6a]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.1400	1.788	2	120.1489	0.506	14	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H)	C[6](C[6]N[6,6a]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[6]N[6,6a]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.2530	0.000	1	120.1489	0.506	14	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H)	C[6](C[6]N[6,6a]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H){1|Ru<7>,1|C<3>,1|N<4>}	C[6](C[6]N[6,6a]Ru)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.0430	0.000	1	119.0430	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]N)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]N)(C[6]C[6]H)(H){1|O<1>,2|C<3>}	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(H){1|C<3>,2|N<2>}	H(C[6]C[6]2)	118.9340	0.000	1	118.5695	0.266	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]N)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]N)(C[6]C[6]H)(H){1|O<1>,2|C<3>}	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(H){1|N<2>,2|C<3>}	H(C[6]C[6]2)	118.2050	0.000	1	118.5695	0.266	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]C[6,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(H){3|C<3>}	C[6](C[6]C[6,6a]C[6,6])(C[6]C[6]H)(H){1|O<1>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	118.8570	0.000	1	118.8570	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]Cl)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(H){1|Cl<1>,1|C<3>,1|N<2>}	C[6](C[6]C[6,6a]Cl)(C[6]C[6]H)(H){1|O<1>,2|C<3>}	H(C[6]C[6]2)	118.7800	0.000	1	118.7800	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H){1|O<1>,2|C<3>}	H(C[6]C[6]2)	119.1095	0.295	4	119.1095	0.087	4	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]N)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(H){1|C<3>,2|N<2>}	C[6](C[6]C[6,6a]N)(C[6]C[6]H)(H){1|O<1>,2|C<3>}	H(C[6]C[6]2)	118.8310	0.000	1	119.1530	0.207	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]N)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(H){1|N<2>,2|C<3>}	C[6](C[6]C[6,6a]N)(C[6]C[6]H)(H){1|O<1>,2|C<3>}	H(C[6]C[6]2)	119.4750	0.000	1	119.1530	0.207	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(H){1|O<1>,2|C<3>}	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(H){1|O<1>,2|C<3>}	H(C[6]C[6]2)	119.1672	0.969	62	119.1672	0.939	62	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6]H)(H){1|H<1>,4|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	118.4710	0.540	2	118.4710	0.292	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.6800	0.000	1	118.8500	0.278	9	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6]H)(H){1|H<1>,1|O<1>,2|C<3>,2|C<4>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.1522	0.183	4	118.8500	0.278	9	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6]H)(H){1|H<1>,1|O<1>,3|C<3>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	118.3402	0.095	4	118.8500	0.278	9	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<6>,2|C<3>}	H(C[6]C[6]2)	120.1354	0.641	10	120.1354	0.411	10	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>,3|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	120.4660	0.000	1	120.0672	0.184	9	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<6>,2|C<3>}	H(C[6]C[6]2)	120.5340	0.000	1	120.0672	0.184	9	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.7456	0.275	5	120.0672	0.184	9	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6]H)(H){1|Pd<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<4>,2|C<3>}	H(C[6]C[6]2)	120.4385	0.039	2	120.0672	0.184	9	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6]H)(H){1|Au<4>,1|C<2>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){2|C<3>}	H(C[6]C[6]2)	119.5040	0.000	1	119.8462	4.244	29	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6]H)(H){1|C<2>,1|C<4>,1|N<3>,1|O<2>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>}	H(C[6]C[6]2)	118.3770	0.000	1	119.8462	4.244	29	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6]H)(H){1|C<2>,1|C<4>,1|N<3>,3|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>}	H(C[6]C[6]2)	126.2590	0.000	1	119.8462	4.244	29	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6]H)(H){1|C<2>,2|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){2|C<3>}	H(C[6]C[6]2)	123.2500	1.622	2	119.8462	4.244	29	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>,2|N<3>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	118.9210	0.000	1	119.8462	4.244	29	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6]H)(H){1|C<4>,1|O<2>,1|S<2>,1|S<3>,3|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|O<2>,2|C<4>}	H(C[6]C[6]2)	115.6270	0.000	1	119.8462	4.244	29	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6]H)(H){1|Fe<5>,1|Fe<6>,1|C<3>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|Fe<6>,1|C<4>,2|C<3>}	H(C[6]C[6]2)	120.6780	0.987	3	119.8462	4.244	29	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6]H)(H){1|H<1>,4|C<3>}	C[6](C[6]C[6]H)2(H){1|C<2>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	115.9740	0.000	1	119.8462	4.244	29	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6]H)(H){1|H<1>,4|C<3>}	C[6](C[6]C[6]H)2(H){1|O<1>,2|C<3>}	H(C[6]C[6]2)	119.5900	0.154	2	119.8462	4.244	29	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6]H)(H){1|Li<3>,1|Li<4>,1|C<4>,1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<4>,2|C<3>}	H(C[6]C[6]2)	120.0370	0.000	1	119.8462	4.244	29	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6]H)(H){1|Li<4>,1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.5520	0.000	1	119.8462	4.244	29	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6]H)(H){1|Li<5>,1|Ni<7>,1|C<4>,1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|C<4>}	H(C[6]C[6]2)	120.1550	0.000	1	119.8462	4.244	29	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6]H)(H){1|Pr<17>,1|C<3>,1|H<1>,1|O<2>,2|C<4>}	C[6](C[6]C[6]H)2(H){1|C<3>,2|C<4>}	H(C[6]C[6]2)	121.3350	0.000	1	119.8462	4.244	29	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6]H)(H){1|Pr<17>,1|C<4>,1|H<1>,1|O<2>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,2|C<4>}	H(C[6]C[6]2)	120.2920	0.000	1	119.8462	4.244	29	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6]H)(H){1|Pr<17>,1|C<4>,1|H<1>,1|O<2>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<4>,2|C<3>}	H(C[6]C[6]2)	119.8920	0.000	1	119.8462	4.244	29	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6]H)(H){1|Pr<17>,1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.0680	0.000	1	119.8462	4.244	29	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6]H)(H){1|Rh<6>,1|C<2>,1|C<3>,1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>}	H(C[6]C[6]2)	120.5830	0.000	1	119.8462	4.244	29	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6]H)(H){1|Se<2>,1|C<2>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<2>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	117.6930	0.000	1	119.8462	4.244	29	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6]H)(H){1|Th<12>,1|C<3>,1|H<1>,1|O<2>,2|C<4>}	C[6](C[6]C[6]H)2(H){1|C<3>,2|C<4>}	H(C[6]C[6]2)	119.8080	0.000	1	119.8462	4.244	29	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6]H)(H){1|Ti<10>,1|C<4>,1|H<1>,1|O<2>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<4>,2|C<3>}	H(C[6]C[6]2)	119.1250	0.220	6	119.8462	4.244	29	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.1470	0.460	15	120.1470	0.212	15	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]As)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]As)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|As<3>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.5510	0.000	1	119.5510	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]As)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]As)(C[6]C[6]H)(H){1|C<2>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|As<3>,1|C<2>}	H(C[6]C[6]2)	121.0820	0.000	1	120.6933	20.536	7	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]As)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]As)(C[6]C[6]H)(H){1|C<2>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|As<4>,1|C<3>}	H(C[6]C[6]2)	122.3470	2.937	2	120.6933	20.536	7	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]As)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]As)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|As<3>,1|C<2>,1|H<1>}	H(C[6]C[6]2)	124.0690	0.000	1	120.6933	20.536	7	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]As)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]As)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|As<4>,1|C<2>,1|H<1>}	H(C[6]C[6]2)	118.3360	6.360	3	120.6933	20.536	7	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]B)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]B)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<3>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	119.7890	0.000	1	119.4912	0.232	17	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]B)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]B)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<3>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.3012	0.195	13	119.4912	0.232	17	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]B)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]B)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,2|B<4>}	H(C[6]C[6]2)	120.6415	0.185	2	119.4912	0.232	17	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]B)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]B)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<6>,1|B<4>,1|C<3>}	H(C[6]C[6]2)	119.3620	0.000	1	119.4912	0.232	17	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]B)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]O[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]B)(C[6]C[6]H)(H){1|C<3>,2|O<2>}	C[6](C[6]C[6]H)(C[6]O[6]O)(H){1|B<4>,1|C<3>}	H(C[6]C[6]2)	117.8130	0.191	2	117.9057	0.044	3	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]B)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]O[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]B)(C[6]C[6]H)(H){1|C<4>,2|O<2>}	C[6](C[6]C[6]H)(C[6]O[6]O)(H){1|B<4>,1|C<3>}	H(C[6]C[6]2)	118.0910	0.000	1	117.9057	0.044	3	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]B)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]B)(C[6]C[6]H)(H){1|C<2>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|B<4>,1|C<3>}	H(C[6]C[6]2)	119.7456	2.745	5	118.9606	2.733	16	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]B)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]B)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|B<4>,1|C<2>,1|H<1>}	H(C[6]C[6]2)	116.3360	0.000	1	118.9606	2.733	16	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]B)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]B)(C[6]C[6]H)(H){1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|B<4>,1|C<3>,2|H<1>}	H(C[6]C[6]2)	118.7500	0.000	1	118.9606	2.733	16	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]B)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]B)(C[6]C[6]H)(H){1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Fe<5>,1|C<3>,2|B<4>}	H(C[6]C[6]2)	119.1320	0.000	1	118.9606	2.733	16	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]B)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]B)(C[6]C[6]H)(H){1|Dy<16>,1|C<4>,1|H<1>,1|H<2>}	C[6](C[6]C[6]H)2(H){1|Dy<16>,1|B<4>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	118.7807	0.382	4	118.9606	2.733	16	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]B)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]B)(C[6]C[6]H)(H){1|Tb<16>,1|C<4>,1|H<1>,1|H<2>}	C[6](C[6]C[6]H)2(H){1|Tb<16>,1|B<4>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	118.8253	0.236	4	118.9606	2.733	16	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]B)(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]B)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|B<3>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.5020	0.000	1	119.5020	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]B)(C[6]C[6]H)(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]B)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|B<3>,3|C<3>}	H(C[6]C[6]2)	119.9920	0.000	1	119.9920	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Be)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Be)(C[6]C[6]H)(H){1|C<2>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Be<3>,1|C<3>}	H(C[6]C[6]2)	119.4150	0.000	1	119.4150	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]H)(H)	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]H)(H){1|C<2>,1|C<4>,1|H<1>}	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H){1|Br<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.2980	0.000	1	120.2980	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]H)(H)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Br<1>,1|Ir<6>,1|C<3>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	119.8650	0.000	1	119.8650	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]H)(H){2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Br<1>,1|C<2>,1|H<1>}	H(C[6]C[6]2)	123.3625	7.813	2	123.3625	61.040	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Br<1>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	119.8950	0.000	1	120.4203	2.598	9	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Br<1>,2|C<3>}	H(C[6]C[6]2)	120.4860	1.710	8	120.4203	2.598	9	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Br<1>,1|C<3>,1|O<1>}	H(C[6]C[6]2)	121.4070	0.000	1	121.1118	0.109	13	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Br<1>,1|Fe<6>,1|C<3>}	H(C[6]C[6]2)	121.2305	0.170	6	121.1118	0.109	13	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Br<1>,1|Ni<6>,1|C<3>}	H(C[6]C[6]2)	120.9438	0.406	6	121.1118	0.109	13	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Br<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0160	0.000	1	120.7175	0.359	53	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Br<1>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	120.8256	0.282	15	120.7175	0.359	53	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Br<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4990	0.470	25	120.7175	0.359	53	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Br<1>,1|C<3>,1|O<1>}	H(C[6]C[6]2)	121.0530	1.674	4	120.7175	0.359	53	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Br<1>,1|Co<6>,1|C<3>}	H(C[6]C[6]2)	121.0670	0.000	1	120.7175	0.359	53	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Br<1>,1|Cu<4>,1|C<3>}	H(C[6]C[6]2)	121.0010	0.000	1	120.7175	0.359	53	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Br<1>,1|Cu<5>,1|C<3>}	H(C[6]C[6]2)	121.3410	0.000	1	120.7175	0.359	53	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Br<1>,1|Ni<6>,1|C<3>}	H(C[6]C[6]2)	121.0400	0.195	2	120.7175	0.359	53	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Br<1>,1|Pd<4>,1|C<3>}	H(C[6]C[6]2)	121.3065	0.093	2	120.7175	0.359	53	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Br<1>,1|Pt<6>,1|C<3>}	H(C[6]C[6]2)	120.8360	0.000	1	120.7175	0.359	53	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]I)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]H)(H){1|H<1>,1|I<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]I)(H){1|Br<1>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	120.4520	0.000	1	120.4520	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Br<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3730	0.028	2	120.0328	10.206	25	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Br<1>,1|Os<9>,1|C<3>}	H(C[6]C[6]2)	121.0127	0.318	3	120.0328	10.206	25	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Br<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1062	0.155	16	120.0328	10.206	25	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Br<1>,1|Re<6>,1|C<3>}	H(C[6]C[6]2)	120.3510	0.000	1	120.0328	10.206	25	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Br<1>,1|Zn<4>,1|C<3>}	H(C[6]C[6]2)	120.4380	0.000	1	120.0328	10.206	25	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]H)(H){1|N<3>,2|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Br<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	117.2740	15.023	2	120.0328	10.206	25	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(H){1|Br<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1850	0.000	1	121.1445	1.841	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Br<1>,1|C<2>,1|N<3>}	H(C[6]C[6]2)	122.1040	0.000	1	121.1445	1.841	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Br<1>,1|Ir<6>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.2500	1.452	3	120.6683	0.783	8	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Br<1>,1|Re<6>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.7870	0.444	2	120.6683	0.783	8	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Br<1>,1|Ru<6>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.9120	0.337	2	120.6683	0.783	8	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Br<1>,1|C<3>,1|C<4>,1|H<1>,1|O<1>,1|O<2>}	H(C[6]C[6]2)	121.1980	0.000	1	120.6683	0.783	8	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]H)(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Br<1>,1|Ir<6>,3|C<3>}	H(C[6]C[6]2)	120.2540	0.000	1	120.2540	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]H)(H)	C[6](C[6]N[6]Br)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]H)(H){1|Br<1>,1|H<1>,1|N<3>}	C[6](C[6]N[6]Br)(C[6]C[6]H)(H){1|Br<1>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	120.6573	0.362	3	120.4513	0.257	4	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]H)(H)	C[6](C[6]N[6]Br)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]H)(H){1|Br<1>,1|H<1>,1|N<3>}	C[6](C[6]N[6]Br)(C[6]C[6]H)(H){1|Br<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8330	0.000	1	120.4513	0.257	4	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[3x3,3x5,12x6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|C<6>,1|H<1>}	C[6](C[6]C[3x3,3x5,12x6]C[6])(C[6]C[6]H)(H){1|Rh<10>,1|H<1>,2|C<3>,4|B<6>}	H(C[6]C[6]2)	122.9885	1.347	2	122.9885	1.815	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<4>,3|C<3>}	H(C[6]C[6]2)	117.8990	0.000	1	117.8990	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|C<4>}	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H){1|Fe<10>,1|H<1>,2|C<2>,2|C<4>}	H(C[6]C[6]2)	119.8020	0.000	1	119.6375	0.054	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){2|C<3>}	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H){1|Ir<6>,1|C<2>,1|C<4>,2|N<3>}	H(C[6]C[6]2)	119.4730	0.000	1	119.6375	0.054	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|C<3>,1|C<4>,2|N<3>}	H(C[6]C[6]2)	119.9760	0.371	2	119.9064	0.590	14	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<5>,1|C<3>,1|C<4>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	119.7270	0.000	1	119.9064	0.590	14	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|C<2>,1|C<3>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.5930	0.000	1	119.9064	0.590	14	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Os<6>,1|C<3>,1|C<4>,2|N<3>}	H(C[6]C[6]2)	119.8327	0.933	9	119.9064	0.590	14	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Zn<6>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.9240	0.000	1	119.9064	0.590	14	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[5]O[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|O<2>,2|H<1>}	C[6](C[6]C[5]O[6])(C[6]C[6]H)(H){1|C<4>,3|C<3>}	H(C[6]C[6]2)	120.2803	0.186	3	120.2803	0.035	3	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	118.6760	0.509	2	118.6760	0.259	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Cd<6>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.1530	0.000	1	120.0250	0.050	3	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|C<4>,1|S<2>,2|C<3>}	H(C[6]C[6]2)	119.9610	0.273	2	120.0250	0.050	3	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]2)(C[6]C[6]H)(H){1|H<1>,4|C<3>}	H(C[6]C[6]2)	119.9705	1.047	2	119.9705	1.097	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]Br)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Br<1>,1|C<2>,1|H<1>}	C[6](C[6]C[6]Br)(C[6]C[6]H)(H){2|C<3>}	H(C[6]C[6]2)	117.7905	1.025	2	117.7905	1.050	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|H<1>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|C<4>}	H(C[6]C[6]2)	121.9020	0.000	1	119.3198	4.425	29	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<2>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|C<4>}	H(C[6]C[6]2)	121.2597	1.434	3	119.3198	4.425	29	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.2300	0.000	1	119.3198	4.425	29	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	116.8620	2.663	2	119.3198	4.425	29	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Ir<7>,1|C<3>,1|C<4>,1|H<2>}	H(C[6]C[6]2)	118.5920	0.000	1	119.3198	4.425	29	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|C<4>,2|H<1>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	118.8220	0.000	1	119.3198	4.425	29	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|C<4>,2|H<1>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.2970	0.000	1	119.3198	4.425	29	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	115.9630	0.000	1	119.3198	4.425	29	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<2>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.4280	3.148	3	119.3198	4.425	29	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.0450	2.348	2	119.3198	4.425	29	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.1655	3.838	4	119.3198	4.425	29	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Ir<7>,1|C<3>,1|C<4>,1|H<2>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.3150	0.000	1	119.3198	4.425	29	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|La<18>,1|C<3>,1|C<4>,1|O<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|La<18>,1|C<3>,1|C<4>,1|O<3>}	H(C[6]C[6]2)	119.5887	0.222	6	119.3198	4.425	29	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|U<14>,1|C<3>,1|C<4>,1|O<2>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|U<14>,1|C<3>,1|C<4>,1|O<2>}	H(C[6]C[6]2)	119.4500	0.000	1	119.3198	4.425	29	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){2|C<4>,2|H<1>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.6330	0.000	1	119.3198	4.425	29	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Cl<1>,1|C<2>,1|H<1>}	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|C<3>,1|C<4>}	H(C[6]C[6]2)	124.2213	5.703	3	121.6478	25.429	6	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Cl<1>,1|C<2>,1|H<1>}	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){2|C<3>}	H(C[6]C[6]2)	119.5610	0.000	1	121.6478	25.429	6	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Cl<1>,1|C<3>}	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|C<2>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	122.1480	0.000	1	121.6478	25.429	6	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Cl<1>,1|C<3>}	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|H<1>,2|C<2>}	H(C[6]C[6]2)	115.5140	0.000	1	121.6478	25.429	6	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Ag<5>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.6690	0.000	1	119.0303	3.636	18	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<2>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|C<4>}	H(C[6]C[6]2)	118.0920	0.000	1	119.0303	3.636	18	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<2>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<2>,1|C<3>}	H(C[6]C[6]2)	118.4810	0.000	1	119.0303	3.636	18	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<2>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|C<4>}	H(C[6]C[6]2)	119.3410	4.121	2	119.0303	3.636	18	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|P<3>,2|C<3>}	H(C[6]C[6]2)	119.7520	5.385	2	119.0303	3.636	18	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.4155	0.428	2	119.0303	3.636	18	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|P<4>,2|C<3>}	H(C[6]C[6]2)	116.1150	0.000	1	119.0303	3.636	18	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<4>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|S<4>,2|C<3>}	H(C[6]C[6]2)	120.1710	0.000	1	119.0303	3.636	18	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|N<2>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	118.6840	0.000	1	119.0303	3.636	18	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|N<3>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	118.7605	0.223	4	119.0303	3.636	18	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<2>,1|C<4>,1|P<4>}	H(C[6]C[6]2)	118.7910	0.000	1	119.0303	3.636	18	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|N<4>,2|H<1>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|H<1>,2|C<4>}	H(C[6]C[6]2)	120.4830	0.000	1	119.0303	3.636	18	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<2>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){2|C<3>}	H(C[6]C[6]2)	113.4445	2.997	2	119.3974	3.799	104	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<2>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9855	0.114	2	119.3974	3.799	104	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.0980	0.384	22	119.3974	3.799	104	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	119.0350	0.000	1	119.3974	3.799	104	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|P<4>}	H(C[6]C[6]2)	118.5250	0.000	1	119.3974	3.799	104	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<4>,2|C<3>}	H(C[6]C[6]2)	118.8110	0.587	7	119.3974	3.799	104	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.1709	2.139	36	119.3974	3.799	104	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|I<1>,2|C<3>}	H(C[6]C[6]2)	120.2490	0.000	2	119.3974	3.799	104	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.8663	0.101	4	119.3974	3.799	104	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<4>,2|C<3>}	H(C[6]C[6]2)	115.8650	0.000	1	119.3974	3.799	104	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|O<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.0462	0.253	21	119.3974	3.799	104	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|O<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|O<2>,2|C<3>}	H(C[6]C[6]2)	120.4780	0.000	1	119.3974	3.799	104	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<2>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	127.8770	0.000	1	119.3974	3.799	104	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<2>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	116.5530	0.000	1	119.3974	3.799	104	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,1|O<2>,2|C<3>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<4>,2|C<3>}	H(C[6]C[6]2)	119.1360	0.000	1	119.3974	3.799	104	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,1|O<2>,2|C<4>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	115.0810	0.000	1	119.3974	3.799	104	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]S)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<2>,1|H<1>,1|S<4>}	C[6](C[6]C[6]H)(C[6]C[6]S)(H){1|C<3>,1|C<4>}	H(C[6]C[6]2)	118.9690	2.942	4	118.3345	15.929	26	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]S)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<2>,1|S<4>}	C[6](C[6]C[6]H)(C[6]C[6]S)(H){1|C<2>,1|C<4>}	H(C[6]C[6]2)	119.3560	0.000	1	118.3345	15.929	26	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]S)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	C[6](C[6]C[6]H)(C[6]C[6]S)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	121.8625	4.588	2	118.3345	15.929	26	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]S)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<3>}	C[6](C[6]C[6]H)(C[6]C[6]S)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	118.9915	0.103	2	118.3345	15.929	26	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]S)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<4>}	C[6](C[6]C[6]H)(C[6]C[6]S)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	117.4012	4.471	16	118.3345	15.929	26	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]S)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|S<4>}	C[6](C[6]C[6]H)(C[6]C[6]S)(H){1|C<2>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	121.3380	0.000	1	118.3345	15.929	26	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cd<6>,2|C<3>}	H(C[6]C[6]2)	120.4115	0.133	4	120.1468	0.775	109	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<6>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	119.9260	0.000	1	120.1468	0.775	109	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<6>,2|C<3>}	H(C[6]C[6]2)	120.4061	0.287	8	120.1468	0.775	109	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cr<6>,2|C<3>}	H(C[6]C[6]2)	120.6570	0.000	1	120.1468	0.775	109	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<4>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	119.9160	0.000	1	120.1468	0.775	109	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<5>,2|C<3>}	H(C[6]C[6]2)	120.1677	0.111	4	120.1468	0.775	109	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	120.3235	0.310	2	120.1468	0.775	109	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,2|C<3>}	H(C[6]C[6]2)	120.5048	0.208	5	120.1468	0.775	109	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<6>,2|C<3>}	H(C[6]C[6]2)	120.0020	0.171	2	120.1468	0.775	109	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<7>,2|C<3>}	H(C[6]C[6]2)	120.6607	0.058	3	120.1468	0.775	109	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,2|C<3>}	H(C[6]C[6]2)	120.1114	0.835	9	120.1468	0.775	109	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pt<6>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	119.7180	0.000	1	120.1468	0.775	109	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Re<6>,2|C<3>}	H(C[6]C[6]2)	120.3110	0.000	1	120.1468	0.775	109	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<6>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	120.3890	0.000	1	120.1468	0.775	109	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<5>,1|C<2>,1|C<3>}	H(C[6]C[6]2)	120.7555	0.054	2	120.1468	0.775	109	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<5>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	119.9415	0.035	2	120.1468	0.775	109	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<5>,2|C<3>}	H(C[6]C[6]2)	120.3815	0.076	2	120.1468	0.775	109	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<6>,1|C<2>,1|C<3>}	H(C[6]C[6]2)	120.8200	0.159	5	120.1468	0.775	109	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<6>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	121.2990	0.000	1	120.1468	0.775	109	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<6>,2|C<3>}	H(C[6]C[6]2)	119.9965	0.002	2	120.1468	0.775	109	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.5328	2.038	10	120.1468	0.775	109	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|C<4>}	H(C[6]C[6]2)	119.8590	0.175	2	120.1468	0.775	109	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<4>,2|C<3>}	H(C[6]C[6]2)	120.2140	0.000	1	120.1468	0.775	109	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<4>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	119.6970	0.000	1	120.1468	0.775	109	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<5>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	120.1640	0.000	1	120.1468	0.775	109	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<5>,2|C<3>}	H(C[6]C[6]2)	120.4005	0.122	2	120.1468	0.775	109	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<6>,2|C<3>}	H(C[6]C[6]2)	120.0210	0.000	1	120.1468	0.775	109	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<2>,1|C<3>}	H(C[6]C[6]2)	120.6835	0.234	2	120.1468	0.775	109	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	119.8415	0.330	13	120.1468	0.775	109	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,2|C<3>}	H(C[6]C[6]2)	120.6620	0.154	2	120.1468	0.775	109	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<8>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	120.0290	0.000	1	120.1468	0.775	109	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<5>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	123.9010	0.000	1	120.1468	0.775	109	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,2|C<3>}	H(C[6]C[6]2)	120.3905	0.287	4	120.1468	0.775	109	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	120.0440	0.049	2	120.1468	0.775	109	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Re<6>,2|C<3>}	H(C[6]C[6]2)	120.1740	0.158	2	120.1468	0.775	109	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<5>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	118.7852	0.261	4	120.1468	0.775	109	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cr<6>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	119.3530	0.000	1	120.1468	0.775	109	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|C<4>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.4060	0.141	2	120.1468	0.775	109	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<2>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<4>,1|C<2>,1|C<3>}	H(C[6]C[6]2)	119.9965	0.285	2	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Au<4>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	118.8970	0.324	2	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.1905	0.149	2	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|O<1>}	H(C[6]C[6]2)	119.9850	0.000	1	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cd<6>,2|C<3>}	H(C[6]C[6]2)	120.0950	0.000	1	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<6>,2|C<3>}	H(C[6]C[6]2)	119.5332	0.678	5	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<4>,2|C<3>}	H(C[6]C[6]2)	119.9250	0.000	1	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	119.6615	0.170	4	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<5>,2|C<3>}	H(C[6]C[6]2)	119.8495	0.334	2	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<6>,2|C<3>}	H(C[6]C[6]2)	119.1870	0.000	1	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	119.3184	0.289	8	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mg<6>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	119.6485	0.175	2	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<6>,2|C<3>}	H(C[6]C[6]2)	119.2465	0.118	2	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<5>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	119.5310	0.221	4	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,2|C<3>}	H(C[6]C[6]2)	120.0370	0.061	4	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<4>,2|C<3>}	H(C[6]C[6]2)	119.7963	0.851	3	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	119.1070	0.000	1	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<6>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	119.3340	0.000	1	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	119.2360	0.076	2	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<5>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	119.9625	0.012	2	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<6>,2|C<3>}	H(C[6]C[6]2)	119.7460	0.000	1	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.4283	0.382	13	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,2|C<4>}	H(C[6]C[6]2)	119.8830	0.000	1	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<3>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	120.1160	0.147	2	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	119.4740	0.000	1	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<6>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	119.7690	0.000	1	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	119.6870	0.000	1	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<8>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	119.6480	0.147	2	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	118.7997	1.486	3	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<3>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	119.7270	0.024	2	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	118.7290	0.271	5	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<5>,2|C<3>}	H(C[6]C[6]2)	120.2125	1.611	2	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<8>,2|C<3>}	H(C[6]C[6]2)	119.6830	0.373	2	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|P<4>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.8390	0.119	2	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|S<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.8480	0.000	1	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cd<6>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	119.8313	0.211	3	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.7490	1.131	3	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<6>,2|C<3>}	H(C[6]C[6]2)	119.8940	0.223	2	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<6>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	119.5295	0.081	2	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|S<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cd<6>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	119.6400	0.000	1	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|S<4>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.6080	0.000	2	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	118.7534	0.518	23	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<4>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	119.1020	0.479	2	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<3>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	119.4190	0.213	3	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	119.7765	0.426	2	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.0875	0.439	17	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<4>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	119.3480	0.000	1	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	119.1300	0.000	1	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<7>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	119.5285	0.139	2	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Li<4>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	119.4465	0.146	2	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<6>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	119.4570	0.000	1	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	118.8297	0.250	3	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Ir<6>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,2|C<4>}	H(C[6]C[6]2)	119.4640	0.000	1	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ag<4>,1|C<2>,1|C<3>}	H(C[6]C[6]2)	121.5558	0.985	4	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ag<4>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	120.0080	0.554	2	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Al<3>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	120.2460	0.000	1	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<6>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	126.9420	0.000	1	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<2>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	120.6303	0.450	8	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|D<1>}	H(C[6]C[6]2)	119.2790	0.000	1	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.7536	1.097	72	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|N<2>}	H(C[6]C[6]2)	119.4360	0.000	1	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|O<1>}	H(C[6]C[6]2)	120.0990	0.406	8	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|O<2>}	H(C[6]C[6]2)	120.2790	0.000	1	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|O<3>}	H(C[6]C[6]2)	120.0280	0.034	2	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,2|C<4>}	H(C[6]C[6]2)	120.1437	1.278	20	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<4>,2|C<3>}	H(C[6]C[6]2)	120.2939	0.835	46	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cd<4>,1|C<2>,1|C<3>}	H(C[6]C[6]2)	120.1010	0.000	1	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cd<4>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	120.0183	0.622	6	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cd<5>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	120.2740	0.000	1	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cd<6>,2|C<3>}	H(C[6]C[6]2)	120.2870	0.413	8	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<4>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	120.5040	0.197	2	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<5>,2|C<3>}	H(C[6]C[6]2)	120.3540	0.000	1	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<6>,1|C<2>,1|C<3>}	H(C[6]C[6]2)	123.0850	0.000	1	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	120.4500	0.000	1	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<6>,2|C<3>}	H(C[6]C[6]2)	120.5577	0.514	35	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<4>,1|C<2>,1|C<3>}	H(C[6]C[6]2)	120.7415	0.349	4	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	119.0093	1.533	3	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<4>,2|C<3>}	H(C[6]C[6]2)	120.4338	0.262	4	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<5>,1|C<2>,1|C<3>}	H(C[6]C[6]2)	120.6290	0.000	1	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	120.0562	0.266	10	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<5>,2|C<3>}	H(C[6]C[6]2)	120.3256	0.236	12	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<8>,2|C<3>}	H(C[6]C[6]2)	120.2030	0.000	1	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<4>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	118.7710	0.000	1	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	120.2985	0.344	4	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<6>,2|C<3>}	H(C[6]C[6]2)	120.2605	0.097	2	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<8>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	118.7630	0.000	1	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.0514	0.541	76	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Hg<4>,2|C<3>}	H(C[6]C[6]2)	120.1565	0.695	30	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<4>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	120.2930	0.000	1	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	120.4650	0.000	1	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<5>,2|C<3>}	H(C[6]C[6]2)	120.3470	0.518	2	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<6>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	120.0445	0.105	4	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<6>,2|C<3>}	H(C[6]C[6]2)	120.5283	0.331	12	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<7>,2|C<3>}	H(C[6]C[6]2)	120.5970	0.000	1	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<6>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	119.9690	0.000	1	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<6>,1|C<2>,1|C<3>}	H(C[6]C[6]2)	120.8317	0.115	4	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	119.9479	0.372	9	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<6>,2|C<3>}	H(C[6]C[6]2)	120.6063	0.174	19	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|O<1>,2|C<3>}	H(C[6]C[6]2)	120.3370	0.174	2	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|O<2>,2|C<3>}	H(C[6]C[6]2)	121.1025	1.388	2	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<2>,1|C<3>}	H(C[6]C[6]2)	120.1668	0.584	14	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	120.1807	0.509	9	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,2|C<3>}	H(C[6]C[6]2)	120.0414	0.532	17	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<4>,1|C<2>,1|C<3>}	H(C[6]C[6]2)	120.5269	0.347	7	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	120.0490	0.278	4	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<4>,2|C<3>}	H(C[6]C[6]2)	120.2994	0.446	5	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<6>,1|C<2>,1|C<3>}	H(C[6]C[6]2)	121.0487	0.495	6	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<5>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	119.9317	0.429	12	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<6>,1|C<2>,1|C<3>}	H(C[6]C[6]2)	120.4620	0.000	1	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	119.9110	0.604	4	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<6>,2|C<3>}	H(C[6]C[6]2)	120.4507	0.428	12	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<4>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	120.0750	0.157	2	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<5>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	120.5090	0.000	1	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<5>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	116.1435	5.358	4	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	120.1975	0.994	4	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<6>,2|C<3>}	H(C[6]C[6]2)	120.7104	0.509	5	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<9>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	120.4970	0.000	1	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<9>,2|C<3>}	H(C[6]C[6]2)	120.8660	0.993	2	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Si<6>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	120.0275	0.317	2	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|U<16>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	116.6520	0.000	1	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<4>,1|C<2>,1|C<3>}	H(C[6]C[6]2)	120.7920	0.000	1	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<4>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	120.1320	0.199	8	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<4>,2|C<3>}	H(C[6]C[6]2)	120.0576	0.586	5	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<5>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	120.1680	0.000	1	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<5>,2|C<3>}	H(C[6]C[6]2)	120.4620	0.212	4	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<6>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	120.4090	0.000	1	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<6>,2|C<3>}	H(C[6]C[6]2)	120.6037	0.243	7	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){3|C<3>}	H(C[6]C[6]2)	119.7480	0.484	2	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<4>,2|C<3>}	H(C[6]C[6]2)	119.9500	0.000	1	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Ru<10>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<10>,2|C<4>}	H(C[6]C[6]2)	119.5670	0.157	2	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Se<1>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	118.8920	0.000	1	119.9992	0.901	736	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.5014	0.355	7	119.5120	0.843	73	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,2|C<4>}	H(C[6]C[6]2)	119.4950	0.000	1	119.5120	0.843	73	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Mn<6>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	119.6070	0.119	2	119.5120	0.843	73	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Re<8>,2|C<3>}	H(C[6]C[6]2)	120.3210	0.000	1	119.5120	0.843	73	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Al<5>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	119.0433	0.164	3	119.5120	0.843	73	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<2>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.7245	0.486	2	119.5120	0.843	73	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.2325	0.800	40	119.5120	0.843	73	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,2|C<4>}	H(C[6]C[6]2)	119.1600	0.000	1	119.5120	0.843	73	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cu<3>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	119.7923	0.149	3	119.5120	0.843	73	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Fe<6>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	119.9335	0.081	6	119.5120	0.843	73	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.7540	0.000	1	119.5120	0.843	73	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Li<4>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	121.8973	2.371	3	119.5120	0.843	73	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Mn<6>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	119.6430	0.000	1	119.5120	0.843	73	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Mn<6>,2|C<3>}	H(C[6]C[6]2)	119.9910	0.000	1	119.5120	0.843	73	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Zn<4>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	119.7350	0.000	1	119.5120	0.843	73	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|O<1>}	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|C<3>,1|C<4>}	H(C[6]C[6]2)	120.7030	0.000	1	119.7370	1.866	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|O<1>}	C[6](C[6]C[6]H)(C[6]N[6]O)(H){3|C<3>}	H(C[6]C[6]2)	118.7710	0.000	1	119.7370	1.866	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|S<4>}	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Pd<5>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	120.8325	0.078	2	120.8325	0.006	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]O[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Cr<6>,2|O<2>}	C[6](C[6]C[6]H)(C[6]O[6]O)(H){2|C<3>}	H(C[6]C[6]2)	116.1530	0.000	1	118.0555	7.239	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]O[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|O<1>,1|O<2>,2|C<4>}	C[6](C[6]C[6]H)(C[6]O[6]O)(H){1|C<3>,1|C<4>}	H(C[6]C[6]2)	119.9580	0.000	1	118.0555	7.239	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]P[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){2|H<1>,2|P<4>}	C[6](C[6]C[6]H)(C[6]P[6]H)(H){1|Ru<9>,1|O<2>,2|C<4>}	H(C[6]C[6]2)	116.8935	0.100	2	116.8935	0.010	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]P[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,1|O<2>,1|P<3>}	C[6](C[6]C[6]H)(C[6]P[6]O)(H){1|Cu<4>,2|C<3>}	H(C[6]C[6]2)	118.0080	0.000	1	118.0080	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<2>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>}	H(C[6]C[6]2)	119.1990	0.000	1	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<2>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<2>,1|C<3>}	H(C[6]C[6]2)	118.0940	10.247	2	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<2>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<2>,1|C<4>}	H(C[6]C[6]2)	119.8465	1.210	2	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<2>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>}	H(C[6]C[6]2)	119.1000	3.380	13	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<2>,2|H<1>}	C[6](C[6]C[6]H)2(H){2|C<3>}	H(C[6]C[6]2)	121.5613	2.230	9	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	118.9810	0.000	1	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>,1|U<8>}	C[6](C[6]C[6]H)2(H){3|C<4>}	H(C[6]C[6]2)	119.3500	0.010	2	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)2(H){1|C<4>,2|C<3>}	H(C[6]C[6]2)	119.5665	0.335	4	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|C<4>,2|C<3>}	H(C[6]C[6]2)	120.4060	0.068	2	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|O<2>,2|C<3>}	H(C[6]C[6]2)	124.2070	0.000	1	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,2|C<4>}	H(C[6]C[6]2)	119.2786	0.281	41	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(H){1|F<1>,2|C<3>}	H(C[6]C[6]2)	119.4080	0.000	1	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.6270	1.425	27	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.3155	0.097	2	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(H){1|O<1>,2|C<3>}	H(C[6]C[6]2)	119.6630	0.000	1	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(H){1|O<2>,2|C<3>}	H(C[6]C[6]2)	120.7116	1.533	31	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(H){3|C<3>}	H(C[6]C[6]2)	119.3335	0.575	4	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>,1|V<6>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.2430	0.000	1	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<2>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6565	3.578	11	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<2>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	121.4649	3.052	10	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<2>,2|C<4>}	H(C[6]C[6]2)	120.0525	2.343	2	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|C<2>}	H(C[6]C[6]2)	119.9840	0.000	1	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|O<1>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.0300	0.000	1	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|V<6>,2|H<1>}	C[6](C[6]C[6]H)2(H){3|C<4>}	H(C[6]C[6]2)	119.8790	0.027	2	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	121.4859	5.753	14	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|N<4>,2|C<3>}	H(C[6]C[6]2)	118.6850	0.000	1	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,3|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|C<4>}	H(C[6]C[6]2)	120.3420	2.763	3	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|O<2>,2|C<4>}	H(C[6]C[6]2)	118.5480	0.000	1	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,3|C<4>}	H(C[6]C[6]2)	118.7120	0.000	1	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|Li<5>,1|C<3>,2|C<4>}	H(C[6]C[6]2)	119.2810	0.000	1	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|Ru<8>,1|H<2>,2|C<3>}	H(C[6]C[6]2)	119.2130	0.369	2	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,2|O<2>}	H(C[6]C[6]2)	118.1300	0.000	1	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(H){2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2230	0.000	1	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|O<2>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|O<2>,2|C<4>}	H(C[6]C[6]2)	117.7030	0.000	1	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<2>,1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8420	0.000	1	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	120.0720	0.000	1	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0200	0.000	1	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Ca<12>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){3|C<4>}	H(C[6]C[6]2)	119.2357	0.125	4	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Ca<7>,1|C<3>,1|H<1>,1|O<3>}	C[6](C[6]C[6]H)2(H){3|C<4>}	H(C[6]C[6]2)	118.8475	0.083	2	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Ca<8>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){3|C<4>}	H(C[6]C[6]2)	119.1810	0.423	2	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Ce<18>,1|C<3>,1|H<1>,1|O<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|O<3>}	H(C[6]C[6]2)	119.7477	0.108	4	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Co<5>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|Co<5>,3|C<4>}	H(C[6]C[6]2)	119.0360	0.000	1	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Cr<4>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){3|C<4>}	H(C[6]C[6]2)	120.3187	1.170	4	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Cr<4>,1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(H){3|C<4>}	H(C[6]C[6]2)	118.9450	0.359	2	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Cr<6>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|Cr<6>,3|C<4>}	H(C[6]C[6]2)	118.9610	0.000	1	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Cr<7>,1|C<3>,1|H<1>,1|N<4>}	C[6](C[6]C[6]H)2(H){3|C<4>}	H(C[6]C[6]2)	119.5225	0.076	2	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Dy<11>,1|C<4>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(H){1|Dy<11>,1|C<3>,1|C<4>,1|O<3>}	H(C[6]C[6]2)	119.6800	0.283	2	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Dy<15>,1|C<3>,1|H<1>,1|O<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|O<2>}	H(C[6]C[6]2)	119.8680	0.000	1	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Dy<16>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(H){1|C<3>,2|C<4>}	H(C[6]C[6]2)	119.0280	0.448	4	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Er<14>,1|C<3>,1|H<1>,1|O<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|O<3>}	H(C[6]C[6]2)	119.1270	0.000	1	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Er<15>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){3|C<4>}	H(C[6]C[6]2)	119.6262	0.581	4	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Eu<8>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){3|C<4>}	H(C[6]C[6]2)	119.3740	0.134	2	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Fe<5>,1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,2|C<3>}	H(C[6]C[6]2)	119.1870	0.146	2	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Fe<5>,1|Fe<6>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Fe<6>,1|C<4>,2|C<3>}	H(C[6]C[6]2)	119.5380	0.608	2	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Gd<15>,1|C<3>,1|H<1>,1|O<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|O<2>}	H(C[6]C[6]2)	119.5405	0.009	2	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Gd<16>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(H){1|C<3>,2|C<4>}	H(C[6]C[6]2)	119.1017	0.302	4	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Gd<17>,1|C<4>,1|H<1>,1|O<3>}	C[6](C[6]C[6]H)2(H){1|Gd<17>,1|C<3>,1|C<4>,1|O<3>}	H(C[6]C[6]2)	119.3610	0.281	2	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<4>,2|C<3>}	H(C[6]C[6]2)	122.9245	2.637	2	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Hf<10>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.2157	0.124	4	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Hf<11>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.2820	0.090	3	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Hf<8>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){3|C<4>}	H(C[6]C[6]2)	119.4800	0.163	2	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Hf<9>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.2840	0.173	5	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Hf<9>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){3|C<4>}	H(C[6]C[6]2)	119.0960	0.467	2	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Ho<15>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|O<3>}	H(C[6]C[6]2)	119.6925	0.013	2	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Ir<7>,1|C<3>,1|H<1>,1|N<4>}	C[6](C[6]C[6]H)2(H){1|Ir<7>,2|C<4>}	H(C[6]C[6]2)	118.9220	0.010	2	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Ir<9>,1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ir<9>,3|C<4>}	H(C[6]C[6]2)	119.5040	0.000	1	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|La<16>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){3|C<4>}	H(C[6]C[6]2)	119.2145	0.528	2	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|La<18>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|O<3>}	H(C[6]C[6]2)	120.1313	0.138	3	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Li<5>,1|C<3>,1|H<1>,1|N<4>}	C[6](C[6]C[6]H)2(H){3|C<4>}	H(C[6]C[6]2)	119.2520	0.180	4	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Li<6>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|Li<6>,3|C<4>}	H(C[6]C[6]2)	119.1140	0.000	1	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Mg<6>,1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.3850	0.000	1	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Nd<12>,1|C<3>,1|H<1>,1|N<4>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.2833	0.050	3	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Nd<12>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(H){3|C<4>}	H(C[6]C[6]2)	119.5025	0.115	2	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Nd<12>,1|C<3>,1|H<1>,1|O<3>}	C[6](C[6]C[6]H)2(H){3|C<4>}	H(C[6]C[6]2)	118.9935	0.291	4	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Nd<15>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){3|C<4>}	H(C[6]C[6]2)	119.2393	0.342	3	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Nd<18>,1|C<3>,1|H<1>,1|O<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|O<3>}	H(C[6]C[6]2)	119.9725	0.059	2	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Ni<4>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){3|C<4>}	H(C[6]C[6]2)	119.4130	0.136	2	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Ni<6>,1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){3|C<4>}	H(C[6]C[6]2)	120.1445	0.165	2	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Pd<5>,1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Pd<5>,3|C<4>}	H(C[6]C[6]2)	119.5360	0.000	1	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Pd<6>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|Pd<6>,3|C<4>}	H(C[6]C[6]2)	119.2270	0.000	1	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(H){3|C<4>}	H(C[6]C[6]2)	119.4770	0.021	2	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Rh<9>,1|C<4>,1|H<1>,1|P<4>}	C[6](C[6]C[6]H)2(H){1|Rh<9>,3|C<4>}	H(C[6]C[6]2)	118.3820	0.000	1	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Ru<10>,1|C<4>,1|H<1>,1|N<4>}	C[6](C[6]C[6]H)2(H){1|Ru<10>,3|C<4>}	H(C[6]C[6]2)	119.3220	0.000	1	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Ru<7>,1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(H){1|Ru<5>,1|Ru<7>,2|C<4>}	H(C[6]C[6]2)	119.0570	0.146	2	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Sc<9>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){3|C<4>}	H(C[6]C[6]2)	119.4180	0.052	2	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Sm<10>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){3|C<4>}	H(C[6]C[6]2)	119.4215	0.142	2	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Sm<11>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){3|C<4>}	H(C[6]C[6]2)	119.2630	0.058	2	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Sr<6>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){3|C<4>}	H(C[6]C[6]2)	119.0632	0.199	8	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Tb<11>,1|C<4>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(H){1|Tb<11>,1|C<3>,1|C<4>,1|O<3>}	H(C[6]C[6]2)	119.8680	0.103	2	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Tb<15>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|O<3>}	H(C[6]C[6]2)	119.7875	0.114	2	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Tb<16>,1|C<4>,1|H<1>,1|O<3>}	C[6](C[6]C[6]H)2(H){1|Tb<16>,1|C<3>,1|C<4>,1|O<3>}	H(C[6]C[6]2)	119.2180	1.039	2	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Th<14>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(H){3|C<4>}	H(C[6]C[6]2)	119.3675	0.204	4	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Th<17>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){3|C<4>}	H(C[6]C[6]2)	119.4930	0.338	3	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Ti<12>,1|C<4>,1|H<1>,1|O<3>}	C[6](C[6]C[6]H)2(H){1|Ti<12>,1|C<3>,1|C<4>,1|O<2>}	H(C[6]C[6]2)	119.3324	0.255	8	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Ti<7>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(H){1|C<3>,2|C<4>}	H(C[6]C[6]2)	119.6915	1.866	2	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|U<13>,1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)2(H){3|C<4>}	H(C[6]C[6]2)	119.0116	0.246	10	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|U<14>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){3|C<4>}	H(C[6]C[6]2)	119.3898	0.395	4	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|U<15>,1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)2(H){3|C<4>}	H(C[6]C[6]2)	118.9620	0.574	2	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|U<16>,1|C<3>,1|H<1>,1|H<2>}	C[6](C[6]C[6]H)2(H){3|C<4>}	H(C[6]C[6]2)	119.8515	0.218	4	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|U<16>,1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|C<4>}	H(C[6]C[6]2)	118.8900	0.000	1	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|U<16>,1|C<4>,1|H<1>,1|O<3>}	C[6](C[6]C[6]H)2(H){1|U<16>,1|C<3>,1|C<4>,1|O<2>}	H(C[6]C[6]2)	119.7228	0.489	19	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Y<10>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|C<4>}	H(C[6]C[6]2)	118.2920	0.023	2	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Yb<12>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.2050	1.161	2	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Yb<13>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){3|C<4>}	H(C[6]C[6]2)	119.3582	0.212	4	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Yb<15>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|O<3>}	H(C[6]C[6]2)	119.9440	0.182	2	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Zr<10>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){3|C<4>}	H(C[6]C[6]2)	119.1485	0.050	2	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Zr<11>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.2240	0.238	4	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Zr<15>,1|C<3>,1|H<1>,1|H<2>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	118.8700	0.000	1	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Zr<7>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){3|C<4>}	H(C[6]C[6]2)	119.3325	0.404	2	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Zr<9>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.2745	0.124	2	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Zr<9>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){3|C<4>}	H(C[6]C[6]2)	119.1202	0.221	6	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){2|Al<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.8010	0.000	1	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){2|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){3|C<4>}	H(C[6]C[6]2)	119.3210	0.410	2	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){2|Dy<16>,1|C<3>,1|H<1>,1|O<3>}	C[6](C[6]C[6]H)2(H){1|C<5>,2|C<4>}	H(C[6]C[6]2)	119.2215	0.339	2	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){2|Fe<6>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Fe<6>,1|C<4>,2|C<3>}	H(C[6]C[6]2)	120.4170	0.558	3	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){2|Gd<16>,1|C<3>,1|H<1>,1|O<3>}	C[6](C[6]C[6]H)2(H){1|C<5>,2|C<4>}	H(C[6]C[6]2)	119.1950	0.000	1	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){2|Ir<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){3|C<4>}	H(C[6]C[6]2)	120.6475	1.183	2	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){2|Li<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.9227	0.236	3	119.7190	3.241	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]N[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|N<3>,2|H<1>}	C[6](C[6]C[6]N[5])(C[6]C[6]H)(H){1|C<3>,1|H<1>,4|C<4>}	H(C[6]C[6]2)	118.7980	0.000	1	118.7980	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Co<6>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.1990	0.322	4	120.1134	0.298	252	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Co<8>,1|C<4>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.1970	0.000	1	120.1134	0.298	252	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cr<6>,1|C<4>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.6640	0.049	2	120.1134	0.298	252	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|C<2>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.1047	0.169	3	120.1134	0.298	252	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|C<4>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.6194	0.626	11	120.1134	0.298	252	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.0632	0.310	4	120.1134	0.298	252	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<5>,1|C<4>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.9957	0.259	15	120.1134	0.298	252	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<5>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.0995	0.069	2	120.1134	0.298	252	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<6>,1|C<4>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.4090	0.925	2	120.1134	0.298	252	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Eu<13>,1|C<4>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.8005	0.139	2	120.1134	0.298	252	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|C<4>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.0879	0.253	15	120.1134	0.298	252	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.4160	0.192	6	120.1134	0.298	252	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Hg<4>,1|C<4>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.7365	0.233	2	120.1134	0.298	252	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|C<2>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.1810	0.000	1	120.1134	0.298	252	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.4645	0.155	2	120.1134	0.298	252	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Mo<6>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.2980	0.199	2	120.1134	0.298	252	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ni<4>,1|C<4>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.0115	0.098	4	120.1134	0.298	252	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|C<4>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.9000	0.332	9	120.1134	0.298	252	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.2430	0.070	3	120.1134	0.298	252	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|C<2>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.5790	0.000	1	120.1134	0.298	252	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|C<4>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.0052	0.308	6	120.1134	0.298	252	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.2290	0.361	6	120.1134	0.298	252	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|C<2>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.2713	0.521	42	120.1134	0.298	252	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|C<4>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.0414	0.291	20	120.1134	0.298	252	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.4944	0.846	5	120.1134	0.298	252	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pt<6>,1|C<4>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.7130	0.588	2	120.1134	0.298	252	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pt<6>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.5930	2.099	7	120.1134	0.298	252	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Re<6>,1|C<2>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.1027	0.285	7	120.1134	0.298	252	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Re<6>,1|C<4>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.9481	0.222	13	120.1134	0.298	252	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Re<6>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.0730	0.174	2	120.1134	0.298	252	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Rh<8>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.8880	0.218	4	120.1134	0.298	252	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|C<2>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.0787	0.122	3	120.1134	0.298	252	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|C<4>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.1967	0.424	11	120.1134	0.298	252	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.3624	0.319	12	120.1134	0.298	252	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ru<8>,1|C<2>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.1280	0.000	1	120.1134	0.298	252	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ru<9>,1|C<4>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.4305	0.344	2	120.1134	0.298	252	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Zn<4>,1|C<4>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.3925	0.165	4	120.1134	0.298	252	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Zn<5>,1|C<4>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.6965	0.194	2	120.1134	0.298	252	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Zn<6>,1|C<4>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.8962	0.325	12	120.1134	0.298	252	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]Zr)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Zr<14>,1|C<4>,1|H<1>}	C[6](C[6]C[6]Zr)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.2880	0.000	2	119.2880	0.000	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|La<13>,1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|La<13>,1|H<1>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	119.1250	0.000	1	119.1250	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Au<4>,1|C<4>,3|C<3>}	H(C[6]C[6]2)	120.2735	0.193	2	119.9570	0.229	50	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|C<2>,1|H<1>,1|N<2>,2|C<3>}	H(C[6]C[6]2)	120.1290	0.000	1	119.9570	0.229	50	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<2>,2|C<3>}	H(C[6]C[6]2)	119.4410	0.000	1	119.9570	0.229	50	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|C<4>,3|C<3>}	H(C[6]C[6]2)	119.9650	0.000	1	119.9570	0.229	50	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|C<4>,3|C<3>}	H(C[6]C[6]2)	119.9223	0.564	24	119.9570	0.229	50	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|C<4>,3|C<3>}	H(C[6]C[6]2)	119.9824	0.409	21	119.9570	0.229	50	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|C<4>,3|C<3>}	H(C[6]C[6]2)	120.7640	0.000	1	120.7640	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]N[6]Al)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Al<4>,1|H<1>,1|N<3>}	C[6](C[6]N[6]Al)(C[6]C[6]H)(H){1|Ca<6>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	120.0617	0.185	6	120.0910	0.059	9	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]N[6]Al)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Al<4>,1|H<1>,1|N<3>}	C[6](C[6]N[6]Al)(C[6]C[6]H)(H){1|Li<4>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	120.1497	0.377	3	120.0910	0.059	9	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]N[6]As)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|As<4>,1|H<1>,1|N<3>}	C[6](C[6]N[6]As)(C[6]C[6]H)(H){1|C<3>,2|C<4>}	H(C[6]C[6]2)	120.8650	0.000	1	120.8650	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]N[6]Br)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Br<1>,1|H<1>,1|N<3>}	C[6](C[6]N[6]Br)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	118.9980	0.000	1	118.9980	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]N[6]Sn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Sn<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6]Sn)(C[6]C[6]H)(H){1|Li<4>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	119.8713	0.375	12	119.9193	0.121	15	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]N[6]Sn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Sn<4>,1|H<1>,1|N<3>}	C[6](C[6]N[6]Sn)(C[6]C[6]H)(H){1|Eu<6>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	120.1110	0.056	3	119.9193	0.121	15	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]P[6]Si)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Si<4>,1|H<1>,2|P<4>}	C[6](C[6]P[6]Si)(C[6]C[6]H)(H){1|Ru<8>,1|O<2>,2|C<4>}	H(C[6]C[6]2)	116.9225	0.115	2	117.0664	0.348	7	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]P[6]Si)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Si<4>,1|P<2>,1|P<3>}	C[6](C[6]P[6]Si)(C[6]C[6]H)(H){1|C<3>,1|C<4>}	H(C[6]C[6]2)	117.5660	0.000	1	117.0664	0.348	7	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]P[6]Si)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Si<4>,1|P<2>,1|P<4>}	C[6](C[6]P[6]Si)(C[6]C[6]H)(H){1|C<3>,1|C<4>}	H(C[6]C[6]2)	117.4980	0.000	1	117.0664	0.348	7	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]P[6]Si)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Si<4>,1|P<3>,1|P<4>}	C[6](C[6]P[6]Si)(C[6]C[6]H)(H){1|Ru<6>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	116.8520	0.855	3	117.0664	0.348	7	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|C<2>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Cl<1>,1|C<3>}	H(C[6]C[6]2)	125.0170	0.000	1	119.4243	11.393	6	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Cl<1>,1|C<2>,1|H<1>}	H(C[6]C[6]2)	117.4260	2.459	3	119.4243	11.393	6	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|H<1>,2|C<2>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Cl<1>,1|C<3>}	H(C[6]C[6]2)	118.7500	0.000	1	119.4243	11.393	6	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Cl<1>,1|C<2>,1|H<1>}	H(C[6]C[6]2)	120.5010	0.000	1	119.4243	11.393	6	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|Cl<1>,1|C<3>,1|H<1>}	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|Cl<1>,1|C<3>,1|O<1>}	H(C[6]C[6]2)	121.1470	0.000	1	120.5605	0.688	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|Cl<1>,1|C<3>,1|O<1>}	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|Cl<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9740	0.000	1	120.5605	0.688	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Br<1>,1|Cl<1>,1|C<3>}	H(C[6]C[6]2)	119.9200	0.000	1	119.7705	1.505	15	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Cl<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1880	0.390	2	119.7705	1.505	15	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Cl<1>,1|C<3>,1|N<3>}	H(C[6]C[6]2)	118.8260	0.000	1	119.7705	1.505	15	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Cl<1>,2|C<3>}	H(C[6]C[6]2)	119.5949	1.753	7	119.7705	1.505	15	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){2|Cl<1>,1|C<3>}	H(C[6]C[6]2)	120.0365	0.136	2	119.7705	1.505	15	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|Cl<1>,1|C<3>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Cl<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0990	0.786	2	119.7705	1.505	15	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|C<2>,1|H<1>,1|P<4>}	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|Cl<1>,1|C<3>}	H(C[6]C[6]2)	113.2550	0.000	1	116.2095	17.458	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|C<3>,1|P<4>}	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|Cl<1>,1|C<2>,1|H<1>}	H(C[6]C[6]2)	119.1640	0.000	1	116.2095	17.458	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cl<1>,1|B<3>,1|C<3>}	H(C[6]C[6]2)	121.2370	0.000	1	121.0011	0.178	66	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cl<1>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	120.9083	0.238	3	121.0011	0.178	66	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cl<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5850	0.409	16	121.0011	0.178	66	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cl<1>,1|Co<6>,1|C<3>}	H(C[6]C[6]2)	121.2285	0.149	2	121.0011	0.178	66	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cl<1>,1|Cu<4>,1|C<3>}	H(C[6]C[6]2)	120.9270	0.338	2	121.0011	0.178	66	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cl<1>,1|Cu<5>,1|C<3>}	H(C[6]C[6]2)	121.1917	0.009	4	121.0011	0.178	66	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cl<1>,1|Ni<6>,1|C<3>}	H(C[6]C[6]2)	121.2463	0.074	6	121.0011	0.178	66	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cl<1>,1|Pd<4>,1|C<3>}	H(C[6]C[6]2)	121.1310	0.416	27	121.0011	0.178	66	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cl<1>,1|Ru<6>,1|C<3>}	H(C[6]C[6]2)	121.1550	0.000	1	121.0011	0.178	66	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cl<1>,1|Zn<4>,1|C<3>}	H(C[6]C[6]2)	121.1255	0.289	4	121.0011	0.178	66	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cl<1>,1|Fe<6>,1|C<3>}	H(C[6]C[6]2)	120.9240	0.071	2	120.2952	1.433	25	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cl<1>,1|Os<9>,1|C<3>}	H(C[6]C[6]2)	120.8965	0.342	2	120.2952	1.433	25	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cl<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1780	1.274	21	120.2952	1.433	25	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Cl<1>,1|Ni<6>,1|C<3>}	H(C[6]C[6]2)	120.4697	0.272	6	120.4697	0.074	6	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(H){2|Cl<1>,1|C<3>}	H(C[6]C[6]2)	116.9260	0.000	1	116.9260	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cl<1>,1|Re<6>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.6953	0.609	3	120.5927	0.289	4	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|C<3>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cl<1>,1|C<2>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.2850	0.000	1	120.5927	0.289	4	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|C<3>,2|N<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Cd<6>,1|Cl<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.4855	0.145	2	119.5250	0.008	6	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|C<3>,2|N<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Cl<1>,1|Cu<6>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.5055	0.078	2	119.5250	0.008	6	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|C<3>,2|N<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Cl<1>,1|Ni<6>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.5840	0.035	2	119.5250	0.008	6	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Cr)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Cr)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<3>}	C[6](C[6]C[6]H)2(H){1|Cr<8>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.6190	0.188	4	119.6190	0.035	4	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]F)(C[6]C[6]H)(H)	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]F)(C[6]C[6]H)(H){1|C<3>,1|C<4>}	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H){1|C<2>,1|F<1>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	129.1850	0.000	1	129.1850	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]F)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]F)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|F<1>,1|H<1>}	H(C[6]C[6]2)	120.8960	1.055	2	120.6782	0.409	6	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]F)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]F)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Cl<1>,1|C<3>,1|F<1>}	H(C[6]C[6]2)	120.5692	0.514	4	120.6782	0.409	6	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]F)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]F)(C[6]C[6]H)(H){1|C<3>,1|P<4>}	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<2>,1|F<1>,1|H<1>}	H(C[6]C[6]2)	119.0570	1.894	2	119.0570	3.586	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]F)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]F)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<5>,1|C<3>,1|F<1>}	H(C[6]C[6]2)	121.4170	0.000	1	121.4170	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]F)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]F)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|F<1>}	H(C[6]C[6]2)	120.2730	0.585	2	120.8665	0.210	12	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]F)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]F)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<9>,1|C<3>,1|F<1>}	H(C[6]C[6]2)	120.7635	0.276	6	120.8665	0.210	12	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]F)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]F)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|F<1>}	H(C[6]C[6]2)	121.3020	0.000	1	120.8665	0.210	12	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]F)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]F)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<4>,1|C<3>,1|F<1>}	H(C[6]C[6]2)	121.3230	0.048	3	120.8665	0.210	12	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]F)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]F)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Os<9>,1|C<3>,1|F<1>}	H(C[6]C[6]2)	121.5620	0.000	1	121.5620	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]F)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]F)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(H){1|F<1>,2|C<3>}	H(C[6]C[6]2)	119.8450	0.000	1	120.7167	0.354	6	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]F)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]F)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<2>,2|F<1>}	H(C[6]C[6]2)	120.9065	0.534	4	120.7167	0.354	6	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]F)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]F)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|F<1>,1|O<1>}	H(C[6]C[6]2)	120.8290	0.000	1	120.7167	0.354	6	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]F)(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]F)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ru<9>,1|F<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	121.3238	0.222	5	121.3238	0.049	5	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Fe)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Fe)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	112.8600	0.000	1	116.1765	21.998	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Fe)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Fe)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	119.4930	0.000	1	116.1765	21.998	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Ga)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Ga)(C[6]C[6]H)(H){1|C<2>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Ga<3>,1|C<3>}	H(C[6]C[6]2)	122.3620	0.000	1	122.3620	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Ge)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Ge)(C[6]C[6]H)(H){1|C<2>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Ge<4>,1|C<3>}	H(C[6]C[6]2)	119.8170	0.000	1	120.1980	0.290	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Ge)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Ge)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ge<4>,1|C<2>,1|H<1>}	H(C[6]C[6]2)	120.5790	0.000	1	120.1980	0.290	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]I)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]I)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|I<1>}	H(C[6]C[6]2)	120.1261	0.518	11	119.9803	1.532	14	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]I)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]I)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|I<2>}	H(C[6]C[6]2)	121.0040	1.250	2	119.9803	1.532	14	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]I)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]I)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|I<1>,2|C<3>}	H(C[6]C[6]2)	116.3290	0.000	1	119.9803	1.532	14	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]I)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]I)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|I<1>}	H(C[6]C[6]2)	120.6095	0.386	24	120.4081	0.192	47	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]I)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]I)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|I<1>}	H(C[6]C[6]2)	120.1006	0.289	18	120.4081	0.192	47	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]I)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]I)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|I<1>}	H(C[6]C[6]2)	121.0280	0.000	1	120.4081	0.192	47	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]I)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]I)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|I<1>}	H(C[6]C[6]2)	120.8740	0.000	1	120.4081	0.192	47	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]I)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]I)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|I<1>}	H(C[6]C[6]2)	120.6720	0.000	1	120.4081	0.192	47	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]I)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]I)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<4>,1|C<3>,1|I<1>}	H(C[6]C[6]2)	120.0845	0.663	2	120.4081	0.192	47	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]I)(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]I)(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,1|H<1>,1|I<1>}	H(C[6]C[6]2)	119.5740	0.176	5	119.6032	0.030	6	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]I)(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]I)(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,1|C<4>,1|I<1>}	H(C[6]C[6]2)	119.7490	0.000	1	119.6032	0.030	6	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]I)(H)	C[6](C[6]C[6]N[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]I)(H){1|C<3>,1|N<3>}	C[6](C[6]C[6]N[5])(C[6]C[6]H)(H){1|C<2>,1|H<1>,1|I<1>,2|C<3>}	H(C[6]C[6]2)	124.3100	0.000	1	124.3100	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]I)(H)	C[6](C[6]N[6]Br)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]I)(H){1|Br<1>,1|H<1>,1|N<3>}	C[6](C[6]N[6]Br)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|I<1>}	H(C[6]C[6]2)	118.9840	0.000	1	118.9840	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<2>,1|C<3>}	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H){1|C<2>,1|N<2>,2|N<3>}	H(C[6]C[6]2)	118.2830	0.000	1	118.2830	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<2>,1|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<2>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	123.3890	0.000	1	120.8697	5.013	18	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<2>,1|C<4>,1|P<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|N<3>}	H(C[6]C[6]2)	122.7860	0.000	1	120.8697	5.013	18	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<2>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	122.9740	0.000	1	120.8697	5.013	18	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<2>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	124.7690	3.339	2	120.8697	5.013	18	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2515	0.199	2	120.8697	5.013	18	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|N<2>,1|O<1>}	H(C[6]C[6]2)	120.0620	0.000	1	120.8697	5.013	18	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|N<3>,1|O<1>}	H(C[6]C[6]2)	119.5975	0.431	4	120.8697	5.013	18	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|H<1>,2|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Ag<5>,1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7970	0.000	1	120.8697	5.013	18	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|H<1>,2|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|N<4>,2|H<1>}	H(C[6]C[6]2)	119.6060	0.000	1	120.8697	5.013	18	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|P<3>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	119.9105	0.016	2	120.8697	5.013	18	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|P<4>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.8230	0.000	1	120.8697	5.013	18	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|S<4>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<4>}	H(C[6]C[6]2)	116.9660	0.000	1	120.8697	5.013	18	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<2>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|N<3>}	H(C[6]C[6]2)	118.9700	0.000	1	120.2433	2.102	8	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<2>,1|H<1>,1|N<4>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|N<3>}	H(C[6]C[6]2)	117.9720	0.000	1	120.2433	2.102	8	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|N<3>,1|O<1>}	H(C[6]C[6]2)	121.7860	0.000	1	120.2433	2.102	8	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|N<3>,1|O<1>}	H(C[6]C[6]2)	121.7680	0.000	1	120.2433	2.102	8	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|N<3>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	121.2060	0.000	1	120.2433	2.102	8	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|N<3>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	118.8660	0.000	1	120.2433	2.102	8	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<2>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6380	0.000	1	120.2433	2.102	8	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<2>,1|H<1>,1|N<4>}	H(C[6]C[6]2)	120.7400	0.000	1	120.2433	2.102	8	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<2>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|N<3>}	H(C[6]C[6]2)	123.2000	0.000	1	120.2186	3.305	129	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.2997	0.094	3	120.2186	3.305	129	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	119.3900	0.082	2	120.2186	3.305	129	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3037	0.365	64	120.2186	3.305	129	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	118.9440	0.000	1	120.2186	3.305	129	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,2|N<3>}	H(C[6]C[6]2)	120.8415	1.077	17	120.2186	3.305	129	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|N<2>,2|C<3>}	H(C[6]C[6]2)	120.7097	1.379	3	120.2186	3.305	129	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.2832	0.944	26	120.2186	3.305	129	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|N<3>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	127.9560	0.000	1	120.2186	3.305	129	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|O<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	116.2066	7.009	5	120.2186	3.305	129	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|O<1>,1|S<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.9580	0.000	1	120.2186	3.305	129	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|O<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	118.4210	0.000	1	120.2186	3.305	129	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|O<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	118.6935	0.306	4	120.2186	3.305	129	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]2)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]2)(H){1|C<3>,1|H<1>,1|N<3>,2|C<4>}	H(C[6]C[6]2)	120.2670	0.000	1	120.2670	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|N<3>,1|O<1>}	H(C[6]C[6]2)	123.1277	0.695	3	120.3532	0.843	308	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cd<6>,1|C<3>,1|N<3>}	H(C[6]C[6]2)	119.8770	0.000	1	120.3532	0.843	308	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|N<3>}	H(C[6]C[6]2)	119.6730	0.000	1	120.3532	0.843	308	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<6>,1|C<3>,1|N<3>}	H(C[6]C[6]2)	119.8520	0.000	1	120.3532	0.843	308	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|N<3>}	H(C[6]C[6]2)	119.8905	0.811	2	120.3532	0.843	308	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|N<3>}	H(C[6]C[6]2)	121.8330	2.434	4	120.3532	0.843	308	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|N<3>}	H(C[6]C[6]2)	119.5230	0.243	6	120.3532	0.843	308	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<5>,1|C<3>,1|N<3>}	H(C[6]C[6]2)	120.0540	0.000	1	120.3532	0.843	308	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<6>,1|C<3>,1|N<2>}	H(C[6]C[6]2)	119.9750	0.000	1	120.3532	0.843	308	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<6>,1|C<3>,1|N<3>}	H(C[6]C[6]2)	120.2770	0.612	2	120.3532	0.843	308	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|Cl<1>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.3910	0.247	4	120.3532	0.843	308	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7666	0.719	35	120.3532	0.843	308	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|N<4>}	H(C[6]C[6]2)	120.1013	0.555	4	120.3532	0.843	308	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ag<3>,1|C<3>,1|N<3>}	H(C[6]C[6]2)	120.6590	0.000	1	120.3532	0.843	308	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|N<2>}	H(C[6]C[6]2)	120.4960	0.325	3	120.3532	0.843	308	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.0185	0.310	25	120.3532	0.843	308	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|N<1>}	H(C[6]C[6]2)	119.7170	0.207	4	120.3532	0.843	308	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	121.6230	0.000	1	120.3532	0.843	308	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0520	0.964	57	120.3532	0.843	308	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|N<4>}	H(C[6]C[6]2)	121.3688	1.415	4	120.3532	0.843	308	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|N<3>,1|O<1>}	H(C[6]C[6]2)	120.3765	0.043	2	120.3532	0.843	308	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cd<6>,1|C<3>,1|N<3>}	H(C[6]C[6]2)	120.3328	0.575	17	120.3532	0.843	308	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<5>,1|C<3>,1|N<3>}	H(C[6]C[6]2)	121.4840	0.000	1	120.3532	0.843	308	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|N<2>}	H(C[6]C[6]2)	120.7970	0.308	2	120.3532	0.843	308	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|N<3>}	H(C[6]C[6]2)	120.9391	1.099	13	120.3532	0.843	308	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<7>,1|C<3>,1|N<3>}	H(C[6]C[6]2)	120.2845	0.255	2	120.3532	0.843	308	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|N<3>}	H(C[6]C[6]2)	120.0840	0.165	4	120.3532	0.843	308	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|N<3>}	H(C[6]C[6]2)	120.2420	0.000	1	120.3532	0.843	308	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|N<3>}	H(C[6]C[6]2)	120.2650	0.000	1	120.3532	0.843	308	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Hg<3>,1|C<3>,1|N<3>}	H(C[6]C[6]2)	120.1440	0.000	1	120.3532	0.843	308	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Hg<4>,1|C<3>,1|N<3>}	H(C[6]C[6]2)	120.5192	0.329	12	120.3532	0.843	308	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|N<3>}	H(C[6]C[6]2)	121.1160	0.000	1	120.3532	0.843	308	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<6>,1|C<3>,1|N<3>}	H(C[6]C[6]2)	120.3023	0.182	3	120.3532	0.843	308	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<5>,1|C<3>,1|N<3>}	H(C[6]C[6]2)	122.0710	0.325	2	120.3532	0.843	308	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|N<3>}	H(C[6]C[6]2)	120.9810	0.390	6	120.3532	0.843	308	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|N<2>}	H(C[6]C[6]2)	120.6110	0.000	1	120.3532	0.843	308	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|N<3>}	H(C[6]C[6]2)	120.7145	0.843	54	120.3532	0.843	308	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|N<2>}	H(C[6]C[6]2)	122.4730	0.000	1	120.3532	0.843	308	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|N<3>}	H(C[6]C[6]2)	120.1968	0.169	5	120.3532	0.843	308	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|N<3>}	H(C[6]C[6]2)	120.5093	0.131	3	120.3532	0.843	308	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<4>,1|C<3>,1|N<3>}	H(C[6]C[6]2)	120.3915	0.334	13	120.3532	0.843	308	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<5>,1|C<3>,1|N<3>}	H(C[6]C[6]2)	121.0087	0.288	3	120.3532	0.843	308	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.9790	0.954	6	120.1819	1.950	11	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){3|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	119.2254	1.280	5	120.1819	1.950	11	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<2>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>}	H(C[6]C[6]2)	121.2138	1.651	4	120.2091	1.783	53	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1707	0.854	3	120.2091	1.783	53	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.7450	0.124	2	120.2091	1.783	53	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<2>,1|V<8>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<4>}	H(C[6]C[6]2)	119.9405	0.088	6	120.2091	1.783	53	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<2>,1|V<9>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<4>}	H(C[6]C[6]2)	119.3303	1.326	6	120.2091	1.783	53	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<2>,1|W<9>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,1|W<9>}	H(C[6]C[6]2)	119.7463	0.217	3	120.2091	1.783	53	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<2>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	115.5170	0.000	1	120.2091	1.783	53	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<2>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	122.0630	2.176	3	120.2091	1.783	53	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|O<1>}	H(C[6]C[6]2)	120.2566	1.128	5	120.2091	1.783	53	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|N<4>,2|C<3>}	H(C[6]C[6]2)	122.0650	0.000	1	120.2091	1.783	53	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|Co<5>,1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,2|N<2>}	H(C[6]C[6]2)	120.2218	0.229	4	120.2091	1.783	53	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|Cr<7>,1|C<3>,1|H<1>,1|H<2>}	C[6](C[6]C[6]H)2(H){1|C<4>,2|N<3>}	H(C[6]C[6]2)	120.5030	0.006	2	120.2091	1.783	53	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|Fe<5>,1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,2|N<2>}	H(C[6]C[6]2)	120.1630	0.485	4	120.2091	1.783	53	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|Li<5>,1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,2|N<2>}	H(C[6]C[6]2)	122.3175	0.364	2	120.2091	1.783	53	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|Mo<7>,1|C<3>,1|H<1>,1|H<2>}	C[6](C[6]C[6]H)2(H){1|C<4>,2|N<3>}	H(C[6]C[6]2)	120.5510	0.014	2	120.2091	1.783	53	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|Pd<5>,1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Pd<5>,1|C<4>,2|N<3>}	H(C[6]C[6]2)	119.4295	0.295	2	120.2091	1.783	53	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|Rh<5>,1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Rh<5>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	118.8150	0.000	1	120.2091	1.783	53	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|W<10>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<4>}	H(C[6]C[6]2)	120.1765	0.262	2	120.2091	1.783	53	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Co<6>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	120.1855	0.127	2	120.3107	0.240	20	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Fe<5>,1|C<4>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	121.8770	0.000	1	120.3107	0.240	20	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Fe<6>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	120.5117	0.152	6	120.3107	0.240	20	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	119.5610	0.105	2	120.3107	0.240	20	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ir<6>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	119.8010	0.000	1	120.3107	0.240	20	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.0940	0.163	2	120.3107	0.240	20	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pt<4>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	120.0010	0.000	1	120.3107	0.240	20	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pt<6>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	120.3568	0.133	5	120.3107	0.240	20	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.8585	1.170	2	120.5271	0.983	9	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.2530	0.008	2	120.5271	0.983	9	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<2>}	H(C[6]C[6]2)	119.6930	0.000	1	120.5271	0.983	9	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	121.4765	0.327	2	120.5271	0.983	9	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.9375	0.298	2	120.5271	0.983	9	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|H<1>,2|N<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.8510	0.000	1	120.8510	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[5,5]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|H<1>,2|C<3>}	C[6](C[6]C[5,5]C[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>,2|C<4>}	H(C[6]C[6]2)	118.9135	0.252	2	118.9135	0.064	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[5,6]O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<4>,1|O<1>,2|H<1>}	C[6](C[6]C[5,6]O)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>,1|O<1>}	H(C[6]C[6]2)	119.0110	0.000	1	119.0110	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|N<3>,2|C<3>}	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>,2|N<3>}	H(C[6]C[6]2)	119.5635	0.026	2	119.5635	0.001	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|N<2>,2|C<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|N<3>,1|O<1>,2|C<3>}	H(C[6]C[6]2)	120.2480	0.000	1	120.2480	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<4>,1|H<1>,1|O<1>}	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H){1|C<3>,1|O<2>,2|C<4>}	H(C[6]C[6]2)	118.8890	0.000	1	118.8890	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]2)(C[6]C[6]H)(H){1|H<1>,1|O<1>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	119.8287	0.343	4	119.4713	0.189	9	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]2)(C[6]C[6]H)(H){1|H<1>,1|O<1>,3|C<3>}	H(C[6]C[6]2)	119.2595	0.208	4	119.4713	0.189	9	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]2)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>,2|N<3>}	H(C[6]C[6]2)	118.8890	0.000	1	119.4713	0.189	9	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]Br)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Br<1>,1|C<3>,1|C<4>}	C[6](C[6]C[6]Br)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	119.0160	0.000	1	119.9736	4.273	9	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]Br)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Br<1>,2|C<3>}	C[6](C[6]C[6]Br)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	120.0932	2.176	8	119.9736	4.273	9	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<2>,1|C<3>,1|H<1>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	119.3185	0.227	2	120.0660	2.761	105	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<2>,1|C<3>,1|H<1>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|O<2>}	H(C[6]C[6]2)	121.0830	0.000	1	120.0660	2.761	105	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<2>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|O<2>}	H(C[6]C[6]2)	121.7250	0.000	1	120.0660	2.761	105	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	119.6080	0.330	22	120.0660	2.761	105	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	118.7580	0.000	1	120.0660	2.761	105	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|P<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	118.9290	0.000	1	120.0660	2.761	105	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,1|O<2>,2|C<4>}	H(C[6]C[6]2)	115.7460	0.000	1	120.0660	2.761	105	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	119.6050	1.208	7	120.0660	2.761	105	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	122.6220	0.000	1	120.0660	2.761	105	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,1|O<2>,2|C<3>}	H(C[6]C[6]2)	118.9730	0.000	1	120.0660	2.761	105	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	120.2943	2.417	36	120.0660	2.761	105	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|O<1>,1|O<2>}	H(C[6]C[6]2)	120.5549	0.793	21	120.0660	2.761	105	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|I<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	119.0830	0.000	2	120.0660	2.761	105	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	119.4646	0.279	5	120.0660	2.761	105	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|O<2>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|O<1>,1|O<2>}	H(C[6]C[6]2)	121.9450	0.000	1	120.0660	2.761	105	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<2>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	121.0805	1.455	2	120.0660	2.761	105	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Br<1>,1|Cl<1>,1|C<3>}	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	119.4090	0.000	1	120.1433	2.118	15	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Cl<1>,1|C<3>,1|H<1>}	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	119.1580	0.202	2	120.1433	2.118	15	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Cl<1>,1|C<3>,1|H<1>}	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|Cl<1>,1|C<3>,1|O<1>}	H(C[6]C[6]2)	120.5550	0.899	2	120.1433	2.118	15	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Cl<1>,1|C<3>,1|N<3>}	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	123.8590	0.000	1	120.1433	2.118	15	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Cl<1>,2|C<3>}	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	120.1073	1.279	7	120.1433	2.118	15	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){2|Cl<1>,1|C<3>}	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	119.3520	1.044	2	120.1433	2.118	15	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]F)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|F<1>,1|H<1>}	C[6](C[6]C[6]F)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	119.1230	1.431	2	119.0828	0.434	6	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]F)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Cl<1>,1|C<3>,1|F<1>}	C[6](C[6]C[6]F)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	119.0627	0.197	4	119.0828	0.434	6	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]I)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|I<1>}	C[6](C[6]C[6]H)(C[6]C[6]I)(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	119.5967	0.673	11	119.6044	0.362	14	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]I)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|I<2>}	C[6](C[6]C[6]H)(C[6]C[6]I)(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	119.5570	0.378	2	119.6044	0.362	14	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]I)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|I<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]C[6]I)(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	119.7830	0.000	1	119.6044	0.362	14	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	119.0363	0.247	3	119.1228	2.818	128	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	119.1085	0.028	2	119.1228	2.818	128	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|N<3>,1|O<1>}	H(C[6]C[6]2)	113.7960	0.000	1	119.1228	2.818	128	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|O<1>,1|O<2>}	H(C[6]C[6]2)	116.9386	7.448	5	119.1228	2.818	128	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|O<1>,1|S<2>}	H(C[6]C[6]2)	120.8370	0.000	1	119.1228	2.818	128	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|O<1>,2|C<3>}	H(C[6]C[6]2)	119.5410	0.000	1	119.1228	2.818	128	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	119.3054	0.423	64	119.1228	2.818	128	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|O<1>,2|C<3>}	H(C[6]C[6]2)	119.4620	0.245	4	119.1228	2.818	128	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	119.8780	0.000	1	119.1228	2.818	128	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<2>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	117.7950	0.000	1	119.1228	2.818	128	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,2|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	118.8854	1.676	16	119.1228	2.818	128	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|N<2>,2|C<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	119.9853	0.781	3	119.1228	2.818	128	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	119.2439	0.829	26	119.1228	2.818	128	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|O<1>}	H(C[6]C[6]2)	120.0130	0.035	2	119.9589	2.585	162	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	119.2117	0.223	3	119.9589	2.585	162	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|O<1>}	H(C[6]C[6]2)	119.6747	0.083	3	119.9589	2.585	162	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	119.7611	1.250	118	119.9589	2.585	162	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.5300	0.088	2	119.9589	2.585	162	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|I<1>,1|O<1>}	H(C[6]C[6]2)	119.5260	0.269	2	119.9589	2.585	162	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|N<3>,1|O<1>}	H(C[6]C[6]2)	118.9130	0.000	1	119.9589	2.585	162	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Cl<1>,1|C<3>,1|O<1>}	H(C[6]C[6]2)	120.0600	0.000	1	119.9589	2.585	162	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|O<1>,2|C<3>}	H(C[6]C[6]2)	119.7030	0.181	3	119.9589	2.585	162	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|O<2>,2|C<3>}	H(C[6]C[6]2)	120.9447	1.961	3	119.9589	2.585	162	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	120.2420	0.296	2	119.9589	2.585	162	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|I<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	119.1920	0.163	2	119.9589	2.585	162	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|I<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|O<1>,1|O<2>}	H(C[6]C[6]2)	119.2000	0.000	1	119.9589	2.585	162	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|N<3>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	119.1040	0.000	1	119.9589	2.585	162	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|O<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|I<1>,1|O<1>}	H(C[6]C[6]2)	119.0190	0.000	1	119.9589	2.585	162	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|O<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|O<1>,1|O<2>}	H(C[6]C[6]2)	126.3715	0.930	2	119.9589	2.585	162	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|O<1>,1|S<3>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|O<1>,1|S<3>}	H(C[6]C[6]2)	125.2260	0.514	4	119.9589	2.585	162	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Cl<1>,1|C<3>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	118.5990	0.000	1	119.9589	2.585	162	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Cl<1>,1|C<3>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Cl<1>,1|C<3>,1|O<1>}	H(C[6]C[6]2)	119.1590	0.233	2	119.9589	2.585	162	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|O<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	119.0070	0.195	3	119.9589	2.585	162	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|O<2>,2|C<3>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	120.3003	2.061	3	119.9589	2.585	162	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Pd<4>,1|C<4>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Pd<4>,1|C<4>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	119.5760	0.290	2	119.9589	2.585	162	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]S)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|S<2>}	C[6](C[6]C[6]H)(C[6]C[6]S)(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	119.2488	0.109	4	119.2228	0.034	23	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]S)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|S<4>}	C[6](C[6]C[6]H)(C[6]C[6]S)(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	119.2173	0.197	19	119.2228	0.034	23	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|O<2>}	H(C[6]C[6]2)	120.7937	0.262	6	120.5644	0.517	22	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<6>,1|C<3>,1|O<2>}	H(C[6]C[6]2)	120.6937	0.234	3	120.5644	0.517	22	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<4>,1|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<2>,1|O<2>}	H(C[6]C[6]2)	120.6770	0.000	1	120.5644	0.517	22	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|N<3>,2|C<4>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.5612	1.054	9	120.5644	0.517	22	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|N<3>,2|C<4>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<5>,1|C<3>,1|O<2>}	H(C[6]C[6]2)	119.9750	0.000	1	120.5644	0.517	22	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|N<3>,2|C<4>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<5>,1|C<3>,1|O<2>}	H(C[6]C[6]2)	119.9355	0.021	2	120.5644	0.517	22	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Br<1>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|O<1>}	H(C[6]C[6]2)	119.7730	0.000	1	120.3456	0.335	126	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Br<1>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|O<1>,1|O<2>}	H(C[6]C[6]2)	120.1880	0.000	1	120.3456	0.335	126	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Bi<6>,1|C<3>,1|O<2>}	H(C[6]C[6]2)	119.9125	0.145	2	120.3456	0.335	126	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.9093	0.154	3	120.3456	0.335	126	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|O<2>}	H(C[6]C[6]2)	119.2990	0.000	1	120.3456	0.335	126	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|O<2>}	H(C[6]C[6]2)	120.8155	0.468	6	120.3456	0.335	126	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|O<2>}	H(C[6]C[6]2)	120.3277	0.443	3	120.3456	0.335	126	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|O<2>}	H(C[6]C[6]2)	119.7885	0.077	4	120.3456	0.335	126	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<6>,1|C<3>,1|O<2>}	H(C[6]C[6]2)	120.0820	0.000	1	120.3456	0.335	126	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Os<6>,1|C<3>,1|O<2>}	H(C[6]C[6]2)	119.8583	0.729	3	120.3456	0.335	126	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|O<2>}	H(C[6]C[6]2)	120.4051	0.451	11	120.3456	0.335	126	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|O<2>}	H(C[6]C[6]2)	120.4340	0.000	1	120.3456	0.335	126	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|O<2>}	H(C[6]C[6]2)	120.9743	0.135	3	120.3456	0.335	126	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|O<2>}	H(C[6]C[6]2)	119.5980	0.000	1	120.3456	0.335	126	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<9>,1|C<3>,1|O<2>}	H(C[6]C[6]2)	119.7587	0.708	3	120.3456	0.335	126	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sn<6>,1|C<3>,1|O<2>}	H(C[6]C[6]2)	121.1680	0.000	1	120.3456	0.335	126	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<5>,1|C<3>,1|O<2>}	H(C[6]C[6]2)	119.2470	0.000	1	120.3456	0.335	126	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<6>,1|C<3>,1|O<2>}	H(C[6]C[6]2)	120.4223	0.345	3	120.3456	0.335	126	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.2000	0.000	1	120.3456	0.335	126	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|O<1>,1|O<2>}	H(C[6]C[6]2)	120.4750	0.000	1	120.3456	0.335	126	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Cl<1>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|O<1>,1|O<2>}	H(C[6]C[6]2)	120.4120	0.000	1	120.3456	0.335	126	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|O<2>}	H(C[6]C[6]2)	120.4165	0.569	2	120.3456	0.335	126	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.5150	0.119	2	120.3456	0.335	126	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|H<1>,1|N<3>,1|O<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|O<2>}	H(C[6]C[6]2)	120.7250	0.437	3	120.3456	0.335	126	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|H<1>,1|N<3>,1|O<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<8>,1|C<3>,1|O<2>}	H(C[6]C[6]2)	120.4430	0.461	6	120.3456	0.335	126	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|O<2>}	H(C[6]C[6]2)	119.4976	0.375	5	120.3456	0.335	126	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.9476	0.444	5	120.3456	0.335	126	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|O<2>,2|C<3>}	H(C[6]C[6]2)	120.4400	0.000	1	120.3456	0.335	126	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|O<2>}	H(C[6]C[6]2)	120.6346	0.457	11	120.3456	0.335	126	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.2626	0.641	20	120.3456	0.335	126	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,2|O<2>}	H(C[6]C[6]2)	120.6650	0.000	1	120.3456	0.335	126	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|O<2>}	H(C[6]C[6]2)	120.7040	0.052	2	120.3456	0.335	126	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|O<2>}	H(C[6]C[6]2)	121.4935	0.173	2	120.3456	0.335	126	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|O<2>}	H(C[6]C[6]2)	120.9430	0.124	2	120.3456	0.335	126	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|O<2>}	H(C[6]C[6]2)	120.4930	0.000	1	120.3456	0.335	126	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<6>,1|C<3>,1|O<2>}	H(C[6]C[6]2)	121.0740	0.109	2	120.3456	0.335	126	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|O<2>}	H(C[6]C[6]2)	120.6875	0.159	2	120.3456	0.335	126	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|O<2>,2|C<3>}	H(C[6]C[6]2)	120.4620	0.000	1	120.3456	0.335	126	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|O<2>}	H(C[6]C[6]2)	120.4190	0.000	1	120.3456	0.335	126	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<6>,1|C<3>,1|O<2>}	H(C[6]C[6]2)	120.8155	0.037	2	120.3456	0.335	126	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<4>,1|C<3>,1|O<2>}	H(C[6]C[6]2)	120.8460	0.000	1	120.3456	0.335	126	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Ru<7>,1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<7>,1|C<4>,1|O<2>}	H(C[6]C[6]2)	119.8400	0.055	2	120.3456	0.335	126	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Br<1>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	119.2100	0.000	1	120.2144	3.155	153	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<2>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|O<2>}	H(C[6]C[6]2)	121.4244	3.815	5	120.2144	3.155	153	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<2>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|O<3>}	H(C[6]C[6]2)	122.9860	0.000	1	120.2144	3.155	153	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<2>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|O<2>}	H(C[6]C[6]2)	123.1453	4.205	3	120.2144	3.155	153	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	119.2295	0.018	2	120.2144	3.155	153	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	121.2458	3.062	4	120.2144	3.155	153	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|O<1>,1|O<2>}	H(C[6]C[6]2)	119.7922	0.560	4	120.2144	3.155	153	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|O<2>,2|C<3>}	H(C[6]C[6]2)	122.2280	0.000	1	120.2144	3.155	153	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	121.1295	1.013	2	120.2144	3.155	153	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(H){1|O<1>,2|C<3>}	H(C[6]C[6]2)	120.1030	0.000	1	120.2144	3.155	153	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(H){1|O<2>,2|C<3>}	H(C[6]C[6]2)	119.8618	0.713	33	120.2144	3.155	153	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|P<4>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	117.8240	0.000	1	120.2144	3.155	153	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|S<4>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|O<1>,1|P<4>}	H(C[6]C[6]2)	118.9640	0.000	1	120.2144	3.155	153	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,2|O<2>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	119.1610	0.000	1	120.2144	3.155	153	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<2>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	130.3950	0.000	1	120.2144	3.155	153	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	119.6513	0.516	8	120.2144	3.155	153	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|O<1>}	H(C[6]C[6]2)	120.4344	0.221	5	120.2144	3.155	153	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<4>,1|W<7>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|O<2>,1|W<7>}	H(C[6]C[6]2)	117.8100	0.000	1	120.2144	3.155	153	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Ce<18>,1|C<3>,1|H<1>,1|O<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|O<3>}	H(C[6]C[6]2)	120.2665	0.545	4	120.2144	3.155	153	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Dy<15>,1|C<3>,1|H<1>,1|O<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|O<2>}	H(C[6]C[6]2)	119.4985	0.101	2	120.2144	3.155	153	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Er<14>,1|C<3>,1|H<1>,1|O<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|O<3>}	H(C[6]C[6]2)	120.0990	0.000	1	120.2144	3.155	153	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Gd<15>,1|C<3>,1|H<1>,1|O<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|O<2>}	H(C[6]C[6]2)	119.6025	0.214	2	120.2144	3.155	153	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|H<1>,1|P<4>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<4>,2|O<2>}	H(C[6]C[6]2)	122.4027	0.858	4	120.2144	3.155	153	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|O<1>}	H(C[6]C[6]2)	120.4820	0.000	1	120.2144	3.155	153	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|F<1>,1|O<1>}	H(C[6]C[6]2)	120.4140	0.000	1	120.2144	3.155	153	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	119.8288	1.324	36	120.2144	3.155	153	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|O<1>,1|O<2>}	H(C[6]C[6]2)	118.8440	7.628	2	120.2144	3.155	153	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|O<1>,2|C<3>}	H(C[6]C[6]2)	120.0565	0.054	2	120.2144	3.155	153	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.2660	0.000	2	120.2144	3.155	153	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Ho<15>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|O<3>}	H(C[6]C[6]2)	120.0695	0.148	2	120.2144	3.155	153	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|La<18>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|O<3>}	H(C[6]C[6]2)	119.6313	0.268	3	120.2144	3.155	153	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Nd<18>,1|C<3>,1|H<1>,1|O<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|O<3>}	H(C[6]C[6]2)	120.7355	0.250	2	120.2144	3.155	153	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Pd<4>,1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<4>,2|O<2>}	H(C[6]C[6]2)	120.1770	0.486	4	120.2144	3.155	153	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Re<7>,1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Re<7>,1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.8190	0.000	1	120.2144	3.155	153	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Rh<5>,1|C<3>,1|H<1>,1|H<2>}	C[6](C[6]C[6]H)2(H){1|C<4>,2|O<2>}	H(C[6]C[6]2)	120.9330	0.102	2	120.2144	3.155	153	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Tb<15>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|O<3>}	H(C[6]C[6]2)	119.9335	0.231	2	120.2144	3.155	153	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Ti<11>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|O<3>}	H(C[6]C[6]2)	120.9705	0.062	2	120.2144	3.155	153	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Yb<15>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|O<3>}	H(C[6]C[6]2)	119.9550	0.092	2	120.2144	3.155	153	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Zr<13>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Zr<13>,1|C<3>,1|O<2>,1|O<3>}	H(C[6]C[6]2)	120.2210	0.000	1	120.2144	3.155	153	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]N[4])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<2>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[4])(C[6]C[6]H)(H){1|C<4>,1|O<2>,2|C<3>}	H(C[6]C[6]2)	120.4080	0.000	1	120.4080	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]N[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|N<3>}	C[6](C[6]C[6]N[5])(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|H<1>,1|N<2>,1|O<2>}	H(C[6]C[6]2)	119.9600	0.000	1	119.9600	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ir<8>,1|N<3>,1|O<2>,2|C<3>}	H(C[6]C[6]2)	120.3880	0.410	2	120.3880	0.168	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,1|O<1>,3|C<3>}	H(C[6]C[6]2)	119.3740	0.137	4	119.2978	0.043	5	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){3|C<3>}	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,1|O<1>,3|C<3>}	H(C[6]C[6]2)	118.9930	0.000	1	119.2978	0.043	5	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|O<2>,3|C<3>}	H(C[6]C[6]2)	120.2480	0.000	1	120.2480	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|Cl<1>,1|C<2>,1|H<1>}	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|C<3>,1|P<4>}	H(C[6]C[6]2)	123.0590	0.000	1	118.6630	38.650	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|Cl<1>,1|C<3>}	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|C<2>,1|H<1>,1|P<4>}	H(C[6]C[6]2)	114.2670	0.000	1	118.6630	38.650	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](C[6]C[6]F)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<2>,1|F<1>,1|H<1>}	C[6](C[6]C[6]F)(C[6]C[6]H)(H){1|C<3>,1|P<4>}	H(C[6]C[6]2)	115.4145	2.340	2	115.4145	5.475	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|P<4>}	H(C[6]C[6]2)	119.5970	0.000	1	119.5970	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|P<4>}	H(C[6]C[6]2)	119.4970	0.000	1	119.8330	0.226	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|P<4>}	H(C[6]C[6]2)	120.1690	0.000	1	119.8330	0.226	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<2>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<2>,1|P<4>}	H(C[6]C[6]2)	120.7810	0.000	1	120.5748	5.954	79	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<2>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|P<3>}	H(C[6]C[6]2)	117.6820	0.000	1	120.5748	5.954	79	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<2>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|P<4>}	H(C[6]C[6]2)	120.9838	3.210	34	120.5748	5.954	79	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|P<4>}	H(C[6]C[6]2)	122.2170	0.000	1	120.5748	5.954	79	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<3>,1|H<1>,1|S<4>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|O<1>,1|P<4>}	H(C[6]C[6]2)	119.7330	0.000	1	120.5748	5.954	79	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<2>,1|H<1>,1|P<4>}	H(C[6]C[6]2)	120.7115	1.962	24	120.5748	5.954	79	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<3>,3|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|P<4>}	H(C[6]C[6]2)	119.3872	0.512	5	120.5748	5.954	79	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|P<4>,2|H<1>}	H(C[6]C[6]2)	119.8200	0.000	1	120.5748	5.954	79	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Ti<10>,1|C<3>,1|N<3>,1|P<4>}	H(C[6]C[6]2)	120.1207	0.363	3	120.5748	5.954	79	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Ti<8>,1|C<3>,1|N<3>,1|P<4>}	H(C[6]C[6]2)	120.0795	0.293	2	120.5748	5.954	79	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|P<4>,2|H<1>}	H(C[6]C[6]2)	119.7380	0.000	1	120.5748	5.954	79	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|Hf<13>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|P<4>}	H(C[6]C[6]2)	119.9700	0.000	1	120.5748	5.954	79	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|La<14>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|P<4>}	H(C[6]C[6]2)	118.7450	0.000	1	120.5748	5.954	79	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|Zr<13>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|P<4>}	H(C[6]C[6]2)	119.7385	0.288	2	120.5748	5.954	79	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|Zr<14>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|P<4>}	H(C[6]C[6]2)	119.2660	0.000	1	120.5748	5.954	79	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|P<4>,2|C<3>}	H(C[6]C[6]2)	119.4960	0.000	1	119.4960	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]S)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]S)(H){1|C<2>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|S<4>}	H(C[6]C[6]2)	122.0570	0.000	1	120.0383	12.319	26	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]S)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]S)(H){1|C<2>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<2>,1|S<4>}	H(C[6]C[6]2)	120.2820	0.000	1	120.0383	12.319	26	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]S)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]S)(H){1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<2>,1|H<1>,1|S<4>}	H(C[6]C[6]2)	119.6232	3.363	4	120.0383	12.319	26	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]S)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]S)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	H(C[6]C[6]2)	120.5875	2.245	2	120.0383	12.319	26	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]S)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]S)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<3>}	H(C[6]C[6]2)	119.5025	3.505	2	120.0383	12.319	26	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]S)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]S)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<4>}	H(C[6]C[6]2)	119.9990	4.088	16	120.0383	12.319	26	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]S)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]S)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|S<2>}	H(C[6]C[6]2)	119.4347	0.177	4	119.9011	0.083	23	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]S)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]S)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|S<4>}	H(C[6]C[6]2)	119.9993	0.195	19	119.9011	0.083	23	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]S)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]S)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	H(C[6]C[6]2)	119.3860	0.000	1	121.2096	4.291	16	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]S)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]S)(H){1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	H(C[6]C[6]2)	121.8680	3.175	5	121.2096	4.291	16	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]S)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]S)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|S<4>}	H(C[6]C[6]2)	118.8020	0.000	1	121.2096	4.291	16	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]S)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]S)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|S<4>}	H(C[6]C[6]2)	122.2743	1.836	3	121.2096	4.291	16	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]S)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]S)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|S<4>}	H(C[6]C[6]2)	121.1703	0.337	4	121.2096	4.291	16	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]S)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]S)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<4>,1|C<3>,1|S<2>}	H(C[6]C[6]2)	120.1610	0.260	2	121.2096	4.291	16	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]S)(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]S)(H){1|H<1>,1|N<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,1|H<1>,1|S<4>}	H(C[6]C[6]2)	120.2260	0.000	2	120.2260	0.000	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]S)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]S)(H){1|C<2>,1|H<1>,1|S<2>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|S<2>}	H(C[6]C[6]2)	122.4398	6.238	4	119.9947	16.577	15	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]S)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]S)(H){1|C<2>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|S<2>}	H(C[6]C[6]2)	114.9460	5.774	2	119.9947	16.577	15	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]S)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]S)(H){1|C<2>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|S<4>}	H(C[6]C[6]2)	122.0150	0.000	1	119.9947	16.577	15	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]S)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]S)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<2>,1|H<1>,1|S<3>}	H(C[6]C[6]2)	119.7920	0.000	1	119.9947	16.577	15	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]S)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]S)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<2>,1|H<1>,1|S<4>}	H(C[6]C[6]2)	118.9450	0.000	1	119.9947	16.577	15	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]S)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]S)(H){1|C<4>,1|O<2>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|O<2>,1|S<3>}	H(C[6]C[6]2)	120.2895	0.672	2	119.9947	16.577	15	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]S)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]S)(H){1|Ti<8>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|S<3>}	H(C[6]C[6]2)	120.2305	0.008	2	119.9947	16.577	15	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]S)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]S)(H){1|Y<12>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|S<3>}	H(C[6]C[6]2)	119.2190	0.000	1	119.9947	16.577	15	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]S)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]S)(H){1|Yb<12>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|S<3>}	H(C[6]C[6]2)	119.2590	0.000	1	119.9947	16.577	15	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]U)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]U)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|U<15>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	118.3630	0.000	1	118.6990	0.226	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]U)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]U)(H){1|Te<2>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|U<13>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.0350	0.000	1	118.6990	0.226	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]W)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]W)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,1|W<9>}	H(C[6]C[6]2)	119.3243	0.367	3	119.3243	0.135	3	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]Y)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]Y)(H){1|C<3>,1|H<1>,1|S<3>}	C[6](C[6]C[6]H)2(H){1|Y<13>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	118.6790	0.000	1	118.6790	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]2)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]2)(H){1|C<3>,1|H<1>,1|N<3>,2|C<4>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	119.6480	0.000	1	119.6480	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]2)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]2)(H){1|C<3>,1|H<1>,1|V<7>,2|C<4>}	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	H(C[6]C[6]2)	120.0380	0.000	1	120.6181	0.231	11	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]2)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]2)(H){1|C<3>,1|H<1>,3|C<4>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	119.9115	0.445	2	120.6181	0.231	11	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]2)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]2)(H){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.8097	0.088	3	120.6181	0.231	11	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]2)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]2)(H){1|Pd<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	121.1095	0.047	2	120.6181	0.231	11	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]2)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]2)(H){1|Re<6>,1|C<4>,1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(H){3|N<3>}	H(C[6]C[6]2)	120.8340	0.267	2	120.6181	0.231	11	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]2)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]2)(H){1|Ru<6>,1|C<4>,1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	H(C[6]C[6]2)	120.6220	0.000	1	120.6181	0.231	11	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]B)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]B)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|B<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.3650	0.085	5	119.3241	0.113	79	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]B)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]B)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|B<4>}	H(C[6]C[6]2)	119.9125	0.172	2	119.3241	0.113	79	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]B)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]B)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|B<4>}	H(C[6]C[6]2)	119.7865	0.194	2	119.3241	0.113	79	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]B)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]B)(H){1|Fe<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|B<4>}	H(C[6]C[6]2)	119.8955	0.008	2	119.3241	0.113	79	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]B)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]B)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|B<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.1692	0.188	17	119.3241	0.113	79	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]B)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]B)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|B<4>}	H(C[6]C[6]2)	119.6963	0.151	11	119.3241	0.113	79	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]B)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]B)(H){1|Li<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|B<4>,1|C<3>,1|N<3>}	H(C[6]C[6]2)	119.3600	0.047	2	119.3241	0.113	79	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]B)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]B)(H){1|Mg<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|B<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.1767	0.161	12	119.3241	0.113	79	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]B)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]B)(H){1|Ni<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|B<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.2092	0.189	4	119.3241	0.113	79	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]B)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]B)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|B<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	118.7775	0.203	2	119.3241	0.113	79	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]B)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]B)(H){1|Pt<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|B<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.5024	0.300	8	119.3241	0.113	79	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]B)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]B)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|B<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.1395	0.282	8	119.3241	0.113	79	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]B)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]B)(H){1|Ru<9>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|B<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	118.7215	0.019	2	119.3241	0.113	79	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]B)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]B)(H){1|Sc<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|B<4>}	H(C[6]C[6]2)	119.1210	0.600	2	119.3241	0.113	79	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<6>,2|C<3>}	C[6](C[6]C[6]2)(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.7546	0.376	10	120.7546	0.142	10	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]Br)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Br<1>,1|C<3>,1|O<1>}	C[6](C[6]C[6]Br)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	117.4580	0.000	1	119.7744	0.653	13	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]Br)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Br<1>,1|Fe<6>,1|C<3>}	C[6](C[6]C[6]Br)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9402	0.253	6	119.7744	0.653	13	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]Br)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Br<1>,1|Ni<6>,1|C<3>}	C[6](C[6]C[6]Br)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9947	0.582	6	119.7744	0.653	13	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5251	2.238	10	120.5380	1.386	108	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|C<4>}	H(C[6]C[6]2)	120.1285	0.134	2	120.5380	1.386	108	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.3400	0.119	2	120.5380	1.386	108	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.2030	0.000	1	120.5380	1.386	108	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cd<6>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5140	0.116	4	120.5380	1.386	108	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<5>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	121.1937	0.207	3	120.5380	1.386	108	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<6>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3620	0.000	1	120.5380	1.386	108	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<6>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5296	0.197	8	120.5380	1.386	108	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cr<6>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.8450	0.000	1	120.5380	1.386	108	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cr<6>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7200	0.000	1	120.5380	1.386	108	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<4>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3680	0.000	1	120.5380	1.386	108	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<4>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5400	0.000	1	120.5380	1.386	108	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<5>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3520	0.000	1	120.5380	1.386	108	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<5>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8007	0.186	4	120.5380	1.386	108	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<5>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3740	0.115	2	120.5380	1.386	108	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<6>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8800	0.000	1	120.5380	1.386	108	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<2>,1|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3565	0.166	2	120.5380	1.386	108	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1420	0.000	1	120.5380	1.386	108	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2976	0.259	13	120.5380	1.386	108	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5846	0.116	5	120.5380	1.386	108	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0040	0.559	2	120.5380	1.386	108	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<8>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.6960	0.000	1	120.5380	1.386	108	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<6>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6730	0.192	2	120.5380	1.386	108	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<7>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7317	0.056	3	120.5380	1.386	108	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<5>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	129.6680	0.000	1	120.5380	1.386	108	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6781	0.615	10	120.5380	1.386	108	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6095	0.220	4	120.5380	1.386	108	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0680	0.031	2	120.5380	1.386	108	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pt<6>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2050	0.000	1	120.5380	1.386	108	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Re<6>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5180	0.000	1	120.5380	1.386	108	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Re<6>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2845	0.228	2	120.5380	1.386	108	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<6>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.6990	0.000	1	120.5380	1.386	108	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<5>,1|C<2>,1|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5875	0.046	2	120.5380	1.386	108	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<5>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6005	0.036	2	120.5380	1.386	108	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<5>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5860	0.240	2	120.5380	1.386	108	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<6>,1|C<2>,1|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3464	0.151	5	120.5380	1.386	108	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<6>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	118.8660	0.000	1	120.5380	1.386	108	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<6>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8850	0.380	2	120.5380	1.386	108	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]F)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<5>,1|C<3>,1|F<1>}	C[6](C[6]C[6]F)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4510	0.000	1	120.4510	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<2>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<4>,1|N<2>}	H(C[6]C[6]2)	121.2630	0.000	1	120.5546	2.798	22	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|N<3>,2|C<4>}	H(C[6]C[6]2)	120.9860	2.599	9	120.5546	2.798	22	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<5>,1|C<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|N<3>,2|C<4>}	H(C[6]C[6]2)	120.4500	0.000	1	120.5546	2.798	22	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0193	0.262	6	120.5546	2.798	22	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<5>,1|C<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|N<3>,2|C<4>}	H(C[6]C[6]2)	120.4555	0.177	2	120.5546	2.798	22	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<6>,1|C<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1960	0.130	3	120.5546	2.798	22	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|P<4>}	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4550	0.000	1	120.4550	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|N<2>}	H(C[6]C[6]2)	120.8985	0.244	4	121.3083	0.630	40	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<6>,1|C<3>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<6>,1|C<3>,1|N<3>}	H(C[6]C[6]2)	121.0936	0.183	8	121.3083	0.630	40	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<4>,1|C<3>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<4>,1|C<3>,1|N<3>}	H(C[6]C[6]2)	121.1055	0.114	4	121.3083	0.630	40	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<5>,1|C<3>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<5>,1|C<3>,1|N<3>}	H(C[6]C[6]2)	121.2230	0.159	4	121.3083	0.630	40	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Li<5>,1|C<3>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Li<5>,1|C<3>,1|N<3>}	H(C[6]C[6]2)	123.2980	1.197	4	121.3083	0.630	40	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<6>,1|C<3>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<6>,1|C<3>,1|N<3>}	H(C[6]C[6]2)	120.8406	0.380	7	121.3083	0.630	40	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|N<3>}	H(C[6]C[6]2)	121.3384	0.229	5	121.3083	0.630	40	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|N<3>}	H(C[6]C[6]2)	121.1765	0.173	2	121.3083	0.630	40	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<6>,1|C<3>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<6>,1|C<3>,1|N<3>}	H(C[6]C[6]2)	121.2775	0.066	2	121.3083	0.630	40	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ca<8>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|N<3>}	H(C[6]C[6]2)	123.4840	0.491	2	122.5408	1.213	5	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<6>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|N<3>}	H(C[6]C[6]2)	121.3000	0.000	1	122.5408	1.213	5	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Li<4>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|N<3>}	H(C[6]C[6]2)	121.4820	0.000	1	122.5408	1.213	5	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mg<6>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|N<3>}	H(C[6]C[6]2)	122.9540	0.000	1	122.5408	1.213	5	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Re<6>,1|C<4>,1|N<2>}	H(C[6]C[6]2)	120.6880	0.000	1	120.6880	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,1|N<2>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|C<3>,1|N<3>}	H(C[6]C[6]2)	120.7070	0.000	1	120.7070	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|N<3>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|B<4>,1|C<4>,1|N<2>}	H(C[6]C[6]2)	120.2109	0.088	9	120.1935	0.009	11	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|N<3>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|C<4>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.1150	0.132	2	120.1935	0.009	11	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ag<3>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.2810	0.010	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ag<3>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	H(C[6]C[6]2)	120.9015	0.035	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ag<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.2937	0.049	3	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ag<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6440	0.004	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ag<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3024	0.319	11	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ag<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	H(C[6]C[6]2)	120.5760	0.253	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ag<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	H(C[6]C[6]2)	120.5895	0.012	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ag<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	121.0920	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Al<3>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.4090	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Al<3>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	H(C[6]C[6]2)	119.9900	0.656	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Al<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.0377	0.276	3	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Al<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1800	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Al<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5220	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Al<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.2790	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Al<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.5330	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Al<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.1028	0.302	4	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Al<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.3646	0.357	8	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Al<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2683	0.500	14	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Al<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	H(C[6]C[6]2)	119.5790	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Al<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7770	0.000	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Al<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.3363	0.691	16	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Al<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.6895	0.195	4	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Al<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1483	0.142	3	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Al<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.6811	0.546	13	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Au<3>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<2>}	H(C[6]C[6]2)	120.1178	0.265	4	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Au<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.2130	0.243	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Au<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7960	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|B<3>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4070	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|B<3>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	H(C[6]C[6]2)	119.9874	0.191	7	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.4075	0.161	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.2053	0.143	9	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	H(C[6]C[6]2)	119.4970	0.073	6	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|B<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<2>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9860	0.360	4	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|B<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.0282	3.790	5	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Bi<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2450	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<2>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<2>,1|N<2>}	H(C[6]C[6]2)	121.1340	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<2>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<2>}	H(C[6]C[6]2)	120.3650	0.441	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<2>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5169	0.302	7	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	119.7270	0.014	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.3472	0.375	25	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7481	0.858	26	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<2>}	H(C[6]C[6]2)	119.4578	0.141	4	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.6090	0.268	4	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	H(C[6]C[6]2)	119.6875	0.202	24	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|D<1>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0090	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.4400	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.6246	1.865	5	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.6875	1.179	34	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,2|N<3>}	H(C[6]C[6]2)	123.5320	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	H(C[6]C[6]2)	120.2297	1.441	15	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.4853	0.084	3	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.1305	0.199	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|O<3>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.2550	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|V<5>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3910	0.023	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|V<5>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	122.3715	2.757	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|V<5>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	H(C[6]C[6]2)	120.1570	0.059	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|V<6>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5263	0.145	3	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|V<6>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6880	1.174	14	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|V<6>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,1|V<6>}	H(C[6]C[6]2)	120.1220	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|V<6>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.1940	0.180	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|V<6>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	H(C[6]C[6]2)	120.4215	0.139	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|V<7>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5810	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|V<7>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5777	0.286	6	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|W<5>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	H(C[6]C[6]2)	119.6885	0.204	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|W<6>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	H(C[6]C[6]2)	119.7905	0.045	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|W<9>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	H(C[6]C[6]2)	119.9078	0.225	4	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<2>,1|O<1>}	H(C[6]C[6]2)	120.6540	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<2>,2|C<3>}	H(C[6]C[6]2)	121.5413	3.980	4	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<2>,1|C<3>,1|N<3>}	H(C[6]C[6]2)	120.0370	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<2>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3935	0.428	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.4580	0.345	10	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2560	1.084	81	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|P<4>}	H(C[6]C[6]2)	120.3170	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1626	0.859	140	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.4270	0.335	3	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	119.7530	1.051	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,1|P<4>}	H(C[6]C[6]2)	119.7840	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,1|S<1>}	H(C[6]C[6]2)	120.2700	0.132	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,2|N<3>}	H(C[6]C[6]2)	120.4020	0.544	52	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Ir<6>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.6110	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<2>}	H(C[6]C[6]2)	120.4588	0.148	4	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.7702	0.838	12	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	H(C[6]C[6]2)	120.5625	1.012	87	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Os<6>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.5970	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Os<7>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.5630	0.072	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Os<8>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	121.2260	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Ce<12>,1|C<4>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.3800	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Ce<13>,1|C<4>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.1820	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ca<10>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2900	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ca<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4762	0.145	5	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ca<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9558	0.191	6	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ca<9>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.6487	0.123	3	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cd<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.2245	0.090	4	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cd<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.3290	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cd<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2330	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cd<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4844	0.172	11	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cd<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	121.4640	0.150	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cd<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1407	0.477	12	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cd<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	122.0858	2.117	6	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cd<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.6851	0.228	14	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cd<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5681	1.060	21	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cd<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.9805	0.036	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cd<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3155	0.254	30	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cd<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.6528	0.122	14	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cd<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6690	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cd<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.6480	1.642	3	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cd<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3080	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|As<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	119.7395	0.155	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<2>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4685	0.060	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.4432	1.322	23	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6488	2.316	10	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9699	0.358	16	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,2|N<3>}	H(C[6]C[6]2)	120.0400	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.3614	0.408	61	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	H(C[6]C[6]2)	120.1874	0.348	22	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Si<4>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	119.7895	0.234	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|As<4>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.0090	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	122.3083	1.840	3	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2924	0.439	11	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3803	0.306	50	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,2|N<3>}	H(C[6]C[6]2)	122.9640	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.6309	0.414	78	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	H(C[6]C[6]2)	120.3890	0.443	30	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Br<1>,1|C<3>,1|N<3>}	H(C[6]C[6]2)	120.3910	0.120	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<2>,1|C<3>,1|N<3>}	H(C[6]C[6]2)	120.5627	0.068	3	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.2723	0.526	26	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5495	0.724	105	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4979	0.594	273	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,2|N<3>}	H(C[6]C[6]2)	121.4903	1.204	9	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Cl<1>,1|C<3>,1|N<3>}	H(C[6]C[6]2)	120.6560	0.832	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.8460	0.730	154	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	H(C[6]C[6]2)	120.6818	0.858	132	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4519	0.578	11	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,2|N<3>}	H(C[6]C[6]2)	120.6740	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.5061	0.618	11	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	H(C[6]C[6]2)	120.9800	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8730	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6180	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cr<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.2523	0.418	4	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cr<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.6305	0.005	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cr<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	H(C[6]C[6]2)	119.2720	0.000	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cr<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	H(C[6]C[6]2)	120.2280	0.075	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cr<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.9873	3.018	4	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cr<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7770	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cr<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	H(C[6]C[6]2)	120.3062	0.515	9	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cr<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.9330	0.124	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cr<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6056	0.899	28	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cr<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3633	0.577	41	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cr<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	121.1668	0.848	16	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cr<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	H(C[6]C[6]2)	120.2745	0.419	6	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cr<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5500	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cr<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1275	0.016	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cr<9>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5020	1.667	3	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<2>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0150	0.071	3	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<2>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	H(C[6]C[6]2)	120.0817	0.281	4	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<3>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3110	0.538	4	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<3>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1480	0.382	17	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<3>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,1|P<4>}	H(C[6]C[6]2)	119.9519	0.217	10	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<3>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.3525	0.548	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<3>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	H(C[6]C[6]2)	120.5814	0.312	18	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.2554	0.597	71	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4099	0.593	58	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3144	0.559	137	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	121.3171	2.028	7	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,1|P<4>}	H(C[6]C[6]2)	119.8223	0.072	3	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.8152	0.322	39	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	H(C[6]C[6]2)	120.8023	1.233	114	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<2>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.1290	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.5870	0.503	44	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4154	1.471	63	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.8675	0.214	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|F<1>,1|N<3>}	H(C[6]C[6]2)	120.8700	0.008	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5138	0.866	335	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.2406	2.237	5	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.6652	0.238	5	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,2|N<3>}	H(C[6]C[6]2)	121.3195	1.341	13	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.9819	0.392	47	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	H(C[6]C[6]2)	120.4813	0.967	83	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Si<5>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	119.8295	0.158	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.6349	0.378	10	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8210	0.450	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2591	0.910	21	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.7548	0.515	56	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	H(C[6]C[6]2)	120.8070	1.594	19	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Dy<15>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(H){1|N<4>,2|C<4>}	H(C[6]C[6]2)	119.7015	0.074	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Er<12>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.5203	0.287	4	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Eu<10>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7200	0.182	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Eu<12>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	121.0020	0.382	4	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Eu<13>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6445	0.558	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Eu<9>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0660	0.211	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Eu<9>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Eu<9>,1|C<4>,2|N<3>}	H(C[6]C[6]2)	120.4270	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.1623	0.352	15	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8692	0.565	6	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4321	0.836	9	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.4425	0.018	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.7093	1.522	21	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	H(C[6]C[6]2)	120.2043	0.155	8	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Si<4>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	119.9465	0.204	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Br<1>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.6320	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.4272	0.555	17	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3935	0.623	17	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.6190	1.174	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	H(C[6]C[6]2)	120.0770	0.127	4	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|F<1>,1|N<3>}	H(C[6]C[6]2)	120.5090	0.117	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4350	0.659	41	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.2004	0.560	5	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,2|N<3>}	H(C[6]C[6]2)	120.8975	0.207	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Cl<1>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.7580	0.570	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.6103	0.828	137	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	H(C[6]C[6]2)	120.4932	0.753	25	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Br<1>,1|C<3>,1|N<3>}	H(C[6]C[6]2)	120.1800	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Br<1>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	121.0910	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<2>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.4407	0.353	4	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.2879	0.868	147	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6499	0.824	176	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.7460	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|F<1>,1|N<3>}	H(C[6]C[6]2)	120.3882	0.236	6	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4371	0.474	842	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.6248	0.217	6	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,2|N<3>}	H(C[6]C[6]2)	120.6945	0.169	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<5>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3963	0.220	6	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Cl<1>,1|C<3>,1|N<3>}	H(C[6]C[6]2)	119.8960	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Cl<1>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.4783	0.259	4	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.9594	0.703	121	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	H(C[6]C[6]2)	120.5112	0.779	195	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.7644	0.166	5	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3192	0.120	4	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3927	0.268	13	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	121.1039	0.886	33	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	H(C[6]C[6]2)	120.6645	0.241	11	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<7>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Fe<7>,1|C<4>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.2700	0.144	3	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.1920	0.030	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8863	0.148	3	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<5>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.0152	0.084	4	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.0995	2.880	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	H(C[6]C[6]2)	120.3185	0.265	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ga<3>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.9230	0.546	7	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ga<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7900	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ga<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2780	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ge<2>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.5175	0.028	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.3990	0.458	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Hf<10>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Hf<10>,1|C<4>,2|N<3>}	H(C[6]C[6]2)	120.1800	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Hg<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.4640	0.477	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Hg<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3570	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Hg<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7390	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Hg<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3850	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Hg<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.4874	0.531	16	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Hg<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	H(C[6]C[6]2)	120.3685	0.770	4	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Hg<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	H(C[6]C[6]2)	120.5355	0.145	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|In<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3005	0.391	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.0629	0.665	14	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8005	0.132	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.2353	0.848	12	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	H(C[6]C[6]2)	119.9746	0.303	8	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	119.9895	0.749	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.0120	0.081	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	H(C[6]C[6]2)	120.0732	0.487	26	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<2>,1|C<3>,1|N<3>}	H(C[6]C[6]2)	119.5200	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4899	0.500	37	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	H(C[6]C[6]2)	120.6357	0.237	3	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1255	0.446	55	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	H(C[6]C[6]2)	120.0544	0.605	64	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1640	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1803	0.211	3	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	121.6090	0.601	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	H(C[6]C[6]2)	120.0505	0.527	4	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4675	0.551	28	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9768	0.433	29	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	119.9134	0.210	5	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.2495	0.357	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Li<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Al<4>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.3814	0.112	12	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Li<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.3555	0.124	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Li<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	H(C[6]C[6]2)	119.4835	0.202	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Li<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0259	0.346	9	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Li<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,1|P<4>}	H(C[6]C[6]2)	120.2000	0.297	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Li<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,2|N<3>}	H(C[6]C[6]2)	121.0370	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Li<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2705	0.616	4	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Li<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,1|N<4>}	H(C[6]C[6]2)	120.6520	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mg<4>,1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<4>,2|C<3>}	H(C[6]C[6]2)	120.0210	0.236	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mg<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.1610	0.065	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mg<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.4022	0.322	6	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mg<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	H(C[6]C[6]2)	120.5333	0.324	3	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mg<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9490	0.041	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mg<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6700	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mg<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.6131	0.338	10	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mg<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1263	0.358	7	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mg<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	121.0835	0.023	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mg<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	H(C[6]C[6]2)	120.6305	0.219	4	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9368	0.155	4	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.1372	0.691	6	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4094	0.188	5	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5149	0.242	13	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.6231	0.310	12	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	H(C[6]C[6]2)	120.6960	0.076	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.6707	0.936	15	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7320	0.875	97	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	121.0710	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	H(C[6]C[6]2)	120.9630	0.030	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5716	0.767	236	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	122.4100	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.9585	0.114	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,2|N<3>}	H(C[6]C[6]2)	125.2770	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.7245	0.440	57	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	H(C[6]C[6]2)	120.7797	1.574	70	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3815	0.200	4	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3698	0.268	36	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.8431	0.430	47	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	H(C[6]C[6]2)	121.4441	2.311	26	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0090	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1495	0.053	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mo<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.0810	0.287	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mo<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.8370	0.288	6	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mo<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	H(C[6]C[6]2)	119.8116	0.314	5	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mo<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7380	1.782	7	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mo<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5474	0.429	21	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mo<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,1|P<3>}	H(C[6]C[6]2)	119.3460	0.575	3	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mo<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,1|P<4>}	H(C[6]C[6]2)	119.8800	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mo<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.8669	0.255	11	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mo<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	H(C[6]C[6]2)	120.1392	0.363	33	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mo<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Si<4>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	119.5927	0.117	3	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mo<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6540	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mo<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5070	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mo<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,1|P<4>}	H(C[6]C[6]2)	119.5720	0.318	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mo<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.1028	0.504	10	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mo<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4360	0.216	6	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mo<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5290	2.125	16	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mo<8>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Mo<8>,1|C<3>,2|N<3>}	H(C[6]C[6]2)	126.5635	4.836	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mo<9>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.7565	0.090	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mo<9>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	H(C[6]C[6]2)	120.0253	0.115	6	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Nd<12>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Nd<12>,1|C<4>,2|N<3>}	H(C[6]C[6]2)	120.9040	0.203	3	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Nd<15>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(H){1|N<4>,2|C<4>}	H(C[6]C[6]2)	119.5510	0.161	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Nd<16>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.5605	0.040	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|As<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	119.8695	0.465	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.3752	0.649	13	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1649	1.261	29	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1699	0.299	32	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.6229	0.373	57	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	H(C[6]C[6]2)	120.2074	0.331	45	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ni<4>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	119.8365	0.037	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.5071	0.636	17	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4180	0.270	8	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.8960	0.229	4	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6875	1.950	37	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	121.0050	0.818	3	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.7830	0.242	23	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	H(C[6]C[6]2)	120.9277	1.356	10	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Br<1>,1|C<3>,1|N<3>}	H(C[6]C[6]2)	120.3430	0.271	8	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.9124	1.021	45	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6412	0.570	170	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.5168	0.288	4	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	H(C[6]C[6]2)	121.1797	0.412	6	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4700	1.114	310	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.3920	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	120.2547	0.310	3	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,2|N<3>}	H(C[6]C[6]2)	120.8774	0.126	12	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.8510	0.468	157	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	H(C[6]C[6]2)	120.5982	0.800	157	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ni<6>,1|C<4>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	119.3240	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	121.0410	1.133	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4042	1.142	16	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	H(C[6]C[6]2)	120.4250	0.401	7	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Os<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.0840	1.355	7	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Os<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,1|N<5>}	H(C[6]C[6]2)	118.3050	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Os<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8675	0.127	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Os<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0720	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Os<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8177	0.485	3	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Os<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3081	0.287	7	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Os<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	H(C[6]C[6]2)	120.4941	0.549	16	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Os<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.6000	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Os<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8070	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Os<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Os<7>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.2420	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Os<7>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Os<7>,1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	119.9210	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Os<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8607	0.351	3	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Os<9>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Br<1>,1|C<3>,1|N<3>}	H(C[6]C[6]2)	120.6500	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Os<9>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6774	0.433	5	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Os<9>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3555	0.803	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pb<3>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.5235	0.029	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pb<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1080	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<2>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3646	0.148	5	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.7050	0.957	44	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4296	0.897	72	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2407	0.542	150	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	119.8805	0.496	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	119.9925	0.606	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,2|N<3>}	H(C[6]C[6]2)	120.1696	1.067	5	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<2>}	H(C[6]C[6]2)	120.1979	0.261	10	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.6878	0.880	68	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	H(C[6]C[6]2)	120.2556	0.354	130	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6655	0.047	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.7703	1.779	3	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	H(C[6]C[6]2)	120.2823	0.507	4	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1457	0.380	8	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	H(C[6]C[6]2)	120.4465	0.263	25	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1005	0.558	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6260	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<2>,1|C<3>,1|N<3>}	H(C[6]C[6]2)	119.5620	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<2>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3967	0.602	6	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	119.9852	0.449	16	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2127	0.643	59	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1184	1.130	68	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.5523	1.105	28	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	H(C[6]C[6]2)	120.2358	0.467	25	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pt<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<2>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.5940	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pt<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1720	0.426	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pt<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2005	0.510	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pt<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<2>,1|C<3>,1|N<3>}	H(C[6]C[6]2)	119.7610	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pt<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	119.2250	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pt<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7925	2.379	12	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pt<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5558	0.493	16	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Re<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.2518	0.616	4	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Re<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5980	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Re<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	H(C[6]C[6]2)	120.8083	0.445	10	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<2>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.4410	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	119.9679	0.219	9	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4329	0.719	45	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3926	0.549	90	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.1746	0.486	10	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	H(C[6]C[6]2)	120.3239	0.533	24	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Re<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5215	0.112	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Re<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<5>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8555	0.080	4	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Re<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	H(C[6]C[6]2)	120.0000	1.560	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Re<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0010	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Rh<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	121.5607	3.688	4	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Rh<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.4920	0.589	4	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Rh<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.3388	1.458	6	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Rh<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	H(C[6]C[6]2)	120.2765	0.240	30	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Rh<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.9183	1.420	7	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Rh<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	H(C[6]C[6]2)	120.1429	0.186	27	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Rh<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4101	0.178	8	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Rh<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.9245	2.541	20	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Rh<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	H(C[6]C[6]2)	120.2765	0.320	12	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Rh<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8620	0.000	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Rh<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2673	0.087	3	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Rh<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	H(C[6]C[6]2)	120.0736	0.258	7	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Rh<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9876	0.621	17	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Rh<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0298	0.358	14	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<10>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<5>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.2100	0.755	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Br<1>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	119.7935	0.083	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.1125	0.286	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,1|N<5>}	H(C[6]C[6]2)	119.6195	0.011	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.1035	0.865	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1229	0.754	7	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	H(C[6]C[6]2)	119.2960	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0818	0.376	17	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.1750	0.191	5	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,1|N<5>}	H(C[6]C[6]2)	120.2530	0.000	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.4170	0.011	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.9179	0.179	8	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	H(C[6]C[6]2)	120.0925	0.340	13	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.1952	0.516	20	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3778	0.725	13	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	H(C[6]C[6]2)	119.5875	0.203	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|C<5>,1|N<3>}	H(C[6]C[6]2)	120.2335	0.469	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0463	0.577	93	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	119.5470	0.164	4	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.2352	0.592	4	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,2|N<3>}	H(C[6]C[6]2)	120.3005	0.244	6	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.5140	0.784	32	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	H(C[6]C[6]2)	120.2873	0.540	90	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.6820	0.242	4	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5310	0.802	4	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	119.8497	0.221	6	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	H(C[6]C[6]2)	120.0658	0.243	10	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<7>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ru<7>,1|C<4>,2|N<3>}	H(C[6]C[6]2)	119.6970	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.3707	0.484	3	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8485	0.859	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	119.6225	0.210	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<9>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<2>,1|C<3>,1|N<3>}	H(C[6]C[6]2)	120.3460	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<9>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4226	0.254	27	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<9>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5171	1.298	22	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<9>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	119.7670	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Sb<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4970	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Sb<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.7410	0.038	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Se<1>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.8890	0.544	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Sm<10>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.5270	0.526	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Sm<12>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	121.3930	7.534	4	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Sm<9>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3680	0.242	3	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Sm<9>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Sm<9>,1|C<4>,2|N<3>}	H(C[6]C[6]2)	120.5960	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Sn<3>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.8020	0.327	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Sn<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2188	0.322	6	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Sn<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9477	0.559	8	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Sn<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,2|N<3>}	H(C[6]C[6]2)	120.5370	0.055	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Sn<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.3192	0.186	8	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Sn<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	H(C[6]C[6]2)	120.3990	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Sn<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5803	0.283	19	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Sn<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	119.5000	1.450	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Sn<6>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Sn<6>,1|C<4>,2|N<3>}	H(C[6]C[6]2)	120.5080	0.132	4	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Sn<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.7242	0.197	12	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Sr<10>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0855	0.185	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Sr<9>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.6970	0.289	4	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ta<10>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9190	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Tc<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0310	0.089	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Tc<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3252	0.500	4	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Th<19>,1|C<4>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(H){1|Th<19>,1|N<4>,2|C<4>}	H(C[6]C[6]2)	120.0800	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ti<10>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<5>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6210	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ti<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	H(C[6]C[6]2)	120.3075	0.347	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ti<8>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ti<8>,1|C<4>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.3815	0.087	4	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|U<11>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|U<11>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.0900	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Yb<12>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.4280	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Yb<13>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	H(C[6]C[6]2)	120.6212	0.207	6	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Yb<14>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Yb<14>,1|C<4>,1|C<5>,1|N<3>}	H(C[6]C[6]2)	120.0240	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Yb<9>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Yb<9>,1|C<4>,2|N<3>}	H(C[6]C[6]2)	120.2460	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<3>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.2320	0.718	4	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<3>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.4160	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.2362	0.447	25	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3375	0.739	51	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	121.3439	1.076	12	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|P<4>}	H(C[6]C[6]2)	119.4930	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	H(C[6]C[6]2)	119.8763	0.405	3	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2112	0.327	60	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.9670	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,2|N<3>}	H(C[6]C[6]2)	120.8853	0.164	3	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.0024	0.414	5	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	H(C[6]C[6]2)	120.2102	0.220	9	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.7301	0.786	18	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6272	0.512	32	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	H(C[6]C[6]2)	119.4750	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5594	0.739	131	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	121.4712	3.445	4	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,1|P<3>}	H(C[6]C[6]2)	120.6983	0.218	4	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,2|N<3>}	H(C[6]C[6]2)	120.8884	0.335	19	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.6255	0.519	20	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	H(C[6]C[6]2)	120.5966	0.403	9	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.3549	0.524	51	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5688	0.353	66	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5934	0.775	71	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,2|N<3>}	H(C[6]C[6]2)	120.4872	0.233	5	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	121.1727	0.978	40	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	H(C[6]C[6]2)	122.1050	3.170	13	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.5350	0.140	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zr<13>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0670	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zr<13>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Zr<13>,1|C<2>,1|N<3>}	H(C[6]C[6]2)	120.1820	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zr<16>,1|C<4>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(H){1|Zr<16>,1|C<3>,1|N<4>,1|O<2>}	H(C[6]C[6]2)	119.4040	0.102	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zr<9>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Zr<9>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.0870	0.000	1	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){2|Co<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<4>,2|C<3>}	H(C[6]C[6]2)	120.6885	0.076	2	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){2|Ni<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<4>,2|C<3>}	H(C[6]C[6]2)	120.5170	0.334	3	120.4700	0.709	9952	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]Si)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|Si<4>,1|C<3>}	C[6](C[6]C[6]Si)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4860	0.000	1	120.4860	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cd<6>,2|C<3>}	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.0410	0.000	1	120.3251	0.065	15	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<6>,2|C<3>}	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.4727	0.205	3	120.3251	0.065	15	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	119.9840	0.000	1	120.3251	0.065	15	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<6>,2|C<3>}	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.4015	0.490	2	120.3251	0.065	15	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<6>,2|C<3>}	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.2595	0.145	2	120.3251	0.065	15	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,2|C<3>}	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.2542	0.206	4	120.3251	0.065	15	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,2|C<3>}	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.5470	0.182	2	120.3251	0.065	15	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]F)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]F)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|F<1>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.4595	0.173	2	121.6286	0.047	22	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]F)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]F)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|F<1>,1|N<3>,1|P<4>}	H(C[6]C[6]2)	121.6680	0.000	1	121.6286	0.047	22	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]F)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]F)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|F<1>,1|N<3>}	H(C[6]C[6]2)	121.5410	0.096	2	121.6286	0.047	22	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]F)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]F)(H){1|Fe<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|F<1>,1|N<3>}	H(C[6]C[6]2)	122.0500	0.018	2	121.6286	0.047	22	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]F)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]F)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|F<1>,1|N<3>}	H(C[6]C[6]2)	121.5630	0.152	3	121.6286	0.047	22	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]F)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]F)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|F<1>,1|N<3>}	H(C[6]C[6]2)	121.7252	0.137	6	121.6286	0.047	22	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]F)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]F)(H){1|Ir<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|F<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	121.6360	0.023	4	121.6286	0.047	22	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]F)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]F)(H){1|Ru<9>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|F<1>,1|N<3>}	H(C[6]C[6]2)	121.2385	0.083	2	121.6286	0.047	22	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]B[6a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]B[6a]C[6])(C[6]C[6]H)(H){1|N<3>,2|H<1>,3|O<2>}	H(C[6]C[6]2)	120.7633	0.155	3	120.7633	0.024	3	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[4]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[4]C[6])(C[6]C[6]H)(H){1|N<3>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	120.3825	0.241	2	120.3825	0.058	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H){1|C<4>,1|N<3>,1|N<4>,3|H<1>}	H(C[6]C[6]2)	120.7085	0.462	2	120.2152	0.296	22	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|W<6>}	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H){1|C<4>,2|N<3>,3|H<1>}	H(C[6]C[6]2)	120.0440	0.000	1	120.2152	0.296	22	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cd<6>,2|C<3>}	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1345	0.078	2	120.2152	0.296	22	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|C<4>}	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H){1|C<4>,2|N<3>,3|H<1>}	H(C[6]C[6]2)	120.5785	0.064	2	120.2152	0.296	22	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H){1|N<2>,2|H<1>,2|N<3>}	H(C[6]C[6]2)	120.1980	0.000	1	120.2152	0.296	22	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H){1|N<3>,2|H<1>,2|N<2>}	H(C[6]C[6]2)	120.3525	0.235	4	120.2152	0.296	22	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H){2|H<1>,3|N<3>}	H(C[6]C[6]2)	120.3750	0.287	4	120.2152	0.296	22	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<6>,2|C<3>}	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H){1|N<3>,2|H<1>,2|N<2>}	H(C[6]C[6]2)	120.1900	0.000	1	120.2152	0.296	22	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<6>,2|C<3>}	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H){2|H<1>,3|N<3>}	H(C[6]C[6]2)	118.7170	0.171	2	120.2152	0.296	22	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<6>,2|C<3>}	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H){1|N<3>,2|H<1>,2|N<2>}	H(C[6]C[6]2)	120.4660	0.000	1	120.2152	0.296	22	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<8>,2|C<3>}	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H){2|H<1>,3|N<3>}	H(C[6]C[6]2)	120.3250	0.038	2	120.2152	0.296	22	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|N<2>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	122.4360	0.000	1	122.4360	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<6>,2|C<3>}	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H){1|N<2>,2|H<1>,2|N<3>}	H(C[6]C[6]2)	120.3855	0.019	2	120.2642	0.083	24	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<6>,2|C<3>}	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H){1|N<3>,2|H<1>,2|N<2>}	H(C[6]C[6]2)	120.2740	0.023	2	120.2642	0.083	24	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<5>,2|C<3>}	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H){1|N<2>,2|H<1>,2|N<3>}	H(C[6]C[6]2)	120.2640	0.000	1	120.2642	0.083	24	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<6>,2|C<3>}	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H){1|N<2>,1|N<3>,1|O<2>,2|H<1>}	H(C[6]C[6]2)	120.4680	0.000	1	120.2642	0.083	24	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H){1|C<3>,2|H<1>,2|N<3>}	H(C[6]C[6]2)	120.2087	0.220	4	120.2642	0.083	24	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H){1|N<2>,1|N<3>,1|O<2>,2|H<1>}	H(C[6]C[6]2)	120.3730	0.000	1	120.2642	0.083	24	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H){1|N<2>,2|H<1>,2|N<3>}	H(C[6]C[6]2)	120.3603	0.126	3	120.2642	0.083	24	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H){1|N<3>,2|H<1>,2|N<2>}	H(C[6]C[6]2)	120.4850	0.252	3	120.2642	0.083	24	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<6>,2|C<3>}	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H){1|N<2>,1|N<3>,1|O<2>,2|H<1>}	H(C[6]C[6]2)	120.4620	0.000	1	120.2642	0.083	24	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<6>,2|C<3>}	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H){1|N<2>,1|N<3>,1|S<2>,2|H<1>}	H(C[6]C[6]2)	120.3900	0.000	1	120.2642	0.083	24	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<6>,2|C<3>}	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H){1|N<3>,2|H<1>,2|N<2>}	H(C[6]C[6]2)	119.9380	0.000	1	120.2642	0.083	24	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|O<1>,2|C<3>}	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H){1|N<2>,2|H<1>,2|N<3>}	H(C[6]C[6]2)	119.5155	0.206	2	120.2642	0.083	24	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<4>,2|C<3>}	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>,2|N<3>}	H(C[6]C[6]2)	120.3820	0.000	1	120.2642	0.083	24	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<6>,2|C<3>}	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H){1|N<2>,2|H<1>,2|N<3>}	H(C[6]C[6]2)	120.3430	0.000	1	120.2642	0.083	24	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<4>,1|N<3>,1|N<4>,3|H<1>}	H(C[6]C[6]2)	120.1905	0.013	2	120.1905	0.000	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6]2)(C[6]C[6]H)(H){1|Pd<5>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.7480	0.105	2	120.4032	0.209	9	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<6>,2|C<3>}	C[6](C[6]C[6]2)(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3570	0.000	1	120.4032	0.209	9	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]2)(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1982	0.517	5	120.4032	0.209	9	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|C<4>}	C[6](C[6]C[6]2)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>,3|H<1>}	H(C[6]C[6]2)	120.7850	0.000	1	120.4032	0.209	9	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]As)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|As<3>,1|C<3>,1|H<1>}	C[6](C[6]C[6]As)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.5560	0.000	1	120.5560	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]B)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<3>,1|C<3>,1|C<4>}	C[6](C[6]C[6]B)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.4620	0.000	1	120.6580	0.528	16	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]B)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<3>,1|C<3>,1|H<1>}	C[6](C[6]C[6]B)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.5410	0.125	12	120.6580	0.528	16	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]B)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,2|B<4>}	C[6](C[6]C[6]B)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	121.3925	2.541	2	120.6580	0.528	16	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]B)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<6>,1|B<4>,1|C<3>}	C[6](C[6]C[6]B)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.7890	0.000	1	120.6580	0.528	16	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]Br)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Br<1>,1|C<3>,1|C<4>}	C[6](C[6]C[6]Br)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.9493	0.251	15	120.1585	0.325	54	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]Br)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Br<1>,1|C<3>,1|H<1>}	C[6](C[6]C[6]Br)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.6670	0.000	1	120.1585	0.325	54	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]Br)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Br<1>,1|C<3>,1|H<1>}	C[6](C[6]C[6]Br)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.2193	0.489	25	120.1585	0.325	54	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]Br)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Br<1>,1|C<3>,1|O<1>}	C[6](C[6]C[6]Br)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.4115	1.696	4	120.1585	0.325	54	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]Br)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Br<1>,1|Co<6>,1|C<3>}	C[6](C[6]C[6]Br)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.4450	0.000	1	120.1585	0.325	54	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]Br)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Br<1>,1|Cu<4>,1|C<3>}	C[6](C[6]C[6]Br)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.2380	0.000	1	120.1585	0.325	54	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]Br)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Br<1>,1|Cu<5>,1|C<3>}	C[6](C[6]C[6]Br)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.9080	0.000	1	120.1585	0.325	54	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]Br)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Br<1>,1|Ni<6>,1|C<3>}	C[6](C[6]C[6]Br)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.2185	0.196	2	120.1585	0.325	54	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]Br)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Br<1>,1|Pd<4>,1|C<3>}	C[6](C[6]C[6]Br)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.0563	0.485	3	120.1585	0.325	54	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]Br)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Br<1>,1|Pt<6>,1|C<3>}	C[6](C[6]C[6]Br)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.3300	0.000	1	120.1585	0.325	54	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ag<4>,1|C<2>,1|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	122.3260	1.057	4	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ag<4>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.5905	0.585	2	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Al<3>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.2820	0.000	1	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Au<4>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.9705	0.011	2	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<4>,1|C<2>,1|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<2>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6635	0.009	2	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<6>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	123.6000	0.000	1	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<2>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.1434	0.225	8	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|D<1>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.5950	0.000	1	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8920	0.069	2	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8412	0.852	13	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	121.8343	0.813	3	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.8688	0.209	23	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.4301	0.790	73	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|N<2>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.3860	0.000	1	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|O<1>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1760	0.000	1	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|O<1>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.8403	0.276	9	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|O<2>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.7020	0.000	1	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|O<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.0605	0.217	2	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,2|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3430	0.000	1	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,2|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.0201	0.857	20	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.4274	1.212	46	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0300	0.000	1	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cd<4>,1|C<2>,1|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.7160	0.000	1	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cd<4>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.4347	0.278	6	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cd<5>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.2300	0.000	1	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cd<6>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	120.9873	0.143	3	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cd<6>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|S<3>}	H(C[6]C[6]2)	120.7320	0.000	1	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cd<6>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4680	0.000	1	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cd<6>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.6782	0.677	8	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<4>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.9710	0.047	2	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<4>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.2755	0.367	2	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<5>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.6120	0.000	1	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<6>,1|C<2>,1|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	117.7210	0.000	1	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.0150	0.000	1	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<6>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.0846	0.960	5	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<6>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.0537	2.715	35	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<3>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7225	0.149	2	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<3>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.8020	0.129	2	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<3>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	121.0573	0.118	3	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<4>,1|C<2>,1|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.4210	0.301	4	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.9303	1.206	3	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<4>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7080	0.000	1	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<4>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.5162	0.252	4	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<5>,1|C<2>,1|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.5740	0.000	1	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4682	0.291	4	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.4438	0.229	10	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<5>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3825	0.090	2	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<5>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.5008	0.283	13	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<6>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.9640	0.000	1	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<8>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.2940	0.000	1	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<4>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	121.0720	0.000	1	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.7845	0.189	2	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.5835	0.131	4	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<6>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.5655	0.127	2	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<8>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.9250	0.000	1	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	121.0560	0.117	5	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|P<4>}	H(C[6]C[6]2)	120.7095	0.172	2	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|S<1>}	H(C[6]C[6]2)	121.7710	0.000	1	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	121.1270	0.230	3	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|S<4>}	H(C[6]C[6]2)	120.7360	0.000	2	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	121.3024	0.590	17	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.5509	0.873	76	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Se<1>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.1670	0.000	1	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Hg<4>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.6277	0.734	31	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<4>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.7000	0.000	1	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<4>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.4030	0.000	1	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7674	0.346	8	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.8690	0.000	1	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.3450	0.000	1	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<7>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.4630	0.024	2	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5930	0.000	1	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Li<4>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	121.3180	0.000	1	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mg<6>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7200	0.048	2	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<5>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.2250	0.216	2	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<6>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2320	0.000	1	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<6>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	121.0930	0.000	1	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<6>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.5845	0.023	4	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<6>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.9030	0.086	2	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<6>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.3743	0.177	12	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<7>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.0970	0.000	1	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<6>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.7130	0.000	1	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<6>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	120.4210	0.048	2	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<5>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7242	0.046	4	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<6>,1|C<2>,1|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.4364	0.130	5	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.4188	0.263	9	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<6>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.4117	0.164	19	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|O<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.9825	0.095	2	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|O<2>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.6820	0.542	2	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<2>,1|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.2902	0.680	16	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.8777	0.458	3	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.4153	0.673	11	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5480	0.277	4	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.5835	0.504	17	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<4>,1|C<2>,1|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.4007	0.451	7	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.3422	0.279	4	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<4>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.6983	1.513	3	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<4>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.3462	0.344	5	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<6>,1|C<2>,1|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.3589	0.338	7	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<5>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.3539	0.517	10	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<5>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.7935	1.675	2	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<6>,1|C<2>,1|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.2380	0.000	1	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.1830	0.000	1	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6470	0.000	1	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.5770	0.300	4	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<6>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.2523	0.398	12	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<4>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.4370	0.262	2	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<5>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.2430	0.000	1	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<6>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.9370	0.000	1	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<8>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7400	0.209	2	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<8>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	121.1960	0.156	2	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<10>,2|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Ru<10>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3735	0.042	2	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<5>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.5475	4.259	4	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.9860	0.010	2	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.2453	0.857	3	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<6>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.2800	0.047	3	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<9>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.5110	0.000	1	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<9>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.8635	1.141	2	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Si<6>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.0735	0.162	2	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|U<16>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	122.8330	0.000	1	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<4>,1|C<2>,1|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.3610	0.040	2	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<4>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.3414	0.111	8	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<4>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.6454	0.308	5	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<5>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4270	0.218	2	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<5>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.5880	0.000	1	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<5>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.3798	0.108	4	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<6>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	121.1965	0.064	2	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<6>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.7260	0.000	1	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<6>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.9090	0.000	1	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<6>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.3466	0.171	7	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){3|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.1185	0.059	2	120.5112	0.922	740	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cl<1>,1|B<3>,1|C<3>}	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.9670	0.000	1	120.2003	0.204	68	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cl<1>,1|C<3>,1|C<4>}	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.9287	0.417	3	120.2003	0.204	68	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cl<1>,1|C<3>,1|H<1>}	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.1084	0.632	16	120.2003	0.204	68	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cl<1>,1|Co<6>,1|C<3>}	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.2385	0.120	2	120.2003	0.204	68	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cl<1>,1|Cu<4>,1|C<3>}	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.6420	0.252	2	120.2003	0.204	68	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cl<1>,1|Cu<5>,1|C<3>}	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.3028	0.074	4	120.2003	0.204	68	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cl<1>,1|Ni<6>,1|C<3>}	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.2236	0.078	7	120.2003	0.204	68	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cl<1>,1|Pd<4>,1|C<3>}	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.1989	0.481	26	120.2003	0.204	68	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cl<1>,1|Ru<6>,1|C<3>}	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.1400	0.000	1	120.2003	0.204	68	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cl<1>,1|Zn<4>,1|C<3>}	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.3813	0.264	6	120.2003	0.204	68	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]F)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|F<1>}	C[6](C[6]C[6]F)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.9180	0.000	1	120.5777	0.155	12	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]F)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|F<1>}	C[6](C[6]C[6]F)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7555	0.419	2	120.5777	0.155	12	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]F)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<9>,1|C<3>,1|F<1>}	C[6](C[6]C[6]F)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7922	0.288	6	120.5777	0.155	12	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]F)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<4>,1|C<3>,1|F<1>}	C[6](C[6]C[6]F)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.2500	0.101	3	120.5777	0.155	12	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]Fe)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|C<4>}	C[6](C[6]C[6]Fe)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.1800	0.000	1	119.1500	0.002	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]Fe)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|C<4>}	C[6](C[6]C[6]Fe)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.1200	0.000	1	119.1500	0.002	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]I)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|I<1>}	C[6](C[6]C[6]H)(C[6]C[6]I)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.9624	0.316	24	120.1231	0.127	47	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]I)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|I<1>}	C[6](C[6]C[6]H)(C[6]C[6]I)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.2726	0.223	18	120.1231	0.127	47	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]I)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|I<1>}	C[6](C[6]C[6]H)(C[6]C[6]I)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.2150	0.000	1	120.1231	0.127	47	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]I)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|I<1>}	C[6](C[6]C[6]H)(C[6]C[6]I)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.2550	0.000	1	120.1231	0.127	47	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]I)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|I<1>}	C[6](C[6]C[6]H)(C[6]C[6]I)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.3390	0.000	1	120.1231	0.127	47	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]I)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<4>,1|C<3>,1|I<1>}	C[6](C[6]C[6]H)(C[6]C[6]I)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.4865	1.152	2	120.1231	0.127	47	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ag<3>,1|C<3>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.9850	0.000	1	120.1587	0.733	299	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|N<2>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.5690	0.272	3	120.1587	0.733	299	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.8866	0.285	26	120.1587	0.733	299	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|N<1>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.3430	0.705	4	120.1587	0.733	299	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.5970	0.000	1	120.1587	0.733	299	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|Cl<1>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8948	0.260	4	120.1587	0.733	299	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.6212	0.648	35	120.1587	0.733	299	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.9879	0.837	57	120.1587	0.733	299	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|N<4>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.6502	1.046	4	120.1587	0.733	299	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|N<4>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.3330	0.325	4	120.1587	0.733	299	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|N<3>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.5947	0.952	3	120.1587	0.733	299	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|N<3>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.5625	0.098	2	120.1587	0.733	299	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cd<6>,1|C<3>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0920	0.000	1	120.1587	0.733	299	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cd<6>,1|C<3>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.2502	0.459	16	120.1587	0.733	299	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<5>,1|C<3>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.6340	0.000	1	120.1587	0.733	299	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|N<2>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.0210	0.441	2	120.1587	0.733	299	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.3023	0.496	12	120.1587	0.733	299	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<7>,1|C<3>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.2200	0.205	2	120.1587	0.733	299	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.0997	0.056	3	120.1587	0.733	299	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.9280	0.000	1	120.1587	0.733	299	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5090	0.000	1	120.1587	0.733	299	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.1480	0.000	1	120.1587	0.733	299	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Hg<3>,1|C<3>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.9420	0.000	1	120.1587	0.733	299	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Hg<4>,1|C<3>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.0943	0.315	12	120.1587	0.733	299	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.4155	0.029	2	120.1587	0.733	299	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<6>,1|C<3>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4270	0.000	1	120.1587	0.733	299	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<6>,1|C<3>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.3263	0.241	3	120.1587	0.733	299	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<5>,1|C<3>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.5045	1.025	2	120.1587	0.733	299	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6680	0.481	2	120.1587	0.733	299	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.2993	0.881	6	120.1587	0.733	299	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|N<2>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.2900	0.000	1	120.1587	0.733	299	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.7501	0.634	47	120.1587	0.733	299	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	123.3115	4.200	4	120.1587	0.733	299	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|N<2>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.3490	0.000	1	120.1587	0.733	299	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8623	0.127	6	120.1587	0.733	299	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.0710	0.247	4	120.1587	0.733	299	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.9320	0.132	3	120.1587	0.733	299	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<4>,1|C<3>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.1855	0.330	13	120.1587	0.733	299	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<5>,1|C<3>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2500	0.000	1	120.1587	0.733	299	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<5>,1|C<3>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.2557	0.144	3	120.1587	0.733	299	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<6>,1|C<3>,1|N<2>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5590	0.000	1	120.1587	0.733	299	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<6>,1|C<3>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3535	0.043	2	120.1587	0.733	299	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Bi<6>,1|C<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5290	0.066	2	120.1514	0.348	125	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	119.8020	0.274	2	120.1514	0.348	125	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	119.6093	0.700	4	120.1514	0.348	125	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.9553	0.628	11	120.1514	0.348	125	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0407	0.289	3	120.1514	0.348	125	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1400	0.000	1	120.1514	0.348	125	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	119.8320	0.147	2	120.1514	0.348	125	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.1094	0.457	5	120.1514	0.348	125	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.2276	0.707	20	120.1514	0.348	125	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|O<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Br<1>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7290	0.000	1	120.1514	0.348	125	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|O<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9580	0.000	1	120.1514	0.348	125	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|O<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Cl<1>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8440	0.000	1	120.1514	0.348	125	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Br<1>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.3920	0.000	1	120.1514	0.348	125	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,2|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.7350	0.000	1	120.1514	0.348	125	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.1560	0.049	2	120.1514	0.348	125	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.2510	0.007	2	120.1514	0.348	125	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.9980	0.000	1	120.1514	0.348	125	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.2265	0.371	2	120.1514	0.348	125	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7617	0.793	6	120.1514	0.348	125	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.5947	0.491	3	120.1514	0.348	125	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.3120	0.000	1	120.1514	0.348	125	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.9547	0.132	3	120.1514	0.348	125	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|H<1>,1|N<3>,1|O<3>}	H(C[6]C[6]2)	120.0953	0.123	3	120.1514	0.348	125	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<6>,1|C<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.3715	0.030	2	120.1514	0.348	125	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<6>,1|C<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3650	0.000	1	120.1514	0.348	125	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.8985	0.046	2	120.1514	0.348	125	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|O<2>,2|C<3>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	119.9690	0.000	1	120.1514	0.348	125	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|O<2>,2|C<3>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.7910	0.000	1	120.1514	0.348	125	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Os<6>,1|C<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7815	0.400	4	120.1514	0.348	125	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1545	0.522	11	120.1514	0.348	125	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2790	0.000	1	120.1514	0.348	125	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.5230	0.000	1	120.1514	0.348	125	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<6>,1|C<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.9980	0.031	2	120.1514	0.348	125	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9253	0.722	3	120.1514	0.348	125	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<8>,1|C<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|H<1>,1|N<3>,1|O<3>}	H(C[6]C[6]2)	119.9535	0.492	6	120.1514	0.348	125	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4840	0.000	1	120.1514	0.348	125	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<7>,1|C<4>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Ru<7>,1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.4955	0.136	2	120.1514	0.348	125	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<9>,1|C<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3530	0.513	3	120.1514	0.348	125	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sn<6>,1|C<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	122.1330	0.000	1	120.1514	0.348	125	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<4>,1|C<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.6520	0.000	1	120.1514	0.348	125	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<5>,1|C<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.9710	0.000	1	120.1514	0.348	125	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<6>,1|C<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4947	0.858	3	120.1514	0.348	125	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|P<4>}	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6760	0.000	1	120.4730	0.082	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|P<4>}	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.2700	0.000	1	120.4730	0.082	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]S)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	C[6](C[6]C[6]H)(C[6]C[6]S)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3120	0.000	1	120.9641	0.948	17	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]S)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	C[6](C[6]C[6]H)(C[6]C[6]S)(H){1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	121.0102	1.384	6	120.9641	0.948	17	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]S)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|S<4>}	C[6](C[6]C[6]H)(C[6]C[6]S)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.6760	0.000	1	120.9641	0.948	17	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]S)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|S<4>}	C[6](C[6]C[6]H)(C[6]C[6]S)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.5640	0.512	3	120.9641	0.948	17	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]S)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|S<4>}	C[6](C[6]C[6]H)(C[6]C[6]S)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	121.0503	0.958	4	120.9641	0.948	17	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]S)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<4>,1|C<3>,1|S<2>}	C[6](C[6]C[6]H)(C[6]C[6]S)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	121.7235	0.359	2	120.9641	0.948	17	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ca<8>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	121.0325	1.152	2	121.3378	0.558	5	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<6>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	121.1560	0.000	1	121.3378	0.558	5	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Li<4>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	122.1660	0.000	1	121.3378	0.558	5	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mg<6>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	121.3020	0.000	1	121.3378	0.558	5	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5280	0.546	2	121.1717	0.150	75	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ce<17>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ce<17>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.1160	0.320	2	121.1717	0.150	75	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<6>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.3410	0.092	4	121.1717	0.150	75	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,1|N<3>,1|O<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,1|N<3>,1|O<1>}	H(C[6]C[6]2)	120.4330	0.024	2	121.1717	0.150	75	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<6>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	121.3402	0.172	4	121.1717	0.150	75	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|N<2>,2|H<1>}	H(C[6]C[6]2)	120.6043	0.508	6	121.1717	0.150	75	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<6>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	121.3419	0.227	10	121.1717	0.150	75	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	121.0580	0.607	4	121.1717	0.150	75	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<6>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	121.0980	0.000	1	121.1717	0.150	75	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<6>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	121.7080	0.000	1	121.1717	0.150	75	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<4>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	121.1898	0.245	4	121.1717	0.150	75	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|N<2>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.4557	0.178	6	121.1717	0.150	75	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<6>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.3247	0.189	9	121.1717	0.150	75	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<6>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<6>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.2115	0.060	4	121.1717	0.150	75	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.3183	0.413	4	121.1717	0.150	75	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<6>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4430	0.000	1	121.1717	0.150	75	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<6>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<6>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.0732	0.104	6	121.1717	0.150	75	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<6>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.0250	0.000	1	121.1717	0.150	75	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<4>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.3678	0.268	4	121.1717	0.150	75	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ag<3>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.1062	0.183	5	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ag<3>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.6620	0.276	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ag<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8516	0.408	37	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ag<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.9190	0.276	13	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ag<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|P<3>}	H(C[6]C[6]2)	120.5140	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ag<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.9823	0.366	7	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ag<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.7870	0.178	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ag<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5059	0.801	9	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ag<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.6852	0.464	6	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ag<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6780	0.076	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ag<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|P<4>}	H(C[6]C[6]2)	120.7760	0.397	3	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Al<3>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3090	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Al<3>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.4990	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Al<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8520	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Al<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6320	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Al<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.8000	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Al<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.4509	0.296	29	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Al<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Rh<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4040	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Al<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Si<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7760	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Al<4>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	121.6635	0.067	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Al<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7450	0.275	24	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Al<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4690	0.000	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Al<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.9340	0.063	4	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Al<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	121.1955	0.093	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Al<5>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Al<5>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6147	0.029	3	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Al<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5394	0.960	10	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Al<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.9300	0.061	3	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Al<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	121.1285	0.244	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Al<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.3346	0.095	9	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Al<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Sn<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6025	0.524	6	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Al<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Sn<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8395	0.310	4	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|As<2>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4420	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Au<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6534	0.518	25	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Au<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.2815	0.199	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Au<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1435	0.885	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Au<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.9670	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<3>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2060	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<3>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.6770	0.038	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<3>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.2950	0.659	23	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.0240	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6562	0.236	6	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6823	0.057	9	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	120.5811	0.200	8	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.8160	0.205	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.5003	1.112	162	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ru<9>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7710	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<2>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3227	0.205	4	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.1854	1.135	5	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.1992	1.245	4	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.6184	0.964	14	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	121.1695	0.486	4	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ba<12>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.2630	0.083	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ba<13>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.4930	0.133	3	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ba<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.8390	0.232	3	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Be<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.4110	0.112	4	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Bi<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.0565	0.326	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Bi<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.8457	0.269	4	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Bi<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6920	0.135	3	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Bi<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.5300	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Bi<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8760	0.190	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<2>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>}	H(C[6]C[6]2)	126.0780	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<2>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.3940	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Br<1>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2470	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<2>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1877	0.192	8	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8770	2.063	45	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.0000	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4442	0.713	29	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.0950	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Cl<1>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1390	0.360	3	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|F<1>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2675	0.015	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.4424	0.814	11	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.5463	0.128	4	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|P<4>}	H(C[6]C[6]2)	120.3265	0.111	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|P<5>}	H(C[6]C[6]2)	120.4660	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	120.5523	0.150	4	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.5027	0.625	24	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ir<6>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.9850	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.3783	1.332	634	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ru<8>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.0230	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<5>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.5495	0.721	4	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|D<1>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7200	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|D<1>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.3095	0.508	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|F<1>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.9105	0.927	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|I<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.2830	0.279	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|I<2>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.5447	0.551	38	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|I<3>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.7330	0.174	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|I<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.0905	0.030	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	120.0210	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.1435	0.864	50	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7790	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	119.7150	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8573	1.671	22	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3668	0.865	37	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|I<1>,1|N<3>}	H(C[6]C[6]2)	120.0037	0.545	3	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.2330	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	120.3507	0.440	21	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.2514	0.336	14	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.2968	1.219	39	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(H){1|Se<2>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.6050	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0506	0.346	26	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|P<4>}	H(C[6]C[6]2)	120.2530	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<1>}	H(C[6]C[6]2)	120.5280	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	119.3372	4.139	15	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.5911	0.243	8	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.0990	0.627	44	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(H){1|Rh<6>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5100	0.130	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<3>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5020	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.3210	0.419	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|P<4>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.4424	0.380	18	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|U<8>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.4690	0.265	7	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|V<5>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8035	1.717	4	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|V<5>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	123.7105	4.402	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|V<5>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.4774	0.161	10	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|V<6>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6430	0.255	24	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|V<6>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.9735	1.715	14	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|V<6>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.5124	0.209	14	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|V<7>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6505	0.285	4	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|V<7>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5555	0.199	6	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|V<8>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7155	0.335	4	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|W<6>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5196	0.227	11	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|W<6>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|P<3>}	H(C[6]C[6]2)	120.7495	0.033	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|W<6>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.8460	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|W<6>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.6056	0.594	20	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|W<7>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.7410	1.509	6	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|W<8>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6700	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|W<8>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.3902	0.131	6	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|W<9>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.3860	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|W<9>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	121.8695	0.136	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|B<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7262	0.188	5	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Br<1>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8771	0.880	11	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<2>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4960	0.085	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8022	1.104	252	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7381	0.744	145	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<5>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	118.3130	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Cl<1>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3498	0.468	8	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|I<1>,1|N<3>}	H(C[6]C[6]2)	120.7583	0.291	7	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	121.4095	1.602	21	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.8175	0.399	18	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|P<4>}	H(C[6]C[6]2)	120.6599	0.246	7	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<1>}	H(C[6]C[6]2)	121.7000	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	120.7174	0.548	26	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<3>}	H(C[6]C[6]2)	120.7647	0.940	4	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	121.0137	0.907	207	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Ir<6>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.2090	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.4144	1.119	478	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Se<1>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7500	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<4>,1|H<1>,1|W<7>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|W<7>,2|N<3>}	H(C[6]C[6]2)	120.7667	0.737	3	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<4>,1|H<1>,1|W<8>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>,1|W<8>}	H(C[6]C[6]2)	120.4940	0.264	4	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<4>,1|H<1>,1|W<9>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>,1|W<9>}	H(C[6]C[6]2)	120.6995	0.135	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<4>,1|H<1>,1|W<9>}	C[6](C[6]C[6]H)2(H){1|Se<2>,1|H<1>,1|N<3>,1|W<9>}	H(C[6]C[6]2)	119.7830	0.437	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ca<10>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7320	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ca<12>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.6933	0.075	4	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ca<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.6455	0.164	4	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ca<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6750	0.205	4	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ca<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.0273	0.082	6	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ca<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	121.1190	0.479	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cd<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.9860	0.565	3	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cd<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	121.0155	0.016	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cd<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.4704	0.271	11	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cd<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8792	0.680	38	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cd<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7192	0.280	13	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cd<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	121.1645	0.032	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cd<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.6298	0.217	8	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cd<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.0703	0.874	107	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cd<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6994	0.360	35	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cd<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.9000	0.058	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cd<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.6118	0.440	33	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cd<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7897	0.174	6	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cd<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.4340	0.585	3	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cd<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7530	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cd<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	121.0887	0.094	3	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ce<16>,1|C<4>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(H){1|Ce<16>,1|H<1>,1|N<4>,1|O<2>}	H(C[6]C[6]2)	120.1346	0.280	8	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<3>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.3755	0.005	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<2>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5620	0.311	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4809	0.373	28	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5782	0.314	16	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.7575	0.897	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|P<4>}	H(C[6]C[6]2)	120.5215	0.875	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.8591	0.365	22	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.7154	0.494	18	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6137	0.374	33	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6344	0.159	49	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.8196	0.431	133	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.5867	0.381	18	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6492	0.759	699	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6471	0.733	293	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.4783	0.349	3	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.8305	0.763	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|P<4>}	H(C[6]C[6]2)	120.3700	0.180	3	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	120.4580	0.803	3	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.8563	0.380	23	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.5112	0.695	257	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<6>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Co<6>,1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.6420	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6506	0.739	32	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6187	0.192	11	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.5360	0.269	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.9435	0.264	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.7514	0.124	9	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.5124	0.147	5	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<7>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Co<7>,1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.9590	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3533	0.096	6	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2300	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	120.4790	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.8875	0.661	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cr<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6235	0.018	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cr<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4900	0.106	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cr<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	122.5463	2.424	4	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cr<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.7980	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cr<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	121.4970	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cr<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.8204	0.310	22	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cr<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.3893	0.106	6	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cr<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6218	0.947	91	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cr<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8533	0.754	44	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cr<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.4356	0.408	7	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cr<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.7939	0.380	23	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cr<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.4518	0.237	20	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cr<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4730	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cr<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4308	0.231	6	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cr<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.7700	0.079	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cr<8>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Cr<8>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.6087	0.148	6	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cr<9>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.0463	0.760	3	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cr<9>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.1555	0.067	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<2>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5390	0.117	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<3>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.0434	0.789	11	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<3>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5873	0.360	17	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<3>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|P<4>}	H(C[6]C[6]2)	120.5615	0.214	4	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<3>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.9993	0.233	6	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<3>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.4784	0.229	7	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6521	0.521	223	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6988	0.438	140	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	121.2680	0.150	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.9855	0.233	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|P<4>}	H(C[6]C[6]2)	120.5837	0.350	84	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<3>}	H(C[6]C[6]2)	121.1280	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.9660	0.189	32	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.6042	0.971	119	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<5>,1|C<2>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>}	H(C[6]C[6]2)	117.6710	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<2>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5260	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7342	0.954	444	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7157	0.718	353	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	121.1827	1.439	3	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.5545	0.172	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.5718	1.661	41	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.6016	0.631	123	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Si<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4265	0.207	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<5>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Cu<5>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.7640	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Br<2>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7430	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6207	0.574	86	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8592	1.135	26	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.7853	0.101	16	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.5104	0.400	28	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Si<5>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9280	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1740	0.216	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Er<15>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Er<15>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.7997	0.277	3	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Eu<10>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8105	0.676	4	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Eu<11>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7640	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Eu<13>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4945	0.077	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Eu<13>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8290	0.035	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Eu<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.9302	0.666	12	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Eu<9>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6255	0.941	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7735	0.366	11	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4082	0.797	10	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.9920	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.8813	0.107	12	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.4669	0.225	20	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7220	0.597	37	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7950	0.979	43	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Fe<5>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.1020	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|P<4>}	H(C[6]C[6]2)	120.2880	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.9302	0.215	13	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.4114	0.200	59	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|B<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.9057	0.205	16	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6137	1.046	556	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6043	0.451	853	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<5>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1943	0.406	6	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.8430	0.011	3	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|P<3>}	H(C[6]C[6]2)	120.5076	0.069	8	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|P<4>}	H(C[6]C[6]2)	120.2643	0.165	3	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.6608	0.290	93	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.6531	1.012	112	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4570	0.059	4	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6313	0.172	13	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.3522	0.127	4	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<7>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Fe<7>,1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.7450	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.0600	0.397	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7237	1.430	3	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<5>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3722	0.140	4	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	121.8646	1.927	15	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ga<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5120	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ga<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.9080	0.939	24	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ga<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.4960	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ge<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.6125	0.064	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1780	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8800	0.762	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.3090	0.337	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|P<3>}	H(C[6]C[6]2)	121.2525	1.159	4	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<1>}	H(C[6]C[6]2)	120.7170	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	120.5850	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.8190	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.8960	2.256	41	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|Ru<8>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	117.1600	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Hf<10>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Hf<10>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.7990	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Hg<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5110	0.335	7	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Hg<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8370	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Hg<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.6210	0.201	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Hg<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.0619	0.401	9	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Hg<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7910	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|In<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5390	0.322	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|In<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.5321	0.495	7	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|In<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.9960	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|In<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.4670	0.319	17	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<3>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.4910	0.211	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9300	0.699	3	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.7055	0.661	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3575	0.704	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5824	0.547	1013	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4261	0.472	54	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<5>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	115.4750	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<6>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0790	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	121.3520	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.8881	0.456	20	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.3801	0.442	55	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5503	0.537	60	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4283	0.216	3	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<5>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4250	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.7330	0.368	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|P<4>}	H(C[6]C[6]2)	119.8133	0.526	3	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ir<7>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0040	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<7>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ir<7>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4450	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<7>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ir<7>,1|H<1>,1|N<3>,1|N<4>}	H(C[6]C[6]2)	120.7680	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<7>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ir<7>,1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.9760	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<7>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ir<7>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.8770	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|B<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8920	0.182	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5373	0.813	97	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5407	0.420	32	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	119.9800	0.168	5	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|P<4>}	H(C[6]C[6]2)	120.3610	0.034	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	120.6660	0.378	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.5668	0.226	10	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.7092	1.277	8	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<9>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1160	0.611	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<9>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ir<9>,1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	121.0890	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Li<3>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Mg<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6100	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Li<3>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.3743	0.524	8	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Li<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Al<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.0493	0.160	6	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Li<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8825	0.217	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Li<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.9608	0.332	10	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Li<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|P<3>}	H(C[6]C[6]2)	120.7465	0.151	4	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Li<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	121.2930	0.105	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Li<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.7061	0.451	41	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Li<4>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	122.0570	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Li<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8510	0.134	4	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Li<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.9282	0.368	4	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Li<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	123.1960	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Li<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.4355	0.052	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Li<5>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Li<5>,1|H<1>,1|N<3>,1|N<4>}	H(C[6]C[6]2)	122.0455	0.863	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mg<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8597	0.504	3	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mg<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.3430	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mg<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.8305	0.933	17	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mg<4>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,3|H<1>}	H(C[6]C[6]2)	121.5700	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mg<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6822	0.291	4	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mg<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.1540	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mg<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Mg<5>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4560	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mg<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.7683	0.235	6	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mg<5>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,3|H<1>}	H(C[6]C[6]2)	114.3390	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mg<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|B<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.2318	0.168	11	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mg<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8187	0.253	3	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mg<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7083	0.133	7	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mg<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	121.5980	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mg<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.5774	0.292	18	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<3>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.6510	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6743	0.137	3	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.9505	0.157	6	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.6051	0.386	18	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6882	0.724	35	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7035	0.237	13	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.8798	0.217	4	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.5982	0.176	13	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7318	0.636	420	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8857	0.976	238	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.3840	0.450	5	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.9185	0.429	20	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.4979	0.955	79	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.8106	3.452	16	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6503	0.384	40	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	121.6465	0.666	4	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.5259	0.361	23	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<7>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Mn<7>,1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	120.7740	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5640	0.258	8	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4715	0.088	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<9>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.7767	0.412	3	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.2599	0.336	8	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6299	0.629	58	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6600	0.597	20	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.5097	0.249	12	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.9840	0.215	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Mo<6>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0150	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.2306	0.767	44	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3216	0.205	7	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4100	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	120.5885	0.412	4	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Se<2>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5180	0.017	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5694	0.249	11	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1630	1.670	16	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.6090	0.088	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	120.5410	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<3>}	H(C[6]C[6]2)	120.0870	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.4815	0.194	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<9>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.2070	1.329	3	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<9>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.6320	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<9>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	120.7945	0.302	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<9>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<3>}	H(C[6]C[6]2)	120.5540	0.013	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<9>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.9970	0.270	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<9>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.3723	0.130	9	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Nb<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.5155	0.330	4	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Nb<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.5492	0.282	17	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Nb<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.1910	0.376	14	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Nb<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.3190	0.055	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Nd<12>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5573	0.194	3	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<3>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.6320	0.071	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|B<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8665	0.151	4	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6683	1.044	81	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5771	0.354	34	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.8216	0.195	8	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.4281	0.296	104	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6086	0.341	23	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.0057	1.189	39	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	120.6750	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.9175	0.341	33	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.5059	0.245	20	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7445	0.745	633	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7237	0.811	317	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Cl<1>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5240	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.5409	0.524	14	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|N<4>}	H(C[6]C[6]2)	120.5475	0.400	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	120.8240	0.014	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<3>}	H(C[6]C[6]2)	120.6120	0.312	4	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<4>}	H(C[6]C[6]2)	120.3800	0.106	3	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.9673	0.591	15	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.4833	0.349	177	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8355	0.514	10	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.4192	2.563	17	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.3520	0.275	8	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.9450	0.415	4	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Np<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.5315	0.053	4	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Os<10>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Os<10>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8590	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Os<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.0493	1.739	7	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Os<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6265	0.626	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Os<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.1890	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Os<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.7294	0.676	15	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Os<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.7740	0.341	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Os<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4186	0.611	219	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Os<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4909	0.255	7	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Os<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.0840	0.505	10	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Os<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.1720	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Os<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.6553	0.208	3	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Os<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.1689	0.604	9	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Os<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2320	0.220	5	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Os<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6370	0.511	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Os<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.3468	0.227	4	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Os<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3040	0.189	5	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Os<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3730	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Os<8>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Os<8>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2660	0.242	3	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Os<9>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1535	0.435	10	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Os<9>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3385	0.162	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Os<9>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.0985	0.244	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Os<9>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	119.9880	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Os<9>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.5048	0.545	4	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pb<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3430	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<3>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5980	0.113	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<2>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>}	H(C[6]C[6]2)	124.2800	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<2>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4216	0.135	5	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6351	1.054	377	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6001	0.489	169	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Cl<1>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8975	0.258	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.8597	0.415	6	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.8289	0.365	8	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|P<4>}	H(C[6]C[6]2)	120.8550	0.901	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	120.8159	0.187	8	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<3>}	H(C[6]C[6]2)	119.9803	0.454	3	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.6256	0.440	75	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.5104	0.659	409	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Se<2>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8460	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.5928	2.006	6	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6308	0.521	4	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.8310	0.194	7	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.7724	0.358	10	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5076	0.142	10	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6190	0.433	7	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.5544	0.227	5	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5640	0.291	8	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8245	1.479	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4990	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|B<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7735	0.073	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<2>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4532	0.693	6	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4257	0.627	727	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5236	1.094	75	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.5399	0.669	9	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	119.9700	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.6276	0.274	51	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.3829	0.330	113	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Se<2>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.6410	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Si<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6111	0.515	10	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<2>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6400	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6845	0.451	15	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6350	0.632	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.2320	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.9560	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.6455	0.236	8	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|B<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8012	0.220	8	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5633	0.473	106	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6585	0.288	18	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.7320	0.457	5	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.3198	0.476	19	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Si<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7935	0.147	6	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Si<5>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3342	0.181	8	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pu<11>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.2147	0.108	4	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pu<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.1580	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4016	0.443	9	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1110	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.2402	2.101	24	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<2>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4610	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4321	0.813	303	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5572	0.777	91	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.5179	1.131	15	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	121.2240	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<3>}	H(C[6]C[6]2)	120.5700	0.049	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.6202	0.448	41	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.2638	0.616	78	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3695	0.057	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1785	0.047	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<5>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5545	0.335	4	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.5430	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3820	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<8>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Re<8>,1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	120.2690	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1113	1.011	7	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|P<4>}	H(C[6]C[6]2)	120.5810	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	118.9628	3.255	12	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5868	0.412	12	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7820	1.066	7	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.9185	0.158	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.6512	0.271	25	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	122.3510	2.071	8	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5310	0.341	32	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.7349	2.016	19	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.3760	0.383	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.6781	0.387	8	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.2656	1.395	47	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<6>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Rh<6>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.9945	0.012	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2620	0.101	6	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7195	0.159	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5581	0.299	82	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.1414	1.595	14	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.3080	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.3660	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|P<4>}	H(C[6]C[6]2)	120.4370	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	120.5790	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.8130	0.221	4	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.9144	0.988	8	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<9>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7593	0.112	4	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<9>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Rh<9>,1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	120.3795	0.001	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<10>,1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ru<10>,1|H<1>,1|N<4>}	H(C[6]C[6]2)	120.4615	0.036	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<10>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3690	0.078	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<10>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<5>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8735	0.118	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<10>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ru<10>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3050	0.341	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5378	0.310	12	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8023	0.810	23	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.5493	0.808	37	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	121.2296	2.206	34	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|B<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7957	0.208	8	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5162	0.827	934	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4922	0.485	122	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.5175	0.265	13	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	120.3118	0.277	5	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.4952	0.385	23	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.4082	0.929	184	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<6>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ru<6>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	121.3000	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4937	0.426	29	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.1390	1.468	8	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	121.2632	0.420	10	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.1860	0.148	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<7>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ru<7>,1|H<1>,1|N<3>,1|N<4>}	H(C[6]C[6]2)	119.9820	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<7>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ru<7>,1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.4790	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<7>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ru<7>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.4315	0.076	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4434	0.292	29	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4010	0.165	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.5775	0.029	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.9850	0.619	18	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.3754	0.096	12	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<8>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ru<8>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4113	0.200	3	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<9>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|B<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.9265	0.168	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<9>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3615	0.316	79	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<9>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4597	0.357	22	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<9>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.3373	0.489	3	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<9>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.7640	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<9>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|P<4>}	H(C[6]C[6]2)	120.4570	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<9>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.0064	1.665	21	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<9>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	121.1265	1.741	11	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<9>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ru<9>,1|H<1>,1|N<3>,1|N<4>}	H(C[6]C[6]2)	120.1020	0.180	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sb<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.9020	0.782	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sc<13>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Sc<13>,1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	120.6240	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sc<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.1740	0.175	3	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sc<9>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.4595	0.084	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Si<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	120.6300	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Si<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.1882	0.802	4	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Si<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<1>}	H(C[6]C[6]2)	120.4303	0.049	3	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Si<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.4090	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sm<10>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7665	0.831	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sm<12>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.6070	0.186	4	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sm<13>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8500	0.433	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sm<14>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4120	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sm<14>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.4430	0.272	4	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sm<15>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8915	0.842	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sm<9>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5353	0.144	3	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sn<3>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8864	0.530	14	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sn<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7435	0.376	10	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sn<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.0413	0.502	9	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sn<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	120.7059	0.232	9	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sn<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	120.7753	0.236	6	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sn<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5562	0.297	28	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sn<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	120.8333	0.113	3	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sn<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	121.0650	0.472	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sn<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.5330	0.296	6	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sn<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Se<2>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6207	0.214	3	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sn<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6800	0.351	4	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sn<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6710	0.008	4	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sn<9>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.6930	0.173	4	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sr<10>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.9740	0.092	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sr<12>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.2530	0.129	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sr<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.7433	0.224	6	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sr<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.7245	0.151	6	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ta<10>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6540	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ta<10>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.6345	0.811	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ta<10>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ta<10>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4435	0.412	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ta<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.1887	0.791	6	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Tc<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5300	0.093	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Tc<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.2847	0.373	21	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Tc<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.4942	0.532	4	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Te<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.9250	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Te<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4410	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Th<14>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Th<14>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.2320	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ti<10>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<5>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3460	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ti<10>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.4718	0.159	6	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ti<10>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ti<10>,1|C<5>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6150	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ti<11>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8145	0.060	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ti<11>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ti<11>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5025	0.129	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ti<12>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.2971	0.272	11	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ti<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.5440	0.135	9	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ti<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6780	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ti<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.4506	0.273	29	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ti<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.4581	0.121	11	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ti<7>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ti<7>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.9500	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ti<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.4590	0.138	14	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ti<9>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.4605	0.135	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ti<9>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ti<9>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.3825	0.067	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|U<11>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|U<11>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7840	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|U<13>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|U<13>,1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	120.6970	0.313	4	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|V<11>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.4215	0.285	4	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Yb<15>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Yb<15>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.8200	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<3>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	123.0510	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7930	0.672	119	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6358	0.312	65	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	121.0434	0.196	7	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|N<4>}	H(C[6]C[6]2)	121.1700	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|P<3>}	H(C[6]C[6]2)	120.5470	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	120.8160	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	121.0715	0.583	37	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.6701	0.642	74	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<5>,1|C<2>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7480	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7110	0.401	173	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7702	0.809	135	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.7585	0.028	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	120.8470	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	121.1002	0.411	13	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.6257	1.028	116	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8112	0.873	178	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7176	0.603	76	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.8185	0.162	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.8647	0.159	3	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.5419	0.168	26	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zr<10>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.4765	0.170	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zr<13>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5190	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zr<13>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Zr<13>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9380	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zr<14>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Zr<14>,1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6520	0.150	3	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zr<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.4705	0.098	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zr<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4765	0.988	4	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zr<8>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Zr<8>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	121.2785	0.243	2	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zr<9>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.4840	0.086	3	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){2|Ru<9>,1|C<5>,1|H<1>}	C[6](C[6]C[6]H)2(H){3|Ru<9>,1|H<1>,1|N<4>}	H(C[6]C[6]2)	113.3320	0.000	1	120.6062	0.683	19894	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|C<4>}	C[6](C[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3692	0.257	4	120.2398	0.071	9	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4140	0.000	1	120.2398	0.071	9	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|C<4>}	C[6](C[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0667	0.227	4	120.2398	0.071	9	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]N[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|N<3>}	C[6](C[6]C[6]N[5])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8233	0.414	4	119.9590	0.221	5	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]N[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|N<3>}	C[6](C[6]C[6]N[5])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5020	0.000	1	119.9590	0.221	5	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2660	0.145	7	120.2442	0.022	8	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0920	0.000	1	120.2442	0.022	8	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]Ni)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<4>,1|C<3>,1|C<4>}	C[6](C[6]C[6]Ni)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.1490	0.000	1	120.1490	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]Pd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|C<4>}	C[6](C[6]C[6]Pd)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.8720	0.000	1	119.8720	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]Pt)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|O<1>}	C[6](C[6]C[6]Pt)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9819	0.163	11	119.8372	0.181	14	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]Pt)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<6>,1|C<3>,1|O<1>}	C[6](C[6]C[6]Pt)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	118.4860	0.000	1	119.8372	0.181	14	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]Pt)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){2|Pt<4>,1|C<3>}	C[6](C[6]C[6]Pt)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7170	0.028	2	119.8372	0.181	14	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]Si)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,1|Si<4>,1|C<3>}	C[6](C[6]C[6]Si)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.4337	0.244	13	120.4658	0.069	14	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]Si)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Si<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]Si)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.8830	0.000	1	120.4658	0.069	14	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<6>,2|C<3>}	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|C<3>,1|N<2>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.3560	0.000	1	120.3189	0.329	49	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<5>,2|C<3>}	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|C<3>,1|N<2>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.2780	0.000	1	120.3189	0.329	49	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<6>,2|C<3>}	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2535	0.080	2	120.3189	0.329	49	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|C<3>,1|N<2>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.2387	0.102	3	120.3189	0.329	49	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1333	0.192	7	120.3189	0.329	49	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<6>,2|C<3>}	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|C<3>,1|N<2>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.2730	0.000	1	120.3189	0.329	49	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,2|C<3>}	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	120.0170	1.001	3	120.3189	0.329	49	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,2|C<3>}	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3543	1.262	6	120.3189	0.329	49	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<4>,2|C<3>}	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3730	0.375	7	120.3189	0.329	49	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<6>,2|C<3>}	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8295	0.005	2	120.3189	0.329	49	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<6>,2|C<3>}	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|N<3>,2|H<1>,2|N<2>}	H(C[6]C[6]2)	120.6113	0.644	6	120.3189	0.329	49	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<9>,2|C<3>}	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|N<3>,2|H<1>,2|N<2>}	H(C[6]C[6]2)	120.3170	0.398	5	120.3189	0.329	49	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ta<13>,1|C<3>,1|C<4>}	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|Ta<13>,1|H<1>,1|N<3>,1|O<2>,2|C<3>}	H(C[6]C[6]2)	120.4910	0.233	2	120.3189	0.329	49	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ti<9>,1|C<3>,1|C<4>}	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|Ti<9>,1|H<1>,1|N<3>,1|O<2>,2|C<3>}	H(C[6]C[6]2)	120.7360	0.075	2	120.3189	0.329	49	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<6>,2|C<3>}	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4080	0.000	1	120.3189	0.329	49	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]N[5a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<6>,1|C<3>,1|N<3>}	C[6](C[6]N[5a]C[6])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2570	0.269	2	120.2570	0.072	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]N[6a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|N<3>}	C[6](C[6]N[6a]C[6])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1879	0.109	12	120.1879	0.012	12	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]I)(H)	C[6](C[6]C[6]Br)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]I)(H){1|Br<1>,1|C<3>,1|C<4>}	C[6](C[6]C[6]Br)(C[6]C[6]H)(H){1|H<1>,1|I<1>,1|N<3>}	H(C[6]C[6]2)	119.7790	0.000	1	119.7790	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]I)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]I)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|I<1>,1|N<3>}	H(C[6]C[6]2)	119.9593	0.372	3	120.3856	0.370	9	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]I)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]I)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|I<1>,1|N<3>}	H(C[6]C[6]2)	120.5987	0.611	6	120.3856	0.370	9	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|H<1>,2|C<3>}	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<2>,3|N<3>}	H(C[6]C[6]2)	120.8717	1.495	3	120.8717	2.234	3	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]Br)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Br<1>,1|C<3>,1|H<1>}	C[6](C[6]C[6]Br)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	119.5620	0.071	2	120.0470	0.123	25	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]Br)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Br<1>,1|C<3>,1|H<1>}	C[6](C[6]C[6]Br)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.0457	0.231	16	120.0470	0.123	25	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]Br)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Br<1>,1|C<3>,1|H<1>}	C[6](C[6]C[6]Br)(C[6]C[6]H)(H){1|N<3>,2|N<2>}	H(C[6]C[6]2)	119.5700	0.344	2	120.0470	0.123	25	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]Br)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Br<1>,1|Os<9>,1|C<3>}	C[6](C[6]C[6]Br)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.4900	0.101	3	120.0470	0.123	25	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]Br)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Br<1>,1|Re<6>,1|C<3>}	C[6](C[6]C[6]Br)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.7360	0.000	1	120.0470	0.123	25	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]Br)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Br<1>,1|Zn<4>,1|C<3>}	C[6](C[6]C[6]Br)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	119.9740	0.000	1	120.0470	0.123	25	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Al<5>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.5807	0.049	4	120.7157	1.685	74	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<2>,1|C<3>,1|H<1>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	121.7130	2.701	2	120.7157	1.685	74	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.1686	0.538	7	120.7157	1.685	74	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.6333	1.082	40	120.7157	1.685	74	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,2|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	121.0020	0.000	1	120.7157	1.685	74	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,2|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.0100	0.000	1	120.7157	1.685	74	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cu<3>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.4170	0.029	3	120.7157	1.685	74	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Fe<6>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.3465	0.121	6	120.7157	1.685	74	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.0390	0.000	1	120.7157	1.685	74	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Li<4>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	125.1593	0.336	3	120.7157	1.685	74	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Mn<6>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	119.9940	0.199	2	120.7157	1.685	74	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Mn<6>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.2550	0.000	1	120.7157	1.685	74	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Mn<6>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.3660	0.000	1	120.7157	1.685	74	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Re<8>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.3160	0.000	1	120.7157	1.685	74	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Zn<4>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	119.9170	0.000	1	120.7157	1.685	74	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cl<1>,1|C<3>,1|H<1>}	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.6547	1.195	21	120.6379	1.203	25	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cl<1>,1|Fe<6>,1|C<3>}	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.3180	0.095	2	120.6379	1.203	25	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cl<1>,1|Os<9>,1|C<3>}	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.7815	0.262	2	120.6379	1.203	25	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]F)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Os<9>,1|C<3>,1|F<1>}	C[6](C[6]C[6]F)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.5850	0.000	1	120.5850	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(C[6]C[6]I)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,1|C<4>,1|I<1>}	C[6](C[6]C[6]H)(C[6]C[6]I)(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.0370	0.000	1	119.8825	0.018	6	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(C[6]C[6]I)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,1|H<1>,1|I<1>}	C[6](C[6]C[6]H)(C[6]C[6]I)(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	119.8516	0.122	5	119.8825	0.018	6	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){3|N<3>}	H(C[6]C[6]2)	121.0142	1.133	5	120.0294	2.548	11	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	119.2087	1.514	6	120.0294	2.548	11	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(C[6]C[6]S)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,1|H<1>,1|S<4>}	C[6](C[6]C[6]H)(C[6]C[6]S)(H){1|H<1>,1|N<1>,1|N<3>}	H(C[6]C[6]2)	119.1060	0.000	2	119.1060	0.000	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Re<6>,1|C<4>,1|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){2|N<3>}	H(C[6]C[6]2)	120.5390	0.000	1	120.5390	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ag<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.5365	0.586	8	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Al<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	119.6870	0.000	1	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Al<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	119.9820	0.000	1	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Al<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.0420	0.091	4	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Al<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.4710	0.109	2	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Al<5>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Al<5>,1|N<2>,2|N<3>}	H(C[6]C[6]2)	120.9690	0.000	1	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Al<5>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Al<5>,3|N<3>}	H(C[6]C[6]2)	120.3983	0.149	3	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Al<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.6305	0.098	2	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Al<7>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Al<7>,1|N<2>,2|N<3>}	H(C[6]C[6]2)	120.7985	0.115	2	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|B<3>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	119.8985	0.364	2	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	119.8990	0.095	2	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|N<2>}	H(C[6]C[6]2)	120.3145	0.071	2	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|B<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.0585	0.799	4	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	119.4159	0.196	12	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	119.7564	0.262	22	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<2>,2|N<3>}	H(C[6]C[6]2)	120.2968	0.167	4	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|S<2>,2|N<3>}	H(C[6]C[6]2)	120.1700	0.000	1	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){3|N<3>}	H(C[6]C[6]2)	120.2666	0.196	8	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,2|N<3>}	H(C[6]C[6]2)	122.8770	0.000	1	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	119.7290	0.000	1	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	119.9752	0.238	13	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	119.2775	0.252	8	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,1|H<1>,1|W<6>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.5540	0.000	1	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,1|H<1>,1|W<6>}	C[6](C[6]C[6]H)2(H){3|N<3>}	H(C[6]C[6]2)	120.8050	0.137	2	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,1|H<1>,1|W<7>}	C[6](C[6]C[6]H)2(H){3|N<3>}	H(C[6]C[6]2)	121.0038	0.157	6	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Br<1>,2|N<3>}	H(C[6]C[6]2)	120.0882	0.170	5	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	H(C[6]C[6]2)	120.0930	0.000	1	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	119.8540	1.269	3	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,2|N<3>}	H(C[6]C[6]2)	120.4123	0.307	49	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Cl<1>,2|N<3>}	H(C[6]C[6]2)	120.6200	0.000	1	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.6220	1.027	21	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.7730	1.287	205	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|N<2>,2|N<3>}	H(C[6]C[6]2)	121.2892	1.438	21	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|N<2>}	H(C[6]C[6]2)	121.2060	2.862	6	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Pd<4>,2|N<3>}	H(C[6]C[6]2)	120.3410	0.000	1	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){3|N<3>}	H(C[6]C[6]2)	121.3910	1.355	99	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ca<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.6505	0.144	2	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cd<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.2780	0.150	2	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cd<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.3105	0.036	2	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cd<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){3|N<3>}	H(C[6]C[6]2)	120.4460	0.116	2	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cd<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.7290	0.113	2	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cd<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.0643	0.128	3	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Co<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,2|N<3>}	H(C[6]C[6]2)	120.3270	0.000	1	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Co<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	121.5385	1.220	2	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Co<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.1475	0.407	22	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Co<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){3|N<3>}	H(C[6]C[6]2)	120.7687	0.064	3	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Co<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	H(C[6]C[6]2)	122.2157	1.760	3	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Co<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,2|N<3>}	H(C[6]C[6]2)	121.3190	0.000	1	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Co<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.0151	0.611	118	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Co<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){3|N<3>}	H(C[6]C[6]2)	120.7250	0.370	11	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,2|N<3>}	H(C[6]C[6]2)	120.8179	0.461	9	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	121.0593	0.333	3	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.4983	0.397	21	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<4>,2|N<3>}	H(C[6]C[6]2)	121.0935	1.438	2	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){3|N<3>}	H(C[6]C[6]2)	120.7060	0.539	7	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Co<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,2|N<3>}	H(C[6]C[6]2)	120.5860	0.000	1	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Co<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.4665	0.216	2	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Co<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.4537	0.355	10	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Co<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.1900	0.406	2	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cr<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.0073	0.242	21	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cr<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.4110	0.388	8	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cr<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.3709	0.334	23	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cr<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<2>,2|N<3>}	H(C[6]C[6]2)	120.8720	0.078	2	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cr<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|N<2>}	H(C[6]C[6]2)	120.8450	0.057	2	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cr<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){3|N<3>}	H(C[6]C[6]2)	120.6101	0.310	11	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cr<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.0270	0.205	2	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cu<3>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.2604	0.135	5	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	121.4130	0.000	1	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.3216	0.364	33	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){3|N<3>}	H(C[6]C[6]2)	121.0932	0.307	16	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	119.4016	1.796	5	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,2|N<3>}	H(C[6]C[6]2)	121.1031	1.223	14	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	122.0427	1.613	3	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.3969	1.006	41	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){3|N<3>}	H(C[6]C[6]2)	120.8988	0.115	4	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cu<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.3196	0.190	16	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cu<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){3|N<3>}	H(C[6]C[6]2)	121.0875	0.015	2	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Fe<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	119.9945	0.250	2	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Fe<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.5270	0.000	1	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Fe<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.3149	0.306	11	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Fe<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){3|N<3>}	H(C[6]C[6]2)	120.9417	0.303	7	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Fe<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.0230	0.559	5	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Fe<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,2|N<3>}	H(C[6]C[6]2)	120.4040	0.130	3	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Fe<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.2978	0.331	12	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Fe<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){3|N<3>}	H(C[6]C[6]2)	120.8070	0.130	8	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	H(C[6]C[6]2)	120.6898	0.368	18	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,2|N<3>}	H(C[6]C[6]2)	120.7665	0.127	2	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.6065	0.592	2	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.6165	0.357	78	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<2>,2|N<3>}	H(C[6]C[6]2)	120.6725	0.509	6	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|N<2>}	H(C[6]C[6]2)	120.9870	0.115	2	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){3|N<3>}	H(C[6]C[6]2)	120.8047	0.321	42	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Fe<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){3|N<3>}	H(C[6]C[6]2)	120.9637	0.405	6	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.0050	0.000	1	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ir<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){3|N<3>}	H(C[6]C[6]2)	120.1900	0.000	1	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ir<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	119.9220	0.000	1	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ir<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.3667	0.520	15	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ir<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Br<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	119.9880	0.000	1	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ir<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Br<1>,2|N<3>}	H(C[6]C[6]2)	120.7650	0.000	1	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ir<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	119.8172	0.192	5	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ir<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|F<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	119.5825	0.075	4	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ir<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.8504	0.082	5	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ir<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.6350	0.000	1	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Li<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	H(C[6]C[6]2)	120.6840	0.140	2	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Li<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,2|N<3>}	H(C[6]C[6]2)	120.4510	0.000	1	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Li<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.0670	0.054	2	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Li<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	H(C[6]C[6]2)	121.0290	0.000	1	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Li<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.4370	0.000	1	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Li<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<2>,2|N<3>}	H(C[6]C[6]2)	119.9690	0.000	1	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Li<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|N<2>}	H(C[6]C[6]2)	120.2330	0.255	2	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Li<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){3|N<3>}	H(C[6]C[6]2)	120.8215	0.248	4	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Li<5>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Li<5>,3|N<3>}	H(C[6]C[6]2)	121.3840	0.000	1	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Li<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,1|N<4>}	H(C[6]C[6]2)	120.2910	0.000	1	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Mg<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	119.5480	0.000	1	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Mn<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	119.9448	0.050	5	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Mn<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.1510	0.068	2	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	H(C[6]C[6]2)	120.4635	0.156	2	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	124.3570	0.000	1	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,2|N<3>}	H(C[6]C[6]2)	119.9200	0.000	1	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.5668	0.232	5	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.5452	0.394	16	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Mn<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	121.7526	1.159	5	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Mo<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.3232	0.308	11	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Mo<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.4490	0.112	2	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Mo<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){3|N<3>}	H(C[6]C[6]2)	120.8586	0.143	14	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Mo<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){3|N<3>}	H(C[6]C[6]2)	120.7384	0.071	5	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Mo<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.7760	0.017	2	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Mo<9>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.3300	0.257	2	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	119.6293	0.106	3	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	H(C[6]C[6]2)	120.7470	0.000	1	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	119.7891	0.397	10	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<2>,2|N<3>}	H(C[6]C[6]2)	120.7355	0.765	4	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){3|N<3>}	H(C[6]C[6]2)	120.5364	0.402	19	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.9060	0.265	5	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	121.8660	0.980	3	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.1702	0.272	36	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<4>,2|N<3>}	H(C[6]C[6]2)	120.7253	0.073	4	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){3|N<3>}	H(C[6]C[6]2)	120.6622	0.230	10	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<5>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ni<5>,1|N<4>,2|N<3>}	H(C[6]C[6]2)	119.8765	0.534	2	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.3780	0.000	1	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	H(C[6]C[6]2)	120.8818	0.426	14	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	121.4670	0.000	1	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,2|N<3>}	H(C[6]C[6]2)	120.4167	0.165	13	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.9163	1.213	14	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|N<4>}	H(C[6]C[6]2)	118.7785	3.652	2	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.2835	0.531	15	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|N<2>}	H(C[6]C[6]2)	120.0840	0.476	3	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){3|N<3>}	H(C[6]C[6]2)	120.7438	0.374	9	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.1137	0.340	4	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Os<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,1|N<5>}	H(C[6]C[6]2)	119.8970	0.000	1	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Os<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	119.9497	0.543	15	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Os<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	H(C[6]C[6]2)	120.1420	0.038	2	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Os<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.5304	0.354	9	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Os<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.3950	0.200	3	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Os<9>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Cl<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	119.3710	0.000	1	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Os<9>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.3910	0.109	2	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.9540	0.000	1	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	H(C[6]C[6]2)	120.1608	0.206	6	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.5795	0.419	2	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,2|N<3>}	H(C[6]C[6]2)	121.0250	0.547	4	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.2663	0.494	6	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.4486	0.507	51	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){3|N<3>}	H(C[6]C[6]2)	120.8558	0.267	4	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Pd<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.2379	0.957	7	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Pd<5>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Pd<5>,3|N<3>}	H(C[6]C[6]2)	120.6220	0.000	1	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Pd<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.4420	0.000	1	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	H(C[6]C[6]2)	119.9737	0.350	25	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	119.1040	0.578	9	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.2934	0.425	45	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Pt<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.3820	0.000	1	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Pt<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.2510	0.000	1	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Pt<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	119.9784	0.625	5	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Re<6>,1|C<2>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<2>,1|N<3>}	H(C[6]C[6]2)	119.4250	0.000	1	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	H(C[6]C[6]2)	120.6508	0.481	6	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.2881	1.482	15	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.4398	0.348	26	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){3|N<3>}	H(C[6]C[6]2)	120.9150	0.410	2	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Re<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.5640	0.000	1	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Rh<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<2>,2|N<3>}	H(C[6]C[6]2)	120.6335	0.944	2	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Rh<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){3|N<3>}	H(C[6]C[6]2)	120.7417	0.287	6	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Rh<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.2767	0.242	3	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Rh<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	119.9532	0.304	23	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Rh<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.4720	0.303	3	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Rh<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.1200	0.884	6	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Rh<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	H(C[6]C[6]2)	120.6270	0.000	1	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Rh<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	121.2800	0.000	1	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,1|N<5>}	H(C[6]C[6]2)	119.9005	0.540	2	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|N<5>}	H(C[6]C[6]2)	119.7250	0.000	1	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	119.6965	0.109	6	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.1361	0.665	37	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){3|N<3>}	H(C[6]C[6]2)	121.0170	0.260	2	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	H(C[6]C[6]2)	120.1367	0.294	3	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	119.6245	0.430	4	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.1507	2.194	15	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.5116	0.878	7	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<2>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	119.4320	0.000	1	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<2>,2|N<3>}	H(C[6]C[6]2)	120.1360	0.940	4	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){3|N<3>}	H(C[6]C[6]2)	120.8960	0.421	4	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	119.6773	0.446	6	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	119.6914	0.348	9	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|O<2>,2|N<3>}	H(C[6]C[6]2)	120.6490	0.000	1	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<7>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ru<7>,1|C<4>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	119.8085	0.161	2	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<7>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ru<7>,1|N<2>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.5660	0.000	1	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|N<4>}	H(C[6]C[6]2)	120.6320	0.000	1	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	H(C[6]C[6]2)	120.3230	0.000	1	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	119.4040	0.378	2	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.5680	0.126	2	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	119.8027	1.234	14	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<8>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ru<8>,1|C<4>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.2745	0.084	2	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<9>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	H(C[6]C[6]2)	120.5985	0.489	2	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<9>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	119.7580	0.000	1	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<9>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.6637	0.399	3	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<9>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.0216	0.761	13	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<9>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ru<9>,1|C<5>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	119.9430	0.000	1	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Sn<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,2|N<3>}	H(C[6]C[6]2)	120.9250	0.096	2	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Sn<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	121.0315	0.442	2	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Sn<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|N<2>}	H(C[6]C[6]2)	119.7305	0.070	2	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ta<9>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ta<9>,3|N<3>}	H(C[6]C[6]2)	120.4730	0.008	2	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Yb<14>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Yb<14>,1|N<2>,2|N<3>}	H(C[6]C[6]2)	119.6620	0.000	1	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	H(C[6]C[6]2)	120.2550	0.564	3	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	121.1010	0.000	1	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,2|N<3>}	H(C[6]C[6]2)	120.5587	0.280	3	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	119.8474	0.791	7	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|N<4>}	H(C[6]C[6]2)	120.6400	0.000	1	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.3469	0.794	37	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Zn<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	H(C[6]C[6]2)	120.4655	0.131	2	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Zn<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	122.4507	1.257	4	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Zn<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,2|N<3>}	H(C[6]C[6]2)	120.6252	0.446	19	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Zn<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.8550	0.369	2	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Zn<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.6387	0.358	13	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Zn<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|N<2>}	H(C[6]C[6]2)	120.5520	0.000	1	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Zn<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){3|N<3>}	H(C[6]C[6]2)	120.9810	0.021	2	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Zn<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	H(C[6]C[6]2)	120.9205	0.329	2	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Zn<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,2|N<3>}	H(C[6]C[6]2)	120.9480	0.361	2	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Zn<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.2230	0.332	2	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Zn<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.2620	0.188	4	120.4738	0.778	2027	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	120.0710	0.164	2	120.3291	0.508	8	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ir<8>,2|C<3>}	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.3740	0.143	2	120.3291	0.508	8	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<6>,2|C<3>}	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	120.9357	0.160	4	120.3291	0.508	8	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Re<6>,1|C<3>,1|N<2>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){2|C<3>,2|N<3>}	H(C[6]C[6]2)	121.2300	0.000	1	121.2300	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cl<1>,1|H<1>,1|N<2>}	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H){2|N<3>}	H(C[6]C[6]2)	120.5460	0.000	1	120.5460	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H){1|N<3>,1|O<2>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	122.8090	0.000	1	122.8090	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|O<1>}	H(C[6]C[6]2)	119.5910	0.000	1	119.2300	0.261	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){3|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|O<1>}	H(C[6]C[6]2)	118.8690	0.000	1	119.2300	0.261	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|C<3>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,1|N<2>,1|O<2>}	H(C[6]C[6]2)	120.1550	0.000	1	120.1550	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Al<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	121.2690	0.000	1	120.8032	0.719	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	119.9540	0.378	4	120.8032	0.719	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|C<3>,1|H<1>,1|I<3>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.7985	0.083	2	120.8032	0.719	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.0255	0.359	2	120.8032	0.719	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|C<3>,1|H<1>,1|W<6>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|O<2>}	H(C[6]C[6]2)	121.1165	0.138	2	120.8032	0.719	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|C<3>,1|H<1>,1|W<9>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.7700	0.000	1	120.8032	0.719	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<2>,1|O<1>}	H(C[6]C[6]2)	120.3190	0.000	1	120.8032	0.719	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	123.7185	5.445	2	120.8032	0.719	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Cl<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.8440	0.000	1	120.8032	0.719	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.4392	1.302	18	120.8032	0.719	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Ir<6>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	121.3450	0.000	1	120.8032	0.719	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Cd<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	121.2440	0.000	1	120.8032	0.719	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Cd<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.9113	0.074	3	120.8032	0.719	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Cd<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.9650	0.096	2	120.8032	0.719	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Co<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|O<2>}	H(C[6]C[6]2)	121.1158	0.217	4	120.8032	0.719	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	119.7310	0.700	2	120.8032	0.719	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Co<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.3170	0.000	1	120.8032	0.719	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	121.2416	0.312	5	120.8032	0.719	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	121.7623	0.982	7	120.8032	0.719	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	121.0245	0.392	2	120.8032	0.719	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.8865	0.236	6	120.8032	0.719	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.6896	0.271	5	120.8032	0.719	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	121.2645	0.073	2	120.8032	0.719	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Cu<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.9430	0.358	2	120.8032	0.719	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Fe<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.8980	0.713	2	120.8032	0.719	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.9340	0.000	1	120.8032	0.719	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.8597	0.309	6	120.8032	0.719	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|O<2>}	H(C[6]C[6]2)	121.5430	0.285	6	120.8032	0.719	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	118.9960	0.165	3	120.8032	0.719	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Hg<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	121.3870	0.076	2	120.8032	0.719	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Ir<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	119.7405	0.547	2	120.8032	0.719	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Ir<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|O<2>}	H(C[6]C[6]2)	121.0905	0.414	8	120.8032	0.719	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Ir<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.6110	0.501	2	120.8032	0.719	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Ir<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.6372	0.525	9	120.8032	0.719	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Ir<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|O<2>,2|N<3>}	H(C[6]C[6]2)	120.3083	0.056	3	120.8032	0.719	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.7054	0.121	12	120.8032	0.719	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.8785	0.047	2	120.8032	0.719	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Mo<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|O<2>}	H(C[6]C[6]2)	121.2548	0.275	4	120.8032	0.719	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Mo<9>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.6700	0.000	1	120.8032	0.719	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Ni<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	121.3243	0.277	4	120.8032	0.719	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Ni<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|O<2>}	H(C[6]C[6]2)	121.2480	0.130	2	120.8032	0.719	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.4710	0.290	4	120.8032	0.719	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Os<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	121.2440	0.000	1	120.8032	0.719	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.4940	0.407	2	120.8032	0.719	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.0969	0.406	8	120.8032	0.719	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|O<2>}	H(C[6]C[6]2)	121.1552	0.175	4	120.8032	0.719	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.5343	0.419	4	120.8032	0.719	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	121.1790	0.000	1	120.8032	0.719	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|O<2>}	H(C[6]C[6]2)	121.1225	0.283	4	120.8032	0.719	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	119.4240	0.000	1	120.8032	0.719	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|O<2>}	H(C[6]C[6]2)	121.0403	0.143	4	120.8032	0.719	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Rh<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.1650	0.379	4	120.8032	0.719	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Rh<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|O<2>}	H(C[6]C[6]2)	121.0701	0.395	14	120.8032	0.719	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Rh<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,1|O<2>,1|S<3>}	H(C[6]C[6]2)	123.8600	0.000	1	120.8032	0.719	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Rh<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	119.9590	0.000	1	120.8032	0.719	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Ru<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.7875	0.124	2	120.8032	0.719	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.5928	0.326	5	120.8032	0.719	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.1440	0.378	5	120.8032	0.719	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<2>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.5920	0.082	2	120.8032	0.719	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|O<2>}	H(C[6]C[6]2)	121.0954	0.261	7	120.8032	0.719	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Ru<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|O<2>,2|N<3>}	H(C[6]C[6]2)	120.9480	0.000	1	120.8032	0.719	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Ru<9>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.5430	0.007	2	120.8032	0.719	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Ru<9>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.9850	0.023	2	120.8032	0.719	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Sn<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	119.1990	2.647	2	120.8032	0.719	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Zn<3>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	121.1830	0.000	1	120.8032	0.719	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.8640	0.345	14	120.8032	0.719	242	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){2|N<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|N<2>,1|O<2>,2|C<3>}	H(C[6]C[6]2)	121.2960	0.000	1	121.2960	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Cl<1>,1|N<3>}	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H){1|Re<6>,1|N<2>,1|O<2>}	H(C[6]C[6]2)	122.1670	0.000	1	122.1670	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Ag<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|P<3>}	H(C[6]C[6]2)	120.1080	0.000	1	120.4165	0.328	188	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Ag<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|P<4>}	H(C[6]C[6]2)	120.8243	0.491	3	120.4165	0.328	188	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Al<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|P<4>}	H(C[6]C[6]2)	120.5205	0.312	10	120.4165	0.328	188	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|P<4>}	H(C[6]C[6]2)	120.0610	0.042	2	120.4165	0.328	188	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|P<5>}	H(C[6]C[6]2)	119.7920	0.000	1	120.4165	0.328	188	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|P<4>}	H(C[6]C[6]2)	119.5230	0.000	1	120.4165	0.328	188	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|C<3>,1|H<1>,1|W<6>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|P<3>}	H(C[6]C[6]2)	120.1460	0.089	2	120.4165	0.328	188	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|P<4>}	H(C[6]C[6]2)	119.9680	0.000	1	120.4165	0.328	188	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,1|P<4>}	H(C[6]C[6]2)	120.9270	0.000	1	120.4165	0.328	188	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|P<4>}	H(C[6]C[6]2)	119.9664	0.370	7	120.4165	0.328	188	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Co<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|P<4>}	H(C[6]C[6]2)	119.8620	0.066	2	120.4165	0.328	188	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|P<4>}	H(C[6]C[6]2)	120.5507	0.514	3	120.4165	0.328	188	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Cu<3>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,1|P<4>}	H(C[6]C[6]2)	120.5558	0.279	11	120.4165	0.328	188	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Cu<3>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|P<4>}	H(C[6]C[6]2)	120.5913	0.283	3	120.4165	0.328	188	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,1|P<4>}	H(C[6]C[6]2)	120.7277	0.072	3	120.4165	0.328	188	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|F<1>,1|N<3>,1|P<4>}	H(C[6]C[6]2)	119.8500	0.000	1	120.4165	0.328	188	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|P<4>}	H(C[6]C[6]2)	120.5431	0.487	82	120.4165	0.328	188	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Fe<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|P<3>}	H(C[6]C[6]2)	120.3565	0.135	2	120.4165	0.328	188	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Fe<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|P<4>}	H(C[6]C[6]2)	120.4120	0.000	1	120.4165	0.328	188	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Fe<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|P<4>}	H(C[6]C[6]2)	120.4607	0.287	4	120.4165	0.328	188	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|P<3>}	H(C[6]C[6]2)	120.0532	0.170	10	120.4165	0.328	188	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|P<4>}	H(C[6]C[6]2)	120.3995	0.046	2	120.4165	0.328	188	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|P<3>}	H(C[6]C[6]2)	119.1707	0.899	4	120.4165	0.328	188	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|P<4>}	H(C[6]C[6]2)	119.5510	0.000	1	120.4165	0.328	188	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Ir<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|P<4>}	H(C[6]C[6]2)	120.5367	0.375	3	120.4165	0.328	188	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Ir<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|P<4>}	H(C[6]C[6]2)	119.9815	0.104	2	120.4165	0.328	188	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Li<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,1|P<4>}	H(C[6]C[6]2)	120.5615	0.179	2	120.4165	0.328	188	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Li<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|P<3>}	H(C[6]C[6]2)	120.6580	0.221	4	120.4165	0.328	188	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Mo<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,1|P<3>}	H(C[6]C[6]2)	121.7540	0.974	3	120.4165	0.328	188	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Mo<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,1|P<4>}	H(C[6]C[6]2)	121.3140	0.000	1	120.4165	0.328	188	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Mo<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,1|P<4>}	H(C[6]C[6]2)	120.7505	0.916	2	120.4165	0.328	188	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|P<4>}	H(C[6]C[6]2)	120.1555	0.028	2	120.4165	0.328	188	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|P<3>}	H(C[6]C[6]2)	118.9350	0.000	1	120.4165	0.328	188	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Rh<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|P<4>}	H(C[6]C[6]2)	120.1550	0.000	1	120.4165	0.328	188	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Rh<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|P<4>}	H(C[6]C[6]2)	119.8550	0.000	1	120.4165	0.328	188	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Ru<9>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|P<4>}	H(C[6]C[6]2)	120.4070	0.000	1	120.4165	0.328	188	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Zn<3>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|P<4>}	H(C[6]C[6]2)	118.0400	0.000	1	120.4165	0.328	188	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|P<4>}	H(C[6]C[6]2)	121.5480	0.000	1	120.4165	0.328	188	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|P<3>}	H(C[6]C[6]2)	120.1470	0.000	1	120.4165	0.328	188	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Zn<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,1|P<3>}	H(C[6]C[6]2)	120.2385	0.131	4	120.4165	0.328	188	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Pd<5>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|S<4>}	H(C[6]C[6]2)	120.7515	0.052	2	120.7515	0.003	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Cl<1>,1|Ni<6>,1|C<3>}	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	119.9930	0.197	5	119.9930	0.039	5	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|B<4>,1|C<4>,1|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|N<3>,1|S<2>}	H(C[6]C[6]2)	120.7778	0.203	9	120.6555	0.109	11	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|C<4>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|N<3>,1|S<2>}	H(C[6]C[6]2)	120.1055	0.125	2	120.6555	0.109	11	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	119.8156	0.266	7	120.2113	3.538	191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	119.1115	0.273	4	120.2113	3.538	191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|S<2>,2|N<3>}	H(C[6]C[6]2)	120.3220	0.000	1	120.2113	3.538	191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	120.6860	0.000	1	120.2113	3.538	191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	119.5280	0.000	1	120.2113	3.538	191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	120.2369	0.583	21	120.2113	3.538	191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<1>}	H(C[6]C[6]2)	119.1030	0.000	1	120.2113	3.538	191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	119.1722	4.589	15	120.2113	3.538	191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|S<1>}	H(C[6]C[6]2)	120.1043	1.536	3	120.2113	3.538	191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	120.5415	1.125	2	120.2113	3.538	191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,1|S<1>}	H(C[6]C[6]2)	119.6430	0.010	2	120.2113	3.538	191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<1>}	H(C[6]C[6]2)	119.6110	0.000	1	120.2113	3.538	191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	119.9274	0.361	26	120.2113	3.538	191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<3>}	H(C[6]C[6]2)	121.7410	2.351	4	120.2113	3.538	191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	120.7390	0.140	2	120.2113	3.538	191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	120.5753	0.177	3	120.2113	3.538	191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Co<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	120.3380	0.000	1	120.2113	3.538	191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Cr<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	121.1110	0.000	1	120.2113	3.538	191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<3>}	H(C[6]C[6]2)	119.9280	0.000	1	120.2113	3.538	191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<1>}	H(C[6]C[6]2)	118.8310	0.000	1	120.2113	3.538	191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	119.4570	0.000	1	120.2113	3.538	191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Ir<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	120.1725	0.230	2	120.2113	3.538	191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Mo<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	120.9252	0.107	4	120.2113	3.538	191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Mo<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	120.5270	0.000	1	120.2113	3.538	191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Mo<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<3>}	H(C[6]C[6]2)	120.9770	0.000	1	120.2113	3.538	191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Mo<9>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	121.0160	0.161	2	120.2113	3.538	191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Mo<9>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<3>}	H(C[6]C[6]2)	121.2980	0.156	2	120.2113	3.538	191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Ni<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	120.7170	0.000	1	120.2113	3.538	191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	120.4417	0.268	3	120.2113	3.538	191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	120.4645	0.136	2	120.2113	3.538	191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<3>}	H(C[6]C[6]2)	120.8060	0.504	4	120.2113	3.538	191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<4>}	H(C[6]C[6]2)	121.1103	0.087	3	120.2113	3.538	191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	120.0430	0.512	2	120.2113	3.538	191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	120.0762	0.285	6	120.2113	3.538	191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<3>}	H(C[6]C[6]2)	121.0577	0.304	3	120.2113	3.538	191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<3>}	H(C[6]C[6]2)	120.1085	0.441	2	120.2113	3.538	191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Rh<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,1|O<2>,1|S<3>}	H(C[6]C[6]2)	123.2800	0.000	1	120.2113	3.538	191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Rh<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|S<2>}	H(C[6]C[6]2)	121.0162	2.497	13	120.2113	3.538	191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Rh<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|S<2>}	H(C[6]C[6]2)	118.9383	2.845	6	120.2113	3.538	191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Rh<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	120.3550	0.000	1	120.2113	3.538	191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Rh<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|S<2>}	H(C[6]C[6]2)	120.1343	5.293	6	120.2113	3.538	191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	120.3678	0.236	5	120.2113	3.538	191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Si<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	120.1200	0.000	1	120.2113	3.538	191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Si<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<1>}	H(C[6]C[6]2)	120.6177	0.339	3	120.2113	3.538	191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Sn<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	120.1153	0.265	8	120.2113	3.538	191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Sn<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	120.2928	0.411	5	120.2113	3.538	191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Sn<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	121.0347	0.190	3	120.2113	3.538	191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	119.9620	0.000	1	120.2113	3.538	191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Zn<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	120.5930	0.000	1	120.2113	3.538	191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]U)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]U)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|U<11>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.3100	0.000	1	120.0665	0.119	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]U)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]U)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|U<11>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8230	0.000	1	120.0665	0.119	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]V)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]V)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,1|V<6>}	H(C[6]C[6]2)	120.3130	0.000	1	120.3130	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]O[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]O[6]H)(H){1|C<3>,1|H<1>,1|P<4>}	C[6](C[6]C[6]H)2(H){1|O<3>,2|H<1>}	H(C[6]C[6]2)	119.2770	0.392	2	119.2770	0.153	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]O[6]O)(H)	C[6](C[6]C[6]B)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]O[6]O)(H){1|B<4>,1|C<3>}	C[6](C[6]C[6]B)(C[6]C[6]H)(H){1|C<3>,2|O<2>}	H(C[6]C[6]2)	121.5470	0.161	2	121.4777	0.027	3	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]O[6]O)(H)	C[6](C[6]C[6]B)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]O[6]O)(H){1|B<4>,1|C<3>}	C[6](C[6]C[6]B)(C[6]C[6]H)(H){1|C<4>,2|O<2>}	H(C[6]C[6]2)	121.3390	0.000	1	121.4777	0.027	3	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]O[6]O)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]O[6]O)(H){1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|O<1>,1|O<2>,2|C<4>}	H(C[6]C[6]2)	118.9700	0.000	1	121.6005	13.839	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]O[6]O)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]O[6]O)(H){2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Cr<6>,2|O<2>}	H(C[6]C[6]2)	124.2310	0.000	1	121.6005	13.839	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]P[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]P[6]C)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|O<2>,1|P<3>}	H(C[6]C[6]2)	118.0755	0.190	2	117.5627	0.187	7	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]P[6]C)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]P[6]C)(H){1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|P<4>,2|C<2>}	H(C[6]C[6]2)	117.3576	0.294	5	117.5627	0.187	7	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]P[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]P[6]H)(H){1|Ru<9>,1|O<2>,2|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){2|H<1>,2|P<4>}	H(C[6]C[6]2)	116.8450	0.085	2	116.8450	0.007	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]P[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]P[6]H)(H){1|C<3>,1|H<1>,2|N<3>}	C[6](C[6]C[6]H)2(H){1|P<4>,2|H<1>}	H(C[6]C[6]2)	116.6230	2.929	2	117.7339	1.678	9	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]P[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]P[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|O<2>,1|P<3>}	H(C[6]C[6]2)	118.5530	0.000	1	117.7339	1.678	9	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]P[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]P[6]H)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Cl<1>,1|H<1>,1|P<3>}	H(C[6]C[6]2)	117.8852	0.541	5	117.7339	1.678	9	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]P[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]P[6]H)(H){2|Cu<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|O<2>,1|P<4>}	H(C[6]C[6]2)	118.3800	0.000	1	117.7339	1.678	9	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]P[6]O)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]P[6]O)(H){1|Cu<4>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,1|O<2>,1|P<3>}	H(C[6]C[6]2)	118.1210	0.000	1	118.1210	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]P[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]P[6]O)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|O<2>,1|P<3>}	H(C[6]C[6]2)	118.3935	0.228	2	118.2790	0.066	4	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]P[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]P[6]O)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|O<2>,1|P<3>}	H(C[6]C[6]2)	117.9500	0.000	1	118.2790	0.066	4	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]P[6]O)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]P[6]O)(H){2|Cu<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|O<2>,1|P<4>}	H(C[6]C[6]2)	118.3790	0.000	1	118.2790	0.066	4	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]As[6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|As<3>,2|H<1>}	C[6](C[6]As[6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|W<6>}	H(C[6]C[6]2)	117.9608	0.407	10	117.9608	0.166	10	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]B[5x3,5x5,20x6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ir<8>,1|B<6>,1|C<3>,1|H<1>}	C[6](C[6]B[5x3,5x5,20x6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|C<6>,1|H<1>,4|B<6>}	H(C[6]C[6]2)	119.6940	0.000	1	119.6940	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]B[6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|B<3>,1|C<3>,1|H<1>}	C[6](C[6]B[6]C[6])(C[6]C[6]H)(H){1|B<3>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.1550	1.748	2	119.1550	3.055	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]B[6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|B<3>,1|C<3>,1|H<1>}	C[6](C[6]B[6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	118.8755	1.797	2	119.0488	0.609	14	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]B[6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|B<3>,2|H<1>}	C[6](C[6]B[6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<3>}	H(C[6]C[6]2)	119.4420	1.024	4	119.0488	0.609	14	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]B[6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|B<3>,2|H<1>}	C[6](C[6]B[6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<4>}	H(C[6]C[6]2)	118.7215	0.361	4	119.0488	0.609	14	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]B[6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Pt<6>,1|B<4>,1|H<1>}	C[6](C[6]B[6]H)(C[6]C[6]H)(H){1|Pt<6>,1|C<3>,1|H<1>,1|P<4>}	H(C[6]C[6]2)	119.2320	0.000	1	119.0488	0.609	14	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]B[6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Pt<6>,1|B<4>,2|H<1>}	C[6](C[6]B[6]H)(C[6]C[6]H)(H){1|Pt<6>,1|C<4>,1|H<1>,1|P<4>}	H(C[6]C[6]2)	119.0153	0.027	3	119.0488	0.609	14	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]B[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|B<4>,1|H<1>,1|N<3>}	C[6](C[6]B[6]N[6])(C[6]C[6]H)(H){1|Ir<8>,1|C<3>,1|H<1>,1|O<3>,2|O<2>}	H(C[6]C[6]2)	120.3575	0.078	2	120.3575	0.006	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]B[6]Pt)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Pt<6>,1|B<4>,1|H<1>}	C[6](C[6]B[6]Pt)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<4>}	H(C[6]C[6]2)	119.0260	0.000	1	119.0260	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[3,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,2|H<1>}	C[6](C[6]C[3,6]H)(C[6]C[6]H)(H){1|Nb<6>,1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.3945	0.026	2	120.3945	0.001	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[3]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<2>,1|C<4>,1|H<1>}	C[6](C[6]C[3]C[6])(C[6]C[6]H)(H){1|C<4>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	113.0480	0.000	1	112.7125	0.225	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[3]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>}	C[6](C[6]C[3]C[6])(C[6]C[6]H)(H){1|C<2>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	112.3770	0.000	1	112.7125	0.225	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[3x3,3x5,12x6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<5>,1|H<1>,1|N<3>}	C[6](C[6]C[3x3,3x5,12x6]N[6])(C[6]C[6]H)(H){1|B<5>,1|C<3>,1|C<5>,2|B<6>,2|H<1>}	H(C[6]C[6]2)	115.1110	0.000	1	117.7155	13.567	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[3x3,3x5,12x6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<5>,1|H<1>,1|N<3>}	C[6](C[6]C[3x3,3x5,12x6]N[6])(C[6]C[6]H)(H){1|Ir<7>,1|C<3>,1|C<5>,1|H<1>,3|B<6>}	H(C[6]C[6]2)	120.3200	0.000	1	117.7155	13.567	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[3x3,4,3x5,14x6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<5>,1|H<1>,1|N<3>}	C[6](C[6]C[3x3,4,3x5,14x6]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>,4|B<6>}	H(C[6]C[6]2)	124.5100	0.000	1	124.5100	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[4,4,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,2|H<1>}	C[6](C[6]C[4,4,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.8125	0.671	2	119.8125	0.450	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[4,5]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|O<1>}	C[6](C[6]C[4,5]C[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,2|C<3>,2|O<2>}	H(C[6]C[6]2)	119.4520	0.000	1	119.4520	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[4,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|C<5>,2|H<1>}	C[6](C[6]C[4,6]H)(C[6]C[6]H)(H){1|C<6>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.9620	0.000	1	119.9340	0.002	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[4,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|C<6>,2|H<1>}	C[6](C[6]C[4,6]H)(C[6]C[6]H)(H){1|C<6>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.9060	0.000	1	119.9340	0.002	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[4]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>}	C[6](C[6]C[4]C[6])(C[6]C[6]H)(H){1|C<2>,1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	121.8290	0.000	1	120.7427	0.891	3	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[4]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|C<3>}	C[6](C[6]C[4]C[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<1>,2|C<3>}	H(C[6]C[6]2)	120.1995	0.105	2	120.7427	0.891	3	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[4]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[4]N[6])(C[6]C[6]H)(H){1|C<3>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	119.8880	0.096	3	120.3187	0.246	23	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[4]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[4]N[6])(C[6]C[6]H)(H){1|C<3>,2|H<1>,3|C<4>}	H(C[6]C[6]2)	120.5575	0.636	2	120.3187	0.246	23	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[4]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[4]N[6])(C[6]C[6]H)(H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.0670	0.000	1	120.3187	0.246	23	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[4]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[4]N[6])(C[6]C[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>,3|C<4>}	H(C[6]C[6]2)	120.1743	0.332	12	120.3187	0.246	23	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[4]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[4]N[6])(C[6]C[6]H)(H){1|Ir<4>,1|C<3>,1|C<4>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.8870	0.000	1	120.3187	0.246	23	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[4]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[4]N[6])(C[6]C[6]H)(H){1|Ni<4>,1|C<3>,1|H<1>,3|C<4>}	H(C[6]C[6]2)	121.8260	0.000	1	120.3187	0.246	23	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[4]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[4]N[6])(C[6]C[6]H)(H){1|Os<7>,1|C<3>,1|C<4>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.6410	0.000	1	120.3187	0.246	23	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[4]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[4]N[6])(C[6]C[6]H)(H){1|Os<8>,1|C<4>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5410	0.000	1	120.3187	0.246	23	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[4]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[4]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|C<3>,1|C<4>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.4980	0.000	1	120.3187	0.246	23	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5,6]C[6,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[5,6]C[6,6])(C[6]C[6]H)(H){1|H<1>,1|P<4>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	115.4580	0.000	1	115.4580	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5,6]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[5,6]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,4|C<3>}	H(C[6]C[6]2)	116.7460	0.000	1	116.7460	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	116.8690	0.000	1	118.5069	0.660	14	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<2>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|H<1>,3|C<3>}	H(C[6]C[6]2)	118.6365	0.170	2	118.5069	0.660	14	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|O<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	118.6337	0.242	9	118.5069	0.660	14	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|O<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|H<1>,3|C<3>}	H(C[6]C[6]2)	117.0140	0.000	1	118.5069	0.660	14	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|O<2>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2380	0.000	1	118.5069	0.660	14	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5,6]N)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<2>}	C[6](C[6]C[5,6]N)(C[6]C[6]H)(H){1|H<1>,3|C<3>}	H(C[6]C[6]2)	118.5905	0.182	2	118.5905	0.033	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5,6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[5,6]N[6])(C[6]C[6]H)(H){1|C<3>,1|O<1>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	120.6600	0.000	1	120.6600	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5,6]O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|O<1>}	C[6](C[6]C[5,6]O)(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	118.6506	0.257	9	118.8499	0.456	10	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5,6]O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|O<1>}	C[6](C[6]C[5,6]O)(C[6]C[6]H)(H){1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.6440	0.000	1	118.8499	0.456	10	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<2>,1|C<4>,1|H<1>}	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H){1|C<3>,2|H<1>,2|O<2>}	H(C[6]C[6]2)	123.9540	0.000	1	119.9837	4.352	10	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<2>,1|C<4>,1|H<1>}	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<2>,2|C<3>}	H(C[6]C[6]2)	116.5360	0.000	1	119.9837	4.352	10	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H){2|Li<4>,1|C<3>,1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.5730	0.000	1	119.9837	4.352	10	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,2|H<1>}	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H){1|Rh<8>,2|H<1>,3|C<4>}	H(C[6]C[6]2)	119.9710	0.000	1	119.9837	4.352	10	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|C<3>}	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>,2|N<3>}	H(C[6]C[6]2)	119.9840	2.316	3	119.9837	4.352	10	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|C<4>}	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H){1|C<3>,2|C<4>,4|H<1>}	H(C[6]C[6]2)	119.7290	0.000	1	119.9837	4.352	10	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|O<2>,2|C<3>}	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|O<1>,2|C<3>}	H(C[6]C[6]2)	119.4630	0.000	1	119.9837	4.352	10	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){2|C<3>}	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H){1|C<2>,1|N<2>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.6590	0.000	1	119.9837	4.352	10	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Br<1>,1|C<4>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ru<4>,1|C<3>,1|H<1>,1|O<3>,2|C<4>}	H(C[6]C[6]2)	120.5670	0.000	1	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Br<1>,1|C<4>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ru<5>,1|Ru<7>,1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	120.4140	0.000	1	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Br<1>,1|C<4>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|Ru<7>,1|C<3>,1|C<4>,1|C<5>,1|H<1>}	H(C[6]C[6]2)	120.7410	0.000	1	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Br<1>,1|C<4>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|Ru<8>,1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	120.0850	0.000	1	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Al<4>,1|C<3>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	119.7190	0.000	1	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Al<5>,1|C<3>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.3900	0.000	1	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Co<4>,1|C<3>,1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.0370	0.093	2	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Co<4>,1|C<3>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.2350	0.000	1	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.8000	0.151	2	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	120.2295	0.914	2	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.5180	0.492	3	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.3479	0.202	10	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|H<1>,1|S<3>,2|C<3>}	H(C[6]C[6]2)	119.6980	0.000	1	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	119.9183	0.168	4	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<10>,1|C<3>,1|H<1>,1|W<6>,2|C<4>}	H(C[6]C[6]2)	120.8000	0.000	1	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<10>,1|Cr<6>,1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	120.6000	0.000	1	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<10>,1|Mo<6>,1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	120.4520	0.000	1	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.2401	0.139	9	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<5>,1|C<3>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.2280	0.000	1	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ni<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.1220	0.000	1	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ni<5>,1|C<3>,1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.1813	0.198	4	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ni<5>,1|C<3>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.1630	0.000	1	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ni<5>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.1870	0.191	2	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.3990	0.000	1	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.5070	0.051	3	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,4|C<3>}	H(C[6]C[6]2)	120.3575	0.200	2	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.8170	0.000	1	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Zn<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.1985	0.151	13	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.8820	0.000	1	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ag<4>,1|C<3>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.4660	0.034	2	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ag<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.5227	0.185	10	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>,2|N<3>}	H(C[6]C[6]2)	118.5615	6.291	2	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|C<3>,2|H<1>,2|N<3>}	H(C[6]C[6]2)	120.0920	0.000	1	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<2>,2|C<3>}	H(C[6]C[6]2)	120.4290	0.000	1	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.6795	0.192	2	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.8820	0.000	1	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cd<5>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.3700	0.000	1	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cd<5>,1|C<3>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.0770	0.402	6	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cd<5>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.8125	0.168	2	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cd<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	119.8140	0.000	1	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cd<6>,1|C<3>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.5353	0.622	3	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cd<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.1019	0.170	7	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Co<4>,1|C<3>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.4540	0.000	1	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Co<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.4345	0.252	2	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Co<5>,1|C<3>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.0760	0.000	1	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Co<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.6560	0.666	8	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Co<6>,1|C<3>,1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	120.8327	0.483	6	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Co<6>,1|C<3>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.2249	0.145	23	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Co<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.4104	0.352	10	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Co<8>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.4950	0.000	1	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.3710	0.198	9	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.4515	0.304	13	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.2642	0.354	13	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|H<1>,1|P<4>,2|C<3>}	H(C[6]C[6]2)	120.6372	0.497	13	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|H<1>,1|P<5>,2|C<3>}	H(C[6]C[6]2)	120.1953	0.275	3	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|H<1>,1|S<3>,2|C<3>}	H(C[6]C[6]2)	120.2565	0.080	2	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.3867	0.488	9	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.4710	0.133	2	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.4091	0.389	11	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<5>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.4286	0.371	26	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.3470	0.125	3	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<6>,1|C<3>,1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	120.4140	0.000	1	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<6>,1|C<3>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.0050	0.371	2	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.5843	0.264	3	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<5>,1|C<3>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	119.8145	0.002	2	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.4257	0.084	4	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.3763	0.198	3	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	120.6679	0.181	7	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.2399	0.641	89	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.1678	1.354	26	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|V<6>,2|C<3>}	H(C[6]C[6]2)	120.3630	0.000	1	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|V<7>,2|C<3>}	H(C[6]C[6]2)	120.3570	0.000	1	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Hg<4>,1|C<3>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	119.7840	0.000	1	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Hg<5>,1|C<3>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.5080	0.000	1	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.6035	0.043	2	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	121.1130	1.121	3	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	120.2730	0.000	1	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.1282	0.936	16	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3150	0.000	1	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.3448	0.420	26	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ir<7>,1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.2900	0.122	2	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ir<8>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.2817	0.118	6	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Li<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.3460	0.000	1	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Mn<5>,1|C<3>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	122.2390	0.000	1	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Mn<5>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.2910	0.000	1	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.3426	0.380	11	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	120.7387	0.431	3	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.4679	0.302	12	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Mn<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.3520	0.215	9	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Mn<8>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.3305	0.053	2	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Mn<8>,1|C<3>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.2380	0.000	1	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Mo<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.2868	0.211	5	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Mo<7>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.5240	0.000	1	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Nd<12>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.8070	0.155	3	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.3798	0.107	4	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	120.6713	0.126	3	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.7150	0.122	2	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.5607	0.257	4	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ni<7>,1|C<3>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	121.1190	1.000	4	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ni<7>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.1270	0.000	1	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Os<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.0080	0.000	1	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.6678	0.289	5	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.4586	0.289	13	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,1|P<4>,2|C<3>}	H(C[6]C[6]2)	120.1000	0.000	1	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.6570	0.000	1	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.4907	0.448	4	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.2727	0.303	7	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|Se<2>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.2640	0.203	3	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Pt<6>,1|C<3>,1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.8707	0.538	3	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Pt<6>,1|C<3>,1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	120.7240	0.000	1	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Re<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.4040	0.194	2	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Re<6>,1|C<3>,1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.5490	0.122	2	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Re<6>,1|C<3>,1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	120.5233	0.393	4	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Re<6>,1|C<3>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	121.0950	1.459	8	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Re<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.4782	0.275	12	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Re<6>,1|H<1>,1|P<4>,2|C<3>}	H(C[6]C[6]2)	120.7840	0.240	2	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Rh<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.0810	2.406	2	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ru<5>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.9360	0.000	1	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.4020	0.000	1	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.2985	0.030	2	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.4116	0.362	22	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.2595	0.223	4	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ru<8>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.4550	0.000	1	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ru<9>,1|C<3>,1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.0620	0.000	1	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ru<9>,1|C<3>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.5782	0.295	5	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ru<9>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.2685	0.281	10	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Zn<4>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.2337	0.303	3	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Zn<4>,1|C<3>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.1212	0.409	5	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Zn<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.1617	0.086	10	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Zn<4>,1|H<1>,1|S<2>,2|C<3>}	H(C[6]C[6]2)	120.2530	0.000	1	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Zn<5>,1|C<3>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	119.7770	0.413	5	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Zn<5>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.0900	0.000	1	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Zn<6>,1|C<2>,1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9560	0.000	1	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Zn<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.3535	0.254	2	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Zn<6>,1|C<3>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.1675	0.009	2	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Zn<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.2873	0.055	3	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|O<2>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cd<5>,1|C<3>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	119.7340	0.000	1	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|O<2>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ir<8>,1|C<3>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.4820	0.000	1	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|O<2>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.3460	0.000	1	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|O<2>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Zn<4>,1|C<3>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	119.8175	0.654	2	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<5>,1|C<2>,1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	123.2730	0.000	1	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Co<5>,1|C<3>,1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	119.5800	0.000	1	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cr<6>,1|C<3>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	119.3215	0.243	2	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.0337	0.905	7	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.5070	0.000	1	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.2340	0.000	1	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	119.8850	0.000	1	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	118.5440	0.000	1	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|C<3>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	119.7620	0.000	1	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cd<5>,1|C<3>,1|N<3>,1|N<4>,2|H<1>}	H(C[6]C[6]2)	120.4630	0.000	1	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cd<6>,1|C<3>,1|C<4>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.9570	0.000	1	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cd<6>,1|C<3>,1|C<4>,1|N<4>,2|H<1>}	H(C[6]C[6]2)	119.9740	0.000	1	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cd<6>,1|C<3>,1|N<3>,1|N<4>,2|H<1>}	H(C[6]C[6]2)	121.4560	0.000	1	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cd<6>,1|C<3>,1|N<4>,1|O<2>,2|H<1>}	H(C[6]C[6]2)	120.5960	0.000	1	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Co<6>,1|H<1>,1|N<3>,1|O<2>,2|C<3>}	H(C[6]C[6]2)	120.2151	0.231	16	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<5>,1|C<3>,1|N<3>,1|N<4>,2|H<1>}	H(C[6]C[6]2)	120.0795	0.241	2	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<10>,1|Cd<4>,1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	120.1950	0.190	2	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<10>,1|Pd<4>,1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	120.6900	0.061	2	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<10>,1|Pt<4>,1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	120.1605	0.050	2	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<10>,1|Ru<6>,1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	120.3160	0.079	2	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<10>,1|Zn<4>,1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	120.4633	0.206	3	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|C<3>,1|C<4>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.8840	0.000	1	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|C<3>,1|N<3>,1|N<4>,2|H<1>}	H(C[6]C[6]2)	120.6100	0.000	1	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|C<3>,1|N<4>,1|O<2>,2|H<1>}	H(C[6]C[6]2)	120.3985	0.160	4	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|H<1>,1|N<3>,1|O<2>,2|C<3>}	H(C[6]C[6]2)	120.4796	0.242	5	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ir<8>,1|H<1>,1|O<2>,3|C<3>}	H(C[6]C[6]2)	120.3860	0.000	1	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Mn<6>,1|C<3>,1|N<3>,1|N<4>,2|H<1>}	H(C[6]C[6]2)	120.5310	0.086	2	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|C<3>,1|C<4>,1|N<4>,2|H<1>}	H(C[6]C[6]2)	120.1315	0.169	2	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|C<3>,1|N<4>,1|O<2>,2|H<1>}	H(C[6]C[6]2)	120.0130	0.000	1	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|H<1>,1|N<3>,1|O<2>,2|C<3>}	H(C[6]C[6]2)	120.2290	0.134	4	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|C<3>,1|N<3>,1|S<3>,2|H<1>}	H(C[6]C[6]2)	120.8850	0.000	1	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|C<3>,1|N<4>,1|O<2>,2|H<1>}	H(C[6]C[6]2)	120.1760	0.389	4	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,4|C<3>}	H(C[6]C[6]2)	120.7850	0.000	1	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|P<4>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6635	0.008	2	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|Re<8>,1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	120.1570	0.308	2	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.1280	1.250	2	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|Re<8>,1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	120.5515	0.022	2	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Pt<6>,1|H<1>,1|N<3>,1|O<2>,2|C<3>}	H(C[6]C[6]2)	120.3255	0.401	2	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ru<10>,1|Pt<4>,1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	120.8310	0.000	1	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ru<5>,1|C<3>,1|H<1>,1|O<3>,2|C<4>}	H(C[6]C[6]2)	120.0660	0.000	1	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ru<5>,1|Ru<7>,1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	120.5455	0.299	4	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|H<1>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	120.8980	0.000	1	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|Ru<7>,1|C<3>,1|C<4>,1|C<5>,1|H<1>}	H(C[6]C[6]2)	120.3625	0.348	10	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|Ru<7>,1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	120.6860	0.000	1	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Zn<5>,1|C<3>,1|N<3>,1|N<4>,2|H<1>}	H(C[6]C[6]2)	120.2240	0.000	1	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Zn<5>,1|C<3>,1|N<4>,1|O<2>,2|H<1>}	H(C[6]C[6]2)	120.8210	0.718	2	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){2|Ru<7>,1|C<3>,1|C<4>,1|C<5>,1|H<1>}	H(C[6]C[6]2)	119.8438	1.280	4	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ag<5>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.0035	0.030	2	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ag<6>,1|C<3>,1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.5498	0.322	4	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>,2|N<3>}	H(C[6]C[6]2)	120.0360	0.000	1	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cd<5>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.1020	0.000	1	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cd<6>,1|C<3>,1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	119.6320	0.253	2	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cd<6>,1|C<3>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	119.6755	0.046	4	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Co<5>,1|C<3>,1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.1243	0.221	3	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Co<5>,1|C<3>,1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	119.7340	0.151	5	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Co<5>,1|C<3>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	119.8128	0.226	9	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Co<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	119.5790	0.115	3	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Co<6>,1|C<3>,1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.0565	0.107	4	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Co<6>,1|C<3>,1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	119.7305	0.035	2	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Co<6>,1|C<3>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	119.6722	0.332	5	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cr<6>,1|C<3>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	119.4393	0.336	4	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.5176	0.307	16	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	120.3023	0.228	7	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	119.4180	0.031	2	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	119.5410	0.000	1	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Eu<13>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.8120	0.210	4	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<4>,1|H<1>,1|N<2>,2|C<3>}	H(C[6]C[6]2)	120.0870	0.000	1	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<5>,1|C<3>,1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.5907	1.295	6	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<5>,1|C<3>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.0360	0.375	2	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<5>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.1291	0.419	11	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	119.9462	0.383	88	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	119.9080	0.287	4	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	119.7633	0.219	7	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.8273	0.438	105	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	119.2572	0.337	6	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.7045	0.169	2	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ir<7>,1|C<3>,1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	118.7130	0.000	1	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ir<9>,1|C<3>,1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.1345	0.025	2	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Mn<5>,1|C<3>,1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	119.6700	0.000	1	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Mn<5>,1|C<3>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	119.9455	0.046	2	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	119.6366	0.590	8	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ni<4>,1|C<3>,1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	119.7500	0.144	4	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ni<5>,1|C<3>,1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	119.4310	0.560	2	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ni<5>,1|C<3>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	119.7767	0.038	3	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	119.3860	0.544	2	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	119.4762	2.058	18	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Os<6>,1|C<3>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	119.7950	0.944	6	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	119.5593	0.680	11	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.6850	0.000	1	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.5800	0.000	1	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	119.5083	0.199	4	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.4990	0.389	26	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Re<6>,1|C<3>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.5325	0.103	2	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Re<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.4550	0.000	1	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Rh<6>,1|C<3>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.4895	0.029	2	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Rh<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.5460	0.000	1	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.6046	0.212	8	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Sm<13>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.4410	0.222	4	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Sn<4>,1|C<3>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	119.9465	0.006	2	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Yb<12>,1|H<1>,1|S<3>,2|C<3>}	H(C[6]C[6]2)	120.6790	0.000	1	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Zn<5>,1|C<3>,1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	119.7455	0.046	2	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Zn<5>,1|C<3>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	119.9561	0.317	9	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Zn<5>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.0995	0.258	6	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Zn<6>,1|C<3>,1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	119.4145	0.303	2	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Zn<6>,1|C<3>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	119.6074	0.069	10	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<6>,1|C<3>,1|N<4>,1|O<2>,2|H<1>}	H(C[6]C[6]2)	120.2835	0.043	2	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|C<3>,2|H<1>,2|N<4>}	H(C[6]C[6]2)	119.6520	0.000	1	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|C<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.3850	0.000	1	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Re<6>,1|C<3>,1|O<2>,1|O<3>,2|H<1>}	H(C[6]C[6]2)	120.1300	0.000	1	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Re<6>,1|C<3>,2|H<1>,2|O<2>}	H(C[6]C[6]2)	119.6080	0.000	1	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|H<1>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	120.3870	0.000	1	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ru<8>,1|C<3>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.4280	0.000	1	120.1579	0.431	1263	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<2>,1|C<3>,1|H<1>}	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<2>,2|C<3>}	H(C[6]C[6]2)	116.8420	0.000	1	120.6362	11.401	9	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<2>,1|C<3>,1|H<1>}	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H){1|H<1>,1|O<2>,2|C<3>}	H(C[6]C[6]2)	119.7900	0.000	1	120.6362	11.401	9	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H){1|Cu<4>,1|N<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7850	0.000	1	120.6362	11.401	9	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H){1|N<3>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	121.1540	0.000	2	120.6362	11.401	9	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|O<2>,2|C<3>}	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>,2|C<3>}	H(C[6]C[6]2)	119.7690	0.000	1	120.6362	11.401	9	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){2|C<3>}	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.8530	0.000	1	120.6362	11.401	9	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){2|C<3>}	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H){1|C<2>,1|N<2>,1|O<2>,2|H<1>}	H(C[6]C[6]2)	128.7120	0.000	1	120.6362	11.401	9	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){2|C<3>}	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H){1|C<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	117.6670	0.000	1	120.6362	11.401	9	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Al<4>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.3270	0.035	2	120.1082	0.746	373	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Al<5>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.3820	0.000	1	120.1082	0.746	373	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.6890	0.000	1	120.1082	0.746	373	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Cu<6>,1|C<3>,1|H<1>,1|N<2>,1|O<2>}	H(C[6]C[6]2)	122.3510	0.000	1	120.1082	0.746	373	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.3680	0.231	2	120.1082	0.746	373	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,1|S<2>,2|C<3>}	H(C[6]C[6]2)	120.3699	0.225	8	120.1082	0.746	373	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Zn<6>,1|C<3>,1|H<1>,1|N<2>,1|O<2>}	H(C[6]C[6]2)	123.2120	0.000	1	120.1082	0.746	373	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Ag<3>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.4650	0.000	1	120.1082	0.746	373	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Au<4>,1|H<1>,1|S<2>,2|C<3>}	H(C[6]C[6]2)	119.5160	0.000	1	120.1082	0.746	373	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|B<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.8935	0.105	2	120.1082	0.746	373	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.4147	0.139	4	120.1082	0.746	373	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>,1|N<3>,1|O<1>}	H(C[6]C[6]2)	120.4370	0.000	1	120.1082	0.746	373	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.8510	0.000	1	120.1082	0.746	373	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|C<3>,1|N<2>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.0319	0.373	7	120.1082	0.746	373	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|C<3>,1|N<2>,1|S<2>,2|H<1>}	H(C[6]C[6]2)	120.0130	0.000	1	120.1082	0.746	373	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|C<3>,2|H<1>,2|N<2>}	H(C[6]C[6]2)	119.6420	0.250	4	120.1082	0.746	373	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<2>,2|C<3>}	H(C[6]C[6]2)	120.3310	0.000	1	120.1082	0.746	373	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Co<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.8205	1.285	2	120.1082	0.746	373	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Co<5>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.2040	0.000	1	120.1082	0.746	373	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Co<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.3428	0.193	12	120.1082	0.746	373	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Cu<3>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.5550	0.000	1	120.1082	0.746	373	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Cu<3>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.2330	0.048	2	120.1082	0.746	373	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.4039	0.116	8	120.1082	0.746	373	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.2040	0.303	4	120.1082	0.746	373	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|H<1>,1|O<2>,2|C<3>}	H(C[6]C[6]2)	120.4390	0.000	1	120.1082	0.746	373	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Cu<5>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.0031	0.702	8	120.1082	0.746	373	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Cu<5>,1|H<1>,1|N<4>,2|C<3>}	H(C[6]C[6]2)	120.5350	0.130	2	120.1082	0.746	373	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Cu<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	119.7710	0.000	1	120.1082	0.746	373	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Fe<5>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.0685	0.033	2	120.1082	0.746	373	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.6448	0.372	9	120.1082	0.746	373	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>,2|C<3>}	H(C[6]C[6]2)	120.5123	0.290	3	120.1082	0.746	373	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Ir<5>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.9550	0.000	1	120.1082	0.746	373	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.3708	0.268	23	120.1082	0.746	373	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.3877	0.235	15	120.1082	0.746	373	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|H<1>,1|S<2>,2|C<3>}	H(C[6]C[6]2)	120.2976	0.352	17	120.1082	0.746	373	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Ir<7>,1|H<1>,1|S<2>,2|C<3>}	H(C[6]C[6]2)	120.4160	0.352	2	120.1082	0.746	373	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.1805	0.162	4	120.1082	0.746	373	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Mn<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.2870	0.000	1	120.1082	0.746	373	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|N<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8093	0.209	6	120.1082	0.746	373	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7650	0.000	1	120.1082	0.746	373	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Ni<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.1503	0.194	3	120.1082	0.746	373	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Ni<5>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.0953	0.027	3	120.1082	0.746	373	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.0340	0.000	1	120.1082	0.746	373	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.2467	0.242	4	120.1082	0.746	373	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Os<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.5268	0.361	5	120.1082	0.746	373	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Os<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.5297	0.097	3	120.1082	0.746	373	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Os<7>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.7095	0.233	4	120.1082	0.746	373	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.4690	0.082	2	120.1082	0.746	373	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.1180	0.179	21	120.1082	0.746	373	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,1|S<2>,2|C<3>}	H(C[6]C[6]2)	119.5134	1.518	7	120.1082	0.746	373	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.9453	0.478	3	120.1082	0.746	373	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Pd<5>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.9105	0.153	2	120.1082	0.746	373	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.1075	0.339	12	120.1082	0.746	373	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,1|S<2>,2|C<3>}	H(C[6]C[6]2)	120.2326	0.396	13	120.1082	0.746	373	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.6215	0.261	4	120.1082	0.746	373	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Pt<5>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.9310	0.634	5	120.1082	0.746	373	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Re<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.4650	0.000	1	120.1082	0.746	373	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Re<6>,1|H<1>,1|S<2>,2|C<3>}	H(C[6]C[6]2)	120.4570	0.000	1	120.1082	0.746	373	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Rh<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.8150	0.000	1	120.1082	0.746	373	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.4450	0.143	2	120.1082	0.746	373	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.4070	0.000	1	120.1082	0.746	373	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Ru<8>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.2578	0.348	12	120.1082	0.746	373	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Sn<3>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.8192	0.334	13	120.1082	0.746	373	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Sn<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.0650	0.177	3	120.1082	0.746	373	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Zn<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.1462	0.224	4	120.1082	0.746	373	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Zn<5>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.2286	0.179	5	120.1082	0.746	373	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Zn<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.5285	0.045	2	120.1082	0.746	373	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<2>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|C<2>,1|H<1>,1|N<2>,1|S<2>}	H(C[6]C[6]2)	107.5660	0.000	1	120.1082	0.746	373	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	119.0460	0.275	4	120.1082	0.746	373	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Os<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.1870	0.192	2	120.1082	0.746	373	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	119.1712	0.333	5	120.1082	0.746	373	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Al<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.1450	0.000	1	120.1082	0.746	373	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Co<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.1535	0.043	2	120.1082	0.746	373	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Co<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.1190	0.000	1	120.1082	0.746	373	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.4125	0.418	2	120.1082	0.746	373	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|H<1>,1|O<2>,2|C<3>}	H(C[6]C[6]2)	119.0480	0.000	1	120.1082	0.746	373	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	119.5900	0.000	1	120.1082	0.746	373	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Fe<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.3073	0.030	3	120.1082	0.746	373	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Fe<5>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	119.7940	0.017	2	120.1082	0.746	373	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Fe<5>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.5370	0.000	1	120.1082	0.746	373	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	119.7380	0.000	1	120.1082	0.746	373	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.0480	0.000	1	120.1082	0.746	373	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Fe<8>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.2352	0.187	12	120.1082	0.746	373	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.2433	0.297	3	120.1082	0.746	373	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Ni<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.1920	0.229	3	120.1082	0.746	373	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Os<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.6260	0.155	4	120.1082	0.746	373	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Os<7>,1|H<1>,1|N<2>,2|C<3>}	H(C[6]C[6]2)	119.9510	0.000	1	120.1082	0.746	373	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	118.9160	0.064	2	120.1082	0.746	373	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Pt<3>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	119.1885	0.095	2	120.1082	0.746	373	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	119.3044	0.049	5	120.1082	0.746	373	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.0146	0.782	8	120.1082	0.746	373	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Re<6>,1|H<1>,1|N<2>,2|C<3>}	H(C[6]C[6]2)	120.5430	0.000	1	120.1082	0.746	373	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Zn<5>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	119.4510	0.000	1	120.1082	0.746	373	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Zn<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	119.9180	0.000	1	120.1082	0.746	373	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5x3,5x5,20x6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<6>,1|H<1>,1|N<3>}	C[6](C[6]C[5x3,5x5,20x6]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|C<3>,1|C<6>,1|H<1>,4|B<6>}	H(C[6]C[6]2)	121.2910	0.000	1	121.2910	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|H<1>,1|P<4>,2|C<3>}	H(C[6]C[6]2)	124.1380	0.000	1	124.1380	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<2>,1|C<3>,1|H<1>}	C[6](C[6]C[6]2)(C[6]C[6]H)(H){1|Se<2>,1|C<2>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	124.6380	0.000	1	119.5732	10.465	29	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<2>,1|C<4>,1|H<1>}	C[6](C[6]C[6]2)(C[6]C[6]H)(H){1|H<1>,4|C<3>}	H(C[6]C[6]2)	107.3820	0.000	1	119.5732	10.465	29	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]2)(C[6]C[6]H)(H){1|Li<4>,1|C<4>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7670	0.000	1	119.5732	10.465	29	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]2)(C[6]C[6]H)(H){1|Pr<17>,1|C<4>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.8000	0.000	1	119.5732	10.465	29	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>}	C[6](C[6]C[6]2)(C[6]C[6]H)(H){1|C<2>,1|C<4>,1|N<3>,1|O<2>,2|H<1>}	H(C[6]C[6]2)	119.5010	0.000	1	119.5732	10.465	29	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>}	C[6](C[6]C[6]2)(C[6]C[6]H)(H){1|C<2>,1|C<4>,1|N<3>,3|H<1>}	H(C[6]C[6]2)	112.1300	0.000	1	119.5732	10.465	29	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>}	C[6](C[6]C[6]2)(C[6]C[6]H)(H){1|Rh<6>,1|C<2>,1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	116.9380	0.000	1	119.5732	10.465	29	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,2|C<4>}	C[6](C[6]C[6]2)(C[6]C[6]H)(H){1|Pr<17>,1|C<3>,1|H<1>,1|O<2>,2|C<4>}	H(C[6]C[6]2)	120.1770	0.000	1	119.5732	10.465	29	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,2|C<4>}	C[6](C[6]C[6]2)(C[6]C[6]H)(H){1|Pr<17>,1|C<4>,1|H<1>,1|O<2>,2|C<3>}	H(C[6]C[6]2)	119.1970	0.000	1	119.5732	10.465	29	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,2|C<4>}	C[6](C[6]C[6]2)(C[6]C[6]H)(H){1|Th<12>,1|C<3>,1|H<1>,1|O<2>,2|C<4>}	H(C[6]C[6]2)	119.6150	0.000	1	119.5732	10.465	29	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,2|C<3>}	C[6](C[6]C[6]2)(C[6]C[6]H)(H){1|Li<3>,1|Li<4>,1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3230	0.000	1	119.5732	10.465	29	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,2|C<3>}	C[6](C[6]C[6]2)(C[6]C[6]H)(H){1|Pr<17>,1|C<4>,1|H<1>,1|O<2>,2|C<3>}	H(C[6]C[6]2)	119.9760	0.000	1	119.5732	10.465	29	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,2|C<3>}	C[6](C[6]C[6]2)(C[6]C[6]H)(H){1|Ti<10>,1|C<4>,1|H<1>,1|O<2>,2|C<3>}	H(C[6]C[6]2)	120.2987	0.211	6	119.5732	10.465	29	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Fe<6>,1|C<4>,2|C<3>}	C[6](C[6]C[6]2)(C[6]C[6]H)(H){1|Fe<5>,1|Fe<6>,1|C<3>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	118.8470	1.377	3	119.5732	10.465	29	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|O<2>,2|C<4>}	C[6](C[6]C[6]2)(C[6]C[6]H)(H){1|C<4>,1|O<2>,1|S<2>,1|S<3>,3|H<1>}	H(C[6]C[6]2)	120.4560	0.000	1	119.5732	10.465	29	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]2)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>,2|N<3>}	H(C[6]C[6]2)	121.1630	0.000	1	119.5732	10.465	29	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|C<4>}	C[6](C[6]C[6]2)(C[6]C[6]H)(H){1|Li<5>,1|Ni<7>,1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.9390	0.000	1	119.5732	10.465	29	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|O<1>,2|C<3>}	C[6](C[6]C[6]2)(C[6]C[6]H)(H){1|H<1>,4|C<3>}	H(C[6]C[6]2)	119.9775	0.069	2	119.5732	10.465	29	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){2|C<3>}	C[6](C[6]C[6]2)(C[6]C[6]H)(H){1|Au<4>,1|C<2>,1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.3620	0.000	1	119.5732	10.465	29	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){2|C<3>}	C[6](C[6]C[6]2)(C[6]C[6]H)(H){1|C<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	123.9850	1.454	2	119.5732	10.465	29	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]As)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|As<3>,1|C<2>,1|H<1>}	C[6](C[6]C[6]As)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	115.2190	0.000	1	116.2490	9.114	7	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]As)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|As<3>,1|C<2>}	C[6](C[6]C[6]As)(C[6]C[6]H)(H){1|C<2>,1|H<1>}	H(C[6]C[6]2)	114.8380	0.000	1	116.2490	9.114	7	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]As)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|As<4>,1|C<2>,1|H<1>}	C[6](C[6]C[6]As)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	118.2113	3.923	3	116.2490	9.114	7	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]As)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|As<4>,1|C<3>}	C[6](C[6]C[6]As)(C[6]C[6]H)(H){1|C<2>,2|H<1>}	H(C[6]C[6]2)	114.5260	1.834	2	116.2490	9.114	7	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]B)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|B<4>,1|C<2>,1|H<1>}	C[6](C[6]C[6]B)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.3310	0.000	1	119.9634	1.720	16	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]B)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|B<4>,1|C<3>,2|H<1>}	C[6](C[6]C[6]B)(C[6]C[6]H)(H){1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.1800	0.000	1	119.9634	1.720	16	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]B)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|B<4>,1|C<3>}	C[6](C[6]C[6]B)(C[6]C[6]H)(H){1|C<2>,2|H<1>}	H(C[6]C[6]2)	121.0458	2.050	5	119.9634	1.720	16	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]B)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Dy<16>,1|B<4>,1|C<4>,1|H<1>}	C[6](C[6]C[6]B)(C[6]C[6]H)(H){1|Dy<16>,1|C<4>,1|H<1>,1|H<2>}	H(C[6]C[6]2)	119.4380	0.103	4	119.9634	1.720	16	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]B)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Fe<5>,1|C<3>,2|B<4>}	C[6](C[6]C[6]B)(C[6]C[6]H)(H){1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.8710	0.000	1	119.9634	1.720	16	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]B)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Tb<16>,1|B<4>,1|C<4>,1|H<1>}	C[6](C[6]C[6]B)(C[6]C[6]H)(H){1|Tb<16>,1|C<4>,1|H<1>,1|H<2>}	H(C[6]C[6]2)	119.5130	0.232	4	119.9634	1.720	16	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]Be)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Be<3>,1|C<3>}	C[6](C[6]C[6]Be)(C[6]C[6]H)(H){1|C<2>,2|H<1>}	H(C[6]C[6]2)	120.9780	0.000	1	120.9780	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]Br)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Br<1>,1|C<2>,1|N<3>}	C[6](C[6]C[6]Br)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	117.4960	0.000	1	118.9755	4.378	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]Br)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Br<1>,1|C<3>,1|H<1>}	C[6](C[6]C[6]Br)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	120.4550	0.000	1	118.9755	4.378	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<2>,1|C<3>,1|H<1>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	117.5821	2.851	11	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<2>,1|C<3>,2|H<1>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.8530	0.000	1	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<2>,1|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<2>,1|H<1>}	H(C[6]C[6]2)	121.5795	5.861	2	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<2>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.5539	4.581	10	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<2>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<2>,1|H<1>}	H(C[6]C[6]2)	122.2050	2.601	2	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<2>,2|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6925	0.127	2	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.9820	0.000	1	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>,1|V<6>}	H(C[6]C[6]2)	120.1360	0.000	1	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|O<1>,2|H<1>}	H(C[6]C[6]2)	119.3070	0.000	1	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Zr<15>,1|C<3>,1|H<1>,1|H<2>}	H(C[6]C[6]2)	119.0300	0.000	1	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){2|Al<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8570	0.000	1	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|O<2>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Dy<15>,1|C<3>,1|H<1>,1|O<3>}	H(C[6]C[6]2)	119.8670	0.000	1	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|O<2>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Gd<15>,1|C<3>,1|H<1>,1|O<3>}	H(C[6]C[6]2)	120.0550	0.038	2	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|O<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Ce<18>,1|C<3>,1|H<1>,1|O<3>}	H(C[6]C[6]2)	119.7295	0.307	4	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|O<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Er<14>,1|C<3>,1|H<1>,1|O<3>}	H(C[6]C[6]2)	120.0710	0.000	1	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|O<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Ho<15>,1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.7350	0.034	2	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|O<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|La<18>,1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.7517	0.192	3	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|O<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Nd<18>,1|C<3>,1|H<1>,1|O<3>}	H(C[6]C[6]2)	119.3970	0.576	2	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|O<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Tb<15>,1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.7185	0.012	2	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|O<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Yb<15>,1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.6020	0.018	2	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,2|H<1>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.4340	0.000	1	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,2|O<2>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	118.9190	0.000	1	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<2>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.2080	0.000	1	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<2>,2|H<1>}	H(C[6]C[6]2)	120.8679	4.568	13	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|O<2>,2|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	119.4450	0.000	1	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,2|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	120.3129	0.297	39	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,2|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Dy<16>,1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.6167	0.454	4	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,2|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Gd<16>,1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.5712	0.030	4	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,2|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Ti<7>,1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.6690	0.033	2	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,3|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.1390	0.000	1	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	119.6663	0.287	3	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.0975	0.185	2	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Fe<5>,1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.7950	0.037	2	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.0255	3.287	2	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<5>,2|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){2|Dy<16>,1|C<3>,1|H<1>,1|O<3>}	H(C[6]C[6]2)	120.3260	0.024	2	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<5>,2|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){2|Gd<16>,1|C<3>,1|H<1>,1|O<3>}	H(C[6]C[6]2)	120.3945	0.026	2	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Co<5>,3|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Co<5>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.6580	0.000	1	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Cr<6>,3|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Cr<6>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3910	0.000	1	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Dy<11>,1|C<3>,1|C<4>,1|O<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Dy<11>,1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.8620	0.225	2	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|F<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	120.4400	0.000	1	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Fe<6>,1|C<4>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Fe<5>,1|Fe<6>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.4910	0.808	2	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Fe<6>,1|C<4>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){2|Fe<6>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.5697	0.715	3	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Gd<17>,1|C<3>,1|C<4>,1|O<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Gd<17>,1|C<4>,1|H<1>,1|O<3>}	H(C[6]C[6]2)	120.1470	0.013	2	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|O<2>,2|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|O<2>,2|H<1>}	H(C[6]C[6]2)	118.6110	0.000	1	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|C<2>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0120	0.000	1	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	120.8513	1.176	27	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	123.2821	10.606	14	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,3|H<1>}	H(C[6]C[6]2)	120.6290	0.282	3	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Hf<10>,1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2535	0.238	4	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Hf<11>,1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2450	0.141	3	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Hf<9>,1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1872	0.318	5	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Mg<6>,1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.6770	0.000	1	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Nd<12>,1|C<3>,1|H<1>,1|N<4>}	H(C[6]C[6]2)	120.3090	0.064	3	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|U<16>,1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7460	0.000	1	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Y<10>,1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1475	0.023	2	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Yb<12>,1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8290	0.643	2	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Zr<11>,1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2093	0.208	3	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Zr<9>,1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2130	0.331	2	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){2|Li<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6237	0.184	3	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ir<7>,2|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Ir<7>,1|C<3>,1|H<1>,1|N<4>}	H(C[6]C[6]2)	119.5775	0.032	2	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ir<9>,3|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Ir<9>,1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.3210	0.000	1	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Li<5>,1|C<3>,2|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2880	0.000	1	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Li<6>,3|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Li<6>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3010	0.000	1	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	120.5390	0.115	2	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<4>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	123.2110	0.000	1	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|O<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	120.0140	0.000	1	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|O<2>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	122.9560	0.000	1	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|O<2>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	120.9518	2.393	30	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Pd<5>,3|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Pd<5>,1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.8620	0.000	1	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Pd<6>,3|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Pd<6>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7820	0.000	1	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Rh<9>,3|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Rh<9>,1|C<4>,1|H<1>,1|P<4>}	H(C[6]C[6]2)	119.5110	0.000	1	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ru<10>,3|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Ru<10>,1|C<4>,1|H<1>,1|N<4>}	H(C[6]C[6]2)	119.4850	0.000	1	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ru<5>,1|Ru<7>,2|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Ru<7>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.3765	0.131	2	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ru<8>,1|H<2>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9990	0.410	2	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Tb<11>,1|C<3>,1|C<4>,1|O<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Tb<11>,1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.5105	0.045	2	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Tb<16>,1|C<3>,1|C<4>,1|O<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Tb<16>,1|C<4>,1|H<1>,1|O<3>}	H(C[6]C[6]2)	119.9255	0.221	2	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ti<12>,1|C<3>,1|C<4>,1|O<2>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Ti<12>,1|C<4>,1|H<1>,1|O<3>}	H(C[6]C[6]2)	119.6259	0.169	9	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|U<16>,1|C<3>,1|C<4>,1|O<2>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|U<16>,1|C<4>,1|H<1>,1|O<3>}	H(C[6]C[6]2)	119.4830	0.533	20	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){2|C<3>,2|H<1>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	118.0030	0.000	1	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){2|C<3>,2|H<1>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.9560	0.000	1	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<2>,2|H<1>}	H(C[6]C[6]2)	117.1570	5.381	9	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){3|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	120.2583	0.680	4	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){3|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>,1|U<8>}	H(C[6]C[6]2)	120.0835	0.043	2	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){3|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|V<6>,2|H<1>}	H(C[6]C[6]2)	119.2025	0.011	2	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){3|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Ca<12>,1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2322	0.223	4	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){3|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Ca<7>,1|C<3>,1|H<1>,1|O<3>}	H(C[6]C[6]2)	120.2165	0.083	2	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){3|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Ca<8>,1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1020	0.037	2	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){3|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Cr<4>,1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8672	0.836	4	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){3|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Cr<4>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.9615	0.187	2	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){3|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Cr<7>,1|C<3>,1|H<1>,1|N<4>}	H(C[6]C[6]2)	120.1465	0.029	2	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){3|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Er<15>,1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9975	0.182	4	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){3|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Eu<8>,1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1455	0.059	2	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){3|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Hf<8>,1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8945	0.019	2	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){3|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Hf<9>,1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4600	0.225	2	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){3|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|La<16>,1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.6990	0.071	2	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){3|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Li<5>,1|C<3>,1|H<1>,1|N<4>}	H(C[6]C[6]2)	120.3287	0.321	4	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){3|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Nd<12>,1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.1060	0.018	2	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){3|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Nd<12>,1|C<3>,1|H<1>,1|O<3>}	H(C[6]C[6]2)	120.1200	0.149	4	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){3|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Nd<15>,1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9425	0.243	4	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){3|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Ni<4>,1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8450	0.047	2	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){3|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Ni<6>,1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7055	0.098	2	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){3|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.8485	0.052	2	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){3|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Sc<9>,1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9585	0.009	2	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){3|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Sm<10>,1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8160	0.079	2	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){3|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Sm<11>,1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0185	0.035	2	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){3|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Sr<6>,1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5976	0.227	8	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){3|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Th<14>,1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.1635	0.155	4	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){3|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Th<17>,1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.6045	0.260	4	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){3|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|U<13>,1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.4222	0.233	10	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){3|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|U<14>,1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8160	0.439	4	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){3|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|U<15>,1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.4965	0.149	2	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){3|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|U<16>,1|C<3>,1|H<1>,1|H<2>}	H(C[6]C[6]2)	119.4730	0.177	4	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){3|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Yb<13>,1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0700	0.302	4	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){3|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Zr<10>,1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5990	0.008	2	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){3|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Zr<7>,1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3590	0.069	2	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){3|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Zr<9>,1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3025	0.160	6	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){3|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1635	0.209	2	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){3|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){2|Ir<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0325	0.129	2	120.1793	6.823	427	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){2|Cl<1>,1|C<3>}	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	124.5760	0.000	1	124.5760	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]Cr)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Cr<8>,1|C<4>,1|H<1>}	C[6](C[6]C[6]Cr)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<3>}	H(C[6]C[6]2)	119.8285	0.182	4	119.8285	0.033	4	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]F)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<2>,2|F<1>}	C[6](C[6]C[6]F)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8310	0.712	3	119.8170	0.409	5	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]F)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|F<1>,1|O<1>}	C[6](C[6]C[6]F)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.2380	0.000	1	119.8170	0.409	5	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]F)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|F<1>,2|C<3>}	C[6](C[6]C[6]F)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	120.3540	0.000	1	119.8170	0.409	5	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]Ga)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ga<3>,1|C<3>}	C[6](C[6]C[6]Ga)(C[6]C[6]H)(H){1|C<2>,2|H<1>}	H(C[6]C[6]2)	119.9060	0.000	1	119.9060	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]Ge)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ge<4>,1|C<2>,1|H<1>}	C[6](C[6]C[6]Ge)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8560	0.000	1	119.7960	0.007	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]Ge)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ge<4>,1|C<3>}	C[6](C[6]C[6]Ge)(C[6]C[6]H)(H){1|C<2>,2|H<1>}	H(C[6]C[6]2)	119.7360	0.000	1	119.7960	0.007	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<2>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	123.2830	0.000	1	119.9504	4.696	52	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<2>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.3350	7.237	3	119.9504	4.696	52	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	122.3110	3.327	3	119.9504	4.696	52	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.4742	0.768	5	119.9504	4.696	52	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<2>,2|H<1>}	H(C[6]C[6]2)	121.4758	3.090	4	119.9504	4.696	52	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<4>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<2>,1|V<8>}	H(C[6]C[6]2)	120.0100	0.081	7	119.9504	4.696	52	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<4>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<2>,1|V<9>}	H(C[6]C[6]2)	120.6090	1.028	5	119.9504	4.696	52	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<4>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|W<10>,1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.9500	0.023	2	119.9504	4.696	52	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,1|W<9>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<2>,1|W<9>}	H(C[6]C[6]2)	119.8290	0.144	3	119.9504	4.696	52	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,2|N<2>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|Co<5>,1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.2057	0.301	4	119.9504	4.696	52	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,2|N<2>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|Fe<5>,1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.1937	0.143	4	119.9504	4.696	52	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,2|N<2>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|Li<5>,1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.6350	2.280	2	119.9504	4.696	52	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,2|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|Cr<7>,1|C<3>,1|H<1>,1|H<2>}	H(C[6]C[6]2)	118.5705	0.006	2	119.9504	4.696	52	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,2|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|Mo<7>,1|C<3>,1|H<1>,1|H<2>}	H(C[6]C[6]2)	118.4920	0.000	1	119.9504	4.696	52	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	120.5610	0.107	2	119.9504	4.696	52	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<4>,2|C<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	115.7730	0.000	1	119.9504	4.696	52	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Pd<5>,1|C<4>,2|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|Pd<5>,1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.4740	0.199	2	119.9504	4.696	52	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Rh<5>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|Rh<5>,1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.0780	0.000	1	119.9504	4.696	52	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<2>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	118.5380	0.000	1	119.3005	4.574	150	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.5210	0.000	1	119.3005	4.574	150	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Dy<15>,1|C<3>,1|H<1>,1|O<3>}	H(C[6]C[6]2)	119.9945	0.132	2	119.3005	4.574	150	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Gd<15>,1|C<3>,1|H<1>,1|O<3>}	H(C[6]C[6]2)	120.0055	0.194	2	119.3005	4.574	150	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|O<3>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Ce<18>,1|C<3>,1|H<1>,1|O<3>}	H(C[6]C[6]2)	119.7163	0.277	4	119.3005	4.574	150	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|O<3>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Er<14>,1|C<3>,1|H<1>,1|O<3>}	H(C[6]C[6]2)	120.1380	0.000	1	119.3005	4.574	150	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|O<3>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Ho<15>,1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.7280	0.107	2	119.3005	4.574	150	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|O<3>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|La<18>,1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.7113	0.220	3	119.3005	4.574	150	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|O<3>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Nd<18>,1|C<3>,1|H<1>,1|O<3>}	H(C[6]C[6]2)	119.4270	0.468	2	119.3005	4.574	150	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|O<3>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Tb<15>,1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.7000	0.000	1	119.3005	4.574	150	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|O<3>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Yb<15>,1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.6225	0.015	2	119.3005	4.574	150	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|F<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.2020	0.000	1	119.3005	4.574	150	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Br<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.3550	0.000	1	119.3005	4.574	150	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	117.0685	4.889	4	119.3005	4.574	150	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	120.0070	1.232	2	119.3005	4.574	150	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|P<4>}	H(C[6]C[6]2)	119.2450	0.000	1	119.3005	4.574	150	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8674	0.231	8	119.3005	4.574	150	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.4895	0.560	35	119.3005	4.574	150	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.5994	0.785	5	119.3005	4.574	150	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|O<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	118.9373	0.031	3	119.3005	4.574	150	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|O<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.1635	8.755	2	119.3005	4.574	150	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|O<1>,1|P<4>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|S<4>}	H(C[6]C[6]2)	119.2240	0.000	1	119.3005	4.574	150	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<2>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	123.2150	3.235	5	119.3005	4.574	150	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<2>,2|H<1>}	H(C[6]C[6]2)	115.2557	7.710	3	119.3005	4.574	150	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|O<3>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<2>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.3340	0.000	1	119.3005	4.574	150	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	118.8780	0.020	2	119.3005	4.574	150	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,2|O<2>}	H(C[6]C[6]2)	119.0750	0.000	1	119.3005	4.574	150	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|O<2>,1|W<7>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<4>,1|W<7>,2|H<1>}	H(C[6]C[6]2)	117.3620	0.000	1	119.3005	4.574	150	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|H<1>,3|C<3>}	H(C[6]C[6]2)	118.7230	0.000	2	119.3005	4.574	150	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|O<3>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Ti<11>,1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8380	0.016	2	119.3005	4.574	150	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,2|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|H<1>,1|P<4>,2|C<3>}	H(C[6]C[6]2)	117.6663	0.408	4	119.3005	4.574	150	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,2|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Pd<4>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.2913	0.062	4	119.3005	4.574	150	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,2|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Rh<5>,1|C<3>,1|H<1>,1|H<2>}	H(C[6]C[6]2)	118.5850	0.013	2	119.3005	4.574	150	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|O<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	119.9060	0.000	1	119.3005	4.574	150	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|O<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.0145	0.111	2	119.3005	4.574	150	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|O<2>,2|C<3>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	116.0220	0.000	1	119.3005	4.574	150	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|O<2>,2|C<3>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	119.0629	2.276	33	119.3005	4.574	150	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Re<7>,1|C<4>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Re<7>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	118.2040	0.000	1	119.3005	4.574	150	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Zr<13>,1|C<3>,1|O<2>,1|O<3>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Zr<13>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.3720	0.000	1	119.3005	4.574	150	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<2>,1|H<1>,1|P<4>}	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	118.8587	2.559	26	119.1057	7.393	81	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<2>,1|P<4>}	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<2>,1|H<1>}	H(C[6]C[6]2)	120.2020	0.000	1	119.1057	7.393	81	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|P<4>}	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	117.5580	0.000	1	119.1057	7.393	81	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|O<1>,1|P<4>}	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<3>,1|H<1>,1|S<4>}	H(C[6]C[6]2)	119.1910	0.000	1	119.1057	7.393	81	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|P<3>}	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<2>,2|H<1>}	H(C[6]C[6]2)	119.9480	0.000	1	119.1057	7.393	81	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|P<4>,2|H<1>}	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.8090	0.000	1	119.1057	7.393	81	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|P<4>,2|H<1>}	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.7210	0.000	1	119.1057	7.393	81	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|P<4>}	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<2>,2|H<1>}	H(C[6]C[6]2)	118.9110	3.522	34	119.1057	7.393	81	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|P<4>}	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<3>,3|H<1>}	H(C[6]C[6]2)	119.9732	0.231	5	119.1057	7.393	81	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|P<4>}	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|Hf<13>,1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.6880	0.000	1	119.1057	7.393	81	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|P<4>}	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|La<14>,1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.5800	0.000	1	119.1057	7.393	81	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|P<4>}	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|Zr<13>,1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.9395	0.033	2	119.1057	7.393	81	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|P<4>}	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|Zr<14>,1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.2210	0.000	1	119.1057	7.393	81	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ti<10>,1|C<3>,1|N<3>,1|P<4>}	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.4117	0.402	3	119.1057	7.393	81	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ti<8>,1|C<3>,1|N<3>,1|P<4>}	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.6800	0.064	2	119.1057	7.393	81	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6]S)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<2>,1|H<1>,1|S<3>}	C[6](C[6]C[6]H)(C[6]C[6]S)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.0430	0.000	1	120.0847	30.471	15	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6]S)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<2>,1|H<1>,1|S<4>}	C[6](C[6]C[6]H)(C[6]C[6]S)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	117.0770	0.000	1	120.0847	30.471	15	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6]S)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|S<2>}	C[6](C[6]C[6]H)(C[6]C[6]S)(H){1|C<2>,1|H<1>,1|S<2>}	H(C[6]C[6]2)	125.2925	6.375	4	120.0847	30.471	15	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6]S)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|S<2>}	C[6](C[6]C[6]H)(C[6]C[6]S)(H){1|C<2>,2|H<1>}	H(C[6]C[6]2)	116.3135	4.181	2	120.0847	30.471	15	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6]S)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|S<4>}	C[6](C[6]C[6]H)(C[6]C[6]S)(H){1|C<2>,2|H<1>}	H(C[6]C[6]2)	108.2750	0.000	1	120.0847	30.471	15	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6]S)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|O<2>,1|S<3>}	C[6](C[6]C[6]H)(C[6]C[6]S)(H){1|C<4>,1|O<2>,2|H<1>}	H(C[6]C[6]2)	120.0320	0.750	2	120.0847	30.471	15	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6]S)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|S<3>}	C[6](C[6]C[6]H)(C[6]C[6]S)(H){1|Ti<8>,1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.0755	0.081	2	120.0847	30.471	15	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6]S)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|S<3>}	C[6](C[6]C[6]H)(C[6]C[6]S)(H){1|Y<12>,1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4850	0.000	1	120.0847	30.471	15	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6]S)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|S<3>}	C[6](C[6]C[6]H)(C[6]C[6]S)(H){1|Yb<12>,1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3780	0.000	1	120.0847	30.471	15	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6]U)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|U<13>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6]U)(H){1|Te<2>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4280	0.000	1	120.4570	0.002	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6]U)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|U<15>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6]U)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4860	0.000	1	120.4570	0.002	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6]W)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,1|W<9>}	C[6](C[6]C[6]H)(C[6]C[6]W)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.8340	0.211	2	119.8340	0.044	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]C[6]Y)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Y<13>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]C[6]Y)(H){1|C<3>,1|H<1>,1|S<3>}	H(C[6]C[6]2)	119.6600	0.000	1	119.6600	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]2)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]2)(H){1|C<3>,1|H<1>,1|V<7>,2|C<4>}	H(C[6]C[6]2)	120.5940	0.000	1	119.9457	0.105	12	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]2)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]2)(H){1|Ru<6>,1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.9250	0.095	2	119.9457	0.105	12	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]2)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]2)(H){1|C<3>,1|H<1>,3|C<4>}	H(C[6]C[6]2)	120.2035	0.039	2	119.9457	0.105	12	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]2)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]2)(H){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.8030	0.372	3	119.9457	0.105	12	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]2)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]2)(H){1|Pd<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.9145	0.211	2	119.9457	0.105	12	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]2)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){3|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]2)(H){1|Re<6>,1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.6295	0.035	2	119.9457	0.105	12	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]B)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|B<4>,1|C<3>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]B)(H){1|Li<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7720	0.116	2	120.4949	0.081	81	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]B)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|B<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]B)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0818	0.088	5	120.4949	0.081	81	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]B)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|B<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]B)(H){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5869	0.249	18	120.4949	0.081	81	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]B)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|B<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]B)(H){1|Mg<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4481	0.151	11	120.4949	0.081	81	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]B)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|B<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]B)(H){1|Ni<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4275	0.224	4	120.4949	0.081	81	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]B)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|B<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]B)(H){1|Pt<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5980	0.328	2	120.4949	0.081	81	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]B)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|B<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]B)(H){1|Pt<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3542	0.184	8	120.4949	0.081	81	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]B)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|B<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]B)(H){1|Ru<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6630	0.214	9	120.4949	0.081	81	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]B)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|B<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]B)(H){1|Ru<9>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7025	0.213	2	120.4949	0.081	81	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]B)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|B<4>}	C[6](C[6]C[6]H)(C[6]N[6]B)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.6550	0.013	2	120.4949	0.081	81	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]B)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|B<4>}	C[6](C[6]C[6]H)(C[6]N[6]B)(H){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4975	0.043	2	120.4949	0.081	81	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]B)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|B<4>}	C[6](C[6]C[6]H)(C[6]N[6]B)(H){1|Fe<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2875	0.070	2	120.4949	0.081	81	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]B)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|B<4>}	C[6](C[6]C[6]H)(C[6]N[6]B)(H){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5400	0.163	12	120.4949	0.081	81	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]B)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|B<4>}	C[6](C[6]C[6]H)(C[6]N[6]B)(H){1|Sc<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.0825	0.080	2	120.4949	0.081	81	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Al<4>,1|C<4>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Li<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6073	0.084	13	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|As<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.8485	0.138	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|As<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6815	0.144	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|As<4>,1|C<4>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2150	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Br<1>,1|C<3>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7510	0.387	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Br<1>,1|C<3>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3650	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Br<1>,1|C<3>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4947	0.353	8	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Br<1>,1|C<3>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Os<9>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4100	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Br<1>,1|C<4>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2890	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Br<1>,1|C<4>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.2630	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Br<1>,1|C<4>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4200	0.054	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Br<1>,1|C<4>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8110	0.000	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<2>,1|C<3>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8480	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<2>,1|C<3>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4940	0.120	3	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<2>,1|C<3>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.0990	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<2>,1|C<3>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pt<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4580	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<2>,1|C<3>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pt<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.9690	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<2>,1|C<3>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<9>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1840	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<2>,1|C<4>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5180	0.063	4	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<2>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|B<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7090	0.090	4	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<2>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.3438	0.226	8	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<2>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8465	0.185	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<2>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2120	0.052	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<2>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1060	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<2>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4424	0.230	5	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<2>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pt<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1958	0.349	5	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<2>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pt<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4320	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<2>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Re<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.9980	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<2>,1|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<2>,1|H<1>}	H(C[6]C[6]2)	120.2980	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ag<3>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2225	0.008	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ag<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2750	0.087	4	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Al<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1957	0.222	3	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Al<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1882	0.185	9	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.2620	0.216	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9247	0.488	10	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0450	0.113	4	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cd<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0672	0.251	12	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5563	1.474	21	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4243	0.455	3	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3800	0.431	24	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cr<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9740	0.262	4	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cr<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.6300	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2481	0.462	68	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0240	0.563	44	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0376	0.633	10	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3005	0.167	15	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1895	0.815	17	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6050	0.568	143	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0374	0.073	5	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Hg<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8725	0.453	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3026	0.868	14	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3570	0.038	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Li<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2270	0.184	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2367	0.484	6	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2786	0.490	14	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mo<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9845	0.016	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1365	0.253	14	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1465	0.829	17	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5454	0.942	45	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.0970	0.717	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9413	1.016	40	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pt<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2611	0.369	16	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pt<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4550	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Re<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2037	0.177	4	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Re<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.9844	1.403	9	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Rh<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.1185	0.116	4	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0620	0.048	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.6185	0.016	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1585	0.405	18	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<3>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8628	0.011	4	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0885	0.248	24	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4425	0.711	17	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5058	0.551	52	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ag<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4690	0.102	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Al<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.7490	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Al<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2699	0.251	14	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Al<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4342	0.195	4	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|B<3>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0260	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4915	0.054	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Bi<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2460	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.3318	0.517	24	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	121.3603	0.948	6	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.6490	0.091	3	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|V<5>}	H(C[6]C[6]2)	120.2405	0.090	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|V<6>}	H(C[6]C[6]2)	120.2663	0.360	3	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|V<7>}	H(C[6]C[6]2)	120.5000	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9958	0.706	81	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ca<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4482	0.144	5	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cd<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3076	0.184	11	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cd<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4935	0.471	21	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cd<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4610	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cd<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2440	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1049	1.447	10	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5788	0.279	11	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4374	0.531	106	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1660	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cr<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5145	0.028	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cr<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.8580	2.866	4	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cr<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4140	0.411	26	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cr<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5245	0.071	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<3>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5305	0.143	4	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4007	0.630	57	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5091	0.899	64	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0830	0.383	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Eu<10>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8730	1.786	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0797	0.556	6	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4750	0.431	17	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4587	0.851	177	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5323	0.125	4	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4550	0.379	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Hg<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6770	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3313	0.756	38	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3770	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4877	0.725	28	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mg<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4325	0.080	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4097	0.105	3	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5524	0.096	5	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2816	1.077	97	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6462	0.361	4	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.2100	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mo<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.6469	1.729	7	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mo<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0690	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mo<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4442	0.311	6	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7027	0.718	31	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4080	0.166	8	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3332	0.577	172	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Os<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1175	0.329	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Os<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.9910	0.103	3	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Os<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6250	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Os<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5293	0.104	3	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Os<9>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4950	0.371	5	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pb<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.8950	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3997	0.957	71	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5350	0.330	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2940	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pt<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5351	0.563	59	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pt<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6285	0.035	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pt<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.8156	4.200	12	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Re<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4520	0.577	45	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Re<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4040	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Rh<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6129	0.638	8	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Rh<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3450	0.000	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Rh<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5371	0.427	17	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4730	0.549	7	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4021	0.416	13	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.2827	0.191	4	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7373	0.067	3	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<9>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5927	0.225	26	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Sb<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.4550	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Sm<10>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9925	1.203	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Sm<9>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6397	0.236	3	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Sn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2666	0.540	5	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Sn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2399	0.213	19	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3961	0.654	50	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3108	0.315	31	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4946	0.265	63	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zr<13>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6630	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9302	0.086	5	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9780	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.6820	0.126	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.7080	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cd<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.5330	0.006	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cd<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.6760	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0590	0.156	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0620	0.915	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2510	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1120	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3487	0.161	4	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Sn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.5115	1.002	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<3>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.6990	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.6328	0.795	12	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|P<4>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3030	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|P<4>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8850	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Al<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2950	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cr<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.4350	0.000	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8415	0.591	4	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.3430	0.222	3	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Li<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.4590	0.048	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.6965	0.013	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.2893	0.416	6	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8730	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.3035	0.286	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.7000	0.453	3	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2740	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|C<5>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1375	0.063	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|F<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0490	0.283	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|F<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9650	0.042	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|F<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0712	0.235	5	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ag<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3590	0.400	11	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Al<3>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7660	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Al<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3210	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Al<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1520	0.000	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Al<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3003	0.112	3	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Au<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.7070	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7821	0.079	9	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|B<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.7336	1.943	5	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.2460	0.556	26	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|D<1>,1|H<1>}	H(C[6]C[6]2)	119.8350	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8940	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	120.5864	0.591	33	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|O<3>}	H(C[6]C[6]2)	120.4940	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|V<5>}	H(C[6]C[6]2)	119.3980	1.783	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|V<6>}	H(C[6]C[6]2)	120.3351	0.139	14	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|V<7>}	H(C[6]C[6]2)	120.2285	0.338	6	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9225	0.445	140	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ca<10>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4510	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ca<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4727	0.235	6	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5620	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cd<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5954	0.493	12	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cd<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4599	0.293	30	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cd<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7687	1.053	3	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5443	0.428	15	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3850	0.250	47	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3259	0.450	279	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2181	0.441	11	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7680	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cr<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.6650	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cr<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3909	1.123	43	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cr<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3390	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cr<9>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.1580	0.132	3	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<2>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4917	0.084	3	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<3>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3814	0.575	17	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4245	0.608	138	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2162	1.043	335	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0731	1.049	20	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Eu<13>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1390	0.535	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Eu<9>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7685	0.322	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6198	1.166	10	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3319	0.919	41	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4245	0.416	843	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5058	0.248	12	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5057	1.500	3	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ga<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5600	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ga<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3060	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.2080	0.126	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Hg<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6890	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Hg<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2790	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|In<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3680	0.143	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.1360	0.479	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4472	0.458	55	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5517	0.109	3	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4655	0.428	29	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Li<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4388	0.341	9	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Li<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4060	0.238	5	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mg<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3075	0.057	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mg<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.6750	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mg<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6246	0.182	7	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3286	0.200	13	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2640	0.899	236	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4860	0.330	37	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.8345	0.056	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mo<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1021	0.907	21	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mo<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1910	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mo<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6880	2.533	16	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4760	0.230	31	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3401	1.756	39	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3650	0.706	309	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5611	0.329	15	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Os<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7979	0.908	7	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Os<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.6960	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Os<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5367	0.384	7	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Os<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.8210	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Os<9>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5820	0.164	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4538	0.522	152	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.3510	1.209	3	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3988	0.372	8	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7410	0.038	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pt<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5002	1.211	68	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pt<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4055	0.073	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pt<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1775	0.415	15	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Re<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3150	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Re<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6594	1.704	90	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Re<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6060	0.412	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Rh<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.6956	1.831	7	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Rh<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1671	1.201	20	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Rh<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5440	0.189	3	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Rh<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5596	0.401	13	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6700	1.148	17	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7071	0.567	96	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5325	0.410	4	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7765	0.142	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<9>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5483	0.504	21	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Sn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.7179	0.467	8	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Sr<10>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5465	0.080	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ta<10>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5280	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Tc<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6040	0.011	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Tc<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.3257	1.004	4	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4644	0.318	61	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4027	0.697	132	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4227	0.627	69	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Al<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2000	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.2483	0.814	3	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4960	2.067	5	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6285	0.013	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6658	0.524	5	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7408	0.217	5	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	118.5040	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0003	0.243	3	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1030	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6915	0.340	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7610	0.168	5	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.1877	0.287	4	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.9652	0.244	6	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.0300	0.031	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<9>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.0020	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.6770	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9813	0.452	3	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<2>,1|O<1>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0100	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<2>,1|H<1>}	H(C[6]C[6]2)	120.5845	0.309	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,1|N<4>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Li<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3690	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,1|N<5>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Os<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.6530	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,1|N<5>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.8835	0.153	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,1|N<5>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0010	0.000	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Al<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.4800	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.1205	0.094	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	118.8731	1.761	7	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2788	0.110	5	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0277	0.259	6	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0640	0.047	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Rh<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.7597	0.145	4	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2820	0.139	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7694	0.221	5	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,1|P<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mo<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.3363	0.485	3	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,1|P<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0973	0.086	4	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,1|P<4>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.5690	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,1|P<4>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<3>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4137	0.199	11	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,1|P<4>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4750	0.054	3	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,1|P<4>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Li<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7045	0.235	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,1|P<4>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mo<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0430	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,1|P<4>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mo<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.6560	0.915	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,1|S<1>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.5515	0.018	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4490	0.245	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1855	0.066	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,1|V<6>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|V<6>}	H(C[6]C[6]2)	119.9280	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	120.5940	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.3398	0.474	53	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3170	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.9660	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1833	0.489	9	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5830	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6189	0.874	14	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0885	0.302	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1410	0.154	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Li<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8550	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.3780	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1599	0.190	12	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1608	0.642	5	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0975	0.326	6	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Sn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.6030	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8290	0.076	3	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8686	0.367	19	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8546	0.325	5	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<5>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7462	0.435	6	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<5>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1137	0.053	3	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<5>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Re<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0195	0.435	4	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<5>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<10>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5635	0.244	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<5>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ti<10>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3140	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ce<12>,1|C<4>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.0670	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ce<13>,1|C<4>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.7250	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Cl<1>,1|C<3>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3935	0.183	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Cl<1>,1|C<3>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	123.1560	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Cl<1>,1|C<4>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2760	0.115	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Cl<1>,1|C<4>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1815	0.494	4	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Fe<7>,1|C<4>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<7>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.2823	0.187	3	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Hf<10>,1|C<4>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Hf<10>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.9850	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ir<6>,1|C<4>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.5370	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Mo<8>,1|C<3>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mo<8>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	118.8675	12.672	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<2>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1185	1.159	4	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<2>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Au<3>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4600	0.105	3	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<2>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.4582	0.199	4	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<2>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.6213	0.221	4	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<2>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6803	0.103	8	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ag<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9570	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Al<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0463	0.255	4	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Al<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8542	0.284	15	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Al<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.7441	0.284	13	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Au<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2940	0.051	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.2527	0.285	4	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|V<6>}	H(C[6]C[6]2)	120.5640	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0424	0.636	12	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ca<9>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4023	0.083	3	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cd<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8898	0.657	6	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cd<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1635	0.140	12	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8772	0.890	62	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9539	0.620	76	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8849	0.939	154	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9611	0.168	10	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cr<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.5404	0.282	17	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<3>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0745	0.135	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9364	0.380	36	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.6244	0.373	45	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0422	0.232	55	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Er<12>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6683	0.101	4	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Eu<12>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1035	0.456	4	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9223	2.549	20	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0339	0.737	132	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8197	0.605	121	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0535	0.940	31	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.8350	2.783	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ga<3>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.6583	0.478	7	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ge<2>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0895	0.084	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Hg<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0577	0.552	16	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9264	0.753	11	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.6310	0.048	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9505	2.176	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7840	0.034	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mg<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0884	0.057	5	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mg<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8322	0.297	9	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mg<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8680	0.031	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8655	0.256	13	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0105	0.507	56	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8994	0.427	49	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mo<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0576	0.393	5	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mo<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3671	0.501	11	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mo<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3147	0.303	10	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mo<9>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.4385	0.045	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Nd<16>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6335	0.189	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8413	0.680	57	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8954	0.364	22	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9382	0.516	146	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pb<3>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.6940	0.076	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8119	0.839	67	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pt<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8513	1.071	27	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Re<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5719	0.726	9	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Rh<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7303	2.107	6	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0850	0.293	6	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9937	0.532	33	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Sb<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1620	0.071	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Se<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0470	0.028	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Sm<12>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3575	6.209	4	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Sn<3>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2530	0.007	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Sn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3985	0.239	8	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Sn<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.7564	0.261	12	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Sr<9>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5140	0.213	4	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Yb<12>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7130	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.8224	0.514	5	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0711	0.660	18	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8941	0.581	39	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2675	0.094	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ag<3>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9360	0.038	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ag<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2890	0.069	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ag<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8965	0.032	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Al<3>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2830	0.041	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|B<3>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9107	0.182	7	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.9665	0.015	6	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.3043	0.172	24	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	120.5564	0.616	15	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|V<5>}	H(C[6]C[6]2)	120.5920	0.075	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|V<6>}	H(C[6]C[6]2)	120.2480	0.014	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|W<5>}	H(C[6]C[6]2)	120.3470	1.962	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|W<6>}	H(C[6]C[6]2)	120.9805	0.076	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|W<9>}	H(C[6]C[6]2)	120.8522	0.149	4	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8351	0.541	82	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5115	0.501	20	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3512	0.445	28	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1502	0.479	125	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1240	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cr<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5055	0.039	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cr<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3076	0.218	9	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cr<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3493	0.267	6	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<2>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5217	0.211	4	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<3>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2199	0.202	17	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4426	1.667	109	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2236	1.168	82	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1275	0.661	20	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2855	0.216	8	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4564	0.361	25	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3171	0.395	189	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0749	0.374	12	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0345	0.090	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Hg<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3487	0.523	4	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Hg<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3000	0.027	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6194	0.301	8	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4603	0.257	26	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5387	0.337	63	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6598	0.094	4	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mg<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0663	0.398	3	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mg<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1290	0.114	4	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1500	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2504	0.965	69	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.7891	1.037	25	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mo<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.8468	0.296	5	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mo<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4672	0.425	34	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mo<9>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.8078	0.171	6	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5291	0.380	43	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2612	3.464	10	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2052	1.057	153	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2044	0.352	7	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Os<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9322	0.538	16	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3530	0.405	125	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5102	0.046	4	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1610	0.201	25	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pt<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2859	0.463	25	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Re<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.4620	0.139	9	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Re<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2671	0.310	23	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Re<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.8075	0.103	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Rh<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4124	0.292	27	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Rh<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4911	0.182	23	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Rh<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2495	0.361	12	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Rh<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7184	0.227	7	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4936	0.161	14	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3489	0.750	87	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7319	0.242	9	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Sn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9805	0.013	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ti<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5375	0.722	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Yb<13>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2477	0.233	6	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4716	0.196	9	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2168	0.341	9	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8116	4.038	14	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<4>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mg<4>,1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.5125	0.103	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<4>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){2|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4915	0.030	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<4>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){2|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9603	0.242	3	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<4>,2|C<4>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Dy<15>,1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.5170	0.091	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<4>,2|C<4>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Nd<15>,1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.6570	0.007	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Nd<12>,1|C<4>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Nd<12>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.3310	0.462	3	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ni<4>,1|C<4>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8165	0.056	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ni<6>,1|C<4>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.7160	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Os<6>,1|C<4>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.5670	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Os<7>,1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Os<7>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.6200	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Os<7>,1|C<4>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8585	0.432	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Os<7>,1|C<4>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Os<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.7710	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Os<8>,1|C<4>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8790	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ru<7>,1|C<4>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<7>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.2030	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Si<4>,1|C<4>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.8170	0.088	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Si<4>,1|C<4>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7830	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Si<4>,1|C<4>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mo<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.9270	0.026	3	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Si<5>,1|C<4>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5945	0.200	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Sm<9>,1|C<4>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Sm<9>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.4530	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Sn<6>,1|C<4>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Sn<6>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.0175	0.036	4	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Th<19>,1|N<4>,2|C<4>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Th<19>,1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.8380	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ti<8>,1|C<4>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ti<8>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.5345	0.173	4	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|U<11>,1|C<4>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|U<11>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1540	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Yb<14>,1|C<4>,1|C<5>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Yb<14>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.7090	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Yb<9>,1|C<4>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Yb<9>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.1710	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Zr<13>,1|C<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zr<13>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8690	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Zr<16>,1|C<3>,1|N<4>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zr<16>,1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.9920	0.033	2	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Zr<9>,1|C<4>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zr<9>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8840	0.000	1	120.2823	0.647	9843	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]F)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|F<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]F)(H){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2173	0.184	4	120.2026	0.045	23	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]F)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|F<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]F)(H){1|Ru<9>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0550	0.062	2	120.2026	0.045	23	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]F)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|F<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]F)(H){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1940	0.365	2	120.2026	0.045	23	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]F)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|F<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]F)(H){1|Fe<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0080	0.041	2	120.2026	0.045	23	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]F)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|F<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]F)(H){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1545	0.204	6	120.2026	0.045	23	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]F)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|F<1>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]F)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.0915	0.063	2	120.2026	0.045	23	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]F)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|F<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]F)(H){1|Ir<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3645	0.084	4	120.2026	0.045	23	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]F)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|F<1>,1|N<3>,1|P<4>}	C[6](C[6]C[6]H)(C[6]N[6]F)(H){1|Cu<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7090	0.000	1	120.2026	0.045	23	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Al<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Li<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4507	0.225	6	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Al<5>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Al<5>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.7617	0.163	3	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|B<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0914	0.097	5	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|B<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5597	0.255	18	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|B<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3830	0.045	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|B<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mg<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4374	0.163	9	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|B<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4475	0.283	4	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|B<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5960	0.233	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|B<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3719	0.136	8	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|B<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6765	0.200	8	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|B<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<9>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7310	0.174	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Br<1>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.5530	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Br<1>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1207	2.414	11	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Br<2>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9110	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<2>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6893	0.045	4	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<2>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.3575	0.218	8	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<2>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8440	0.297	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<2>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1965	0.117	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<2>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2070	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<2>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5192	0.267	4	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<2>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1648	0.383	5	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<2>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3470	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<2>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.0230	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ag<3>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1646	0.451	5	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ag<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3898	0.460	38	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ag<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5941	0.721	8	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ag<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6475	0.110	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Al<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.7180	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Al<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2056	0.280	22	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Al<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6592	0.795	10	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Au<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2284	0.405	25	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Au<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3030	0.334	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<3>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0940	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6413	0.219	7	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ba<12>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1285	0.029	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Bi<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.7225	0.179	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Bi<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3587	0.176	3	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Bi<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1225	0.019	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.3512	0.975	46	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	120.8312	1.820	23	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.5558	0.221	26	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|V<5>}	H(C[6]C[6]2)	120.7498	1.276	4	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|V<6>}	H(C[6]C[6]2)	120.1932	0.439	23	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|V<7>}	H(C[6]C[6]2)	120.3405	0.402	4	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|V<8>}	H(C[6]C[6]2)	120.3032	0.149	4	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|W<6>}	H(C[6]C[6]2)	120.5549	0.324	11	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|W<8>}	H(C[6]C[6]2)	120.4985	0.121	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9259	0.752	250	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ca<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4678	0.129	5	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cd<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1979	0.536	39	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cd<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1603	0.551	104	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cd<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1590	0.310	6	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cd<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3550	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6545	1.058	28	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4168	0.440	35	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3265	0.691	696	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2039	0.915	33	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2772	0.107	6	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cr<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5480	0.041	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cr<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	118.9702	2.980	4	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cr<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3699	0.980	93	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cr<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3628	0.251	6	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<3>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.8217	0.856	11	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4049	0.501	226	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3374	0.863	445	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3411	0.611	84	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3025	0.045	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Eu<10>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2695	1.123	4	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Eu<11>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4030	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Eu<13>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6200	0.024	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Eu<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4769	0.338	12	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2485	0.439	11	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5377	0.645	36	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4348	0.865	560	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4715	0.147	4	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4560	0.395	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3680	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Hg<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1840	0.309	8	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Hg<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9919	0.392	9	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|In<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0580	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6065	0.449	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2990	0.538	1008	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3412	0.473	59	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3420	0.540	98	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<9>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.1260	1.222	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Li<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3575	0.114	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Li<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3135	0.171	4	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mg<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0305	0.179	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mg<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3757	0.260	4	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mg<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3440	0.417	3	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3962	0.139	5	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2007	1.147	35	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3232	0.666	421	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.1650	2.571	16	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5344	0.319	8	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2824	0.832	59	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6484	0.397	8	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4165	0.274	11	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<9>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.0527	0.902	3	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Nd<12>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.8385	0.151	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5807	0.962	81	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3396	0.291	22	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3114	0.865	637	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5396	0.930	10	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Os<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1435	0.207	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Os<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4003	0.579	216	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Os<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6488	0.182	5	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Os<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5098	0.230	5	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Os<9>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4699	0.283	10	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pb<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.8880	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<3>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3105	0.029	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3622	0.802	374	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3412	0.658	6	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2997	0.221	10	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4805	0.245	8	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2960	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3087	0.608	722	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0542	0.613	15	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2932	1.411	109	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5940	0.557	9	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4451	0.674	297	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3420	0.021	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4500	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.9697	0.732	7	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2112	0.318	12	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3485	0.406	32	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5493	0.237	6	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4898	0.301	83	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<9>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5892	0.066	4	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<10>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4785	0.134	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3152	0.453	13	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4283	0.713	937	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7435	0.588	29	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3746	0.349	30	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<9>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4468	0.270	80	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sb<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1220	0.713	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sm<10>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9865	1.197	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sm<13>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.9405	0.278	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sm<14>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7350	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sm<15>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4635	0.531	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sm<9>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6387	0.204	3	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sn<3>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8609	0.372	14	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1632	0.406	10	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2245	0.252	29	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sn<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4098	0.196	4	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sn<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3250	0.111	4	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sr<12>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0535	0.036	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Te<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.5460	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Te<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6250	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ti<11>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6075	0.039	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ti<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.7290	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<3>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7480	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2312	0.740	118	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2609	0.305	176	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3618	0.985	175	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zr<13>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6170	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zr<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3815	0.340	4	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Al<4>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.1555	0.206	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.3010	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.3050	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ag<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3156	0.390	14	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Al<3>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.8880	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Al<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3290	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Al<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2870	0.000	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Al<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2960	0.081	3	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Au<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8100	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.8325	0.122	8	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.2036	1.316	5	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.1114	0.507	29	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|D<1>,1|H<1>}	H(C[6]C[6]2)	119.8770	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8520	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	120.6710	0.541	38	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<3>}	H(C[6]C[6]2)	120.5060	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|V<5>}	H(C[6]C[6]2)	121.0985	0.745	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|V<6>}	H(C[6]C[6]2)	120.2913	0.252	14	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|V<7>}	H(C[6]C[6]2)	120.2257	0.234	6	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9667	0.412	144	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ca<10>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4510	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ca<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5325	0.225	6	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2753	0.171	3	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cd<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5155	0.490	13	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cd<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4507	0.320	35	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cd<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2230	0.944	3	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4401	0.709	17	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3673	0.248	49	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3581	0.474	289	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2105	0.441	11	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.8660	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cr<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6025	0.105	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cr<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.4610	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cr<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0950	1.077	43	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cr<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3310	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cr<9>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.9053	0.403	3	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<2>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5793	0.021	3	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<3>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4968	0.412	16	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3615	0.584	132	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3804	1.091	354	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5383	0.742	26	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Eu<13>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0150	0.460	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Eu<9>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7985	0.339	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1936	1.097	10	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4927	1.041	40	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4151	0.423	851	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4468	0.236	13	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3787	1.432	3	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ga<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4330	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.2030	0.211	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Hg<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4700	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Hg<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3790	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|In<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3310	0.187	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.0113	0.365	3	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3912	0.574	51	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5387	0.133	3	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4532	0.408	33	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Li<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5742	0.273	10	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Li<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4304	0.231	5	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mg<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3440	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mg<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.6560	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mg<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6224	0.177	7	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3273	0.217	13	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4347	0.887	242	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5183	0.291	39	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7885	0.025	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6148	0.833	21	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2240	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5883	2.626	16	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4407	0.369	33	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3663	1.369	39	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3998	0.667	320	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4754	0.373	17	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Os<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.8824	0.953	7	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Os<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.7010	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Os<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6066	0.331	7	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Os<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6755	0.057	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Os<9>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5220	0.083	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3480	0.552	170	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.5703	1.169	4	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4044	0.300	7	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7770	0.098	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3870	1.160	75	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3480	0.054	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2273	0.367	18	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2700	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2408	1.792	90	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5010	0.355	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.3593	1.608	7	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4842	1.288	19	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4580	0.150	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3089	0.488	14	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1100	1.486	23	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5567	0.625	123	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.1190	0.924	8	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6950	0.197	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<9>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4516	0.455	22	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.7639	0.510	9	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sr<10>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5445	0.036	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ta<10>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6220	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Tc<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5765	0.019	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Tc<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.2430	1.524	4	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4554	0.316	62	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2985	0.753	136	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2700	0.535	75	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.0740	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Li<4>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.7850	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<5>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	123.6920	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<5>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7668	0.475	6	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<5>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1480	0.112	4	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<5>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	124.3780	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<5>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3440	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<5>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9765	0.421	4	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<5>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<10>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6070	0.204	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<5>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ti<10>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3160	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<6>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.4190	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ce<16>,1|H<1>,1|N<4>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ce<16>,1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.0584	0.265	8	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Cl<1>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.2745	0.180	4	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Cl<1>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9876	0.508	8	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Cl<1>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7890	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Cl<1>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2240	0.677	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Co<6>,1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<6>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.0640	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Co<7>,1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<7>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.0820	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Cr<8>,1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cr<8>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.5400	0.251	5	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Cu<5>,1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<5>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.7860	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Er<15>,1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Er<15>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.2913	0.278	3	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|F<1>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.0505	0.063	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Fe<5>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9430	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Fe<7>,1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<7>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.3950	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|I<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	120.4883	0.404	3	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|I<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8474	0.339	7	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Al<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5008	0.038	4	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.9167	0.254	11	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	120.2630	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.3353	2.121	21	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2975	0.752	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1933	0.109	4	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1725	0.216	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cr<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3698	0.383	6	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.4735	0.272	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6367	0.509	3	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1580	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0887	0.052	3	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1320	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4627	0.141	4	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5618	0.373	5	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1647	0.216	11	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2895	0.093	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.8383	1.040	14	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Os<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5372	0.388	9	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Os<9>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5205	0.149	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.7077	0.308	6	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.0489	0.512	9	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3760	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5265	0.663	15	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0080	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1085	0.349	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1655	0.435	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3580	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.8676	0.471	14	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3365	0.080	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<9>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3260	0.165	3	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1518	0.118	6	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0775	0.036	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4990	0.185	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<2>,1|H<1>}	H(C[6]C[6]2)	119.4630	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|N<4>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	116.6835	1.358	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|N<4>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.3630	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.8263	0.249	4	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|I<3>}	H(C[6]C[6]2)	119.7160	0.127	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|W<9>}	H(C[6]C[6]2)	120.0380	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.5792	0.224	17	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3570	0.184	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0920	0.335	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9000	0.304	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2970	0.066	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.8690	0.010	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Hg<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1515	0.060	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.8980	0.973	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1560	0.369	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<9>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2110	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Os<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0820	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3662	0.346	8	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.7290	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4460	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.3360	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<9>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9570	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|P<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ag<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.9330	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|P<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|W<6>}	H(C[6]C[6]2)	120.4070	0.134	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|P<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7763	0.123	11	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|P<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5897	0.966	4	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|P<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Li<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2825	0.197	4	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|P<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6440	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|P<4>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ag<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1287	0.170	3	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|P<4>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.3700	0.163	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|P<4>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.3390	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|P<4>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0844	0.360	7	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|P<4>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6775	0.388	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|P<4>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.9087	2.332	3	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|P<4>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<3>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4370	0.080	4	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|P<4>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4677	0.328	86	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|P<4>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4180	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|P<4>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7897	0.114	3	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|P<4>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7953	0.540	3	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|P<4>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.8875	0.343	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|P<4>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4905	0.349	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|P<4>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3770	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|P<4>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5330	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|P<4>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<9>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3290	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|P<5>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.4250	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.8860	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	118.5660	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.0990	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Si<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.7563	0.346	3	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>,1|W<8>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<4>,1|H<1>,1|W<8>}	H(C[6]C[6]2)	119.9327	0.147	4	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>,1|W<9>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<4>,1|H<1>,1|W<9>}	H(C[6]C[6]2)	119.7135	0.524	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2886	0.357	9	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.3427	0.239	3	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	119.2850	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3840	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	120.2073	0.376	21	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	121.4739	4.010	15	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.6873	0.392	26	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5683	0.367	3	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4760	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cr<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3580	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.0760	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4845	0.326	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8030	0.419	4	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1940	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<9>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.2235	0.736	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0830	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9035	0.120	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2963	0.187	7	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5890	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6032	0.413	5	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Si<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0100	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2947	0.261	9	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sn<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2200	0.189	6	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.5980	0.241	3	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6890	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1590	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	121.4733	2.340	3	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4890	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9810	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<9>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8685	0.135	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8808	0.176	4	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5060	0.158	3	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.8100	0.229	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<4>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1670	0.173	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<2>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	121.7700	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<5>,1|C<2>,1|H<1>}	H(C[6]C[6]2)	119.5240	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<2>,1|H<1>}	H(C[6]C[6]2)	116.9210	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<5>,1|C<2>,1|H<1>}	H(C[6]C[6]2)	122.3200	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|W<7>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<4>,1|H<1>,1|W<7>}	H(C[6]C[6]2)	119.5513	0.527	3	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ag<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2789	0.375	7	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Al<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2310	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Al<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.4660	0.195	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Al<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.6470	0.095	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<3>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.5290	0.225	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1775	0.155	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0715	0.663	4	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.1283	0.421	25	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	120.1995	0.344	15	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.0386	0.161	8	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|W<6>}	H(C[6]C[6]2)	119.9330	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.6337	0.813	207	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ca<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0450	0.075	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9315	0.120	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cd<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1640	0.034	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cd<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1085	0.084	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cd<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9467	0.244	3	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1907	0.347	22	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2660	0.249	137	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2697	0.552	22	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1848	0.242	9	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1815	0.162	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cr<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2209	0.280	23	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cr<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0803	0.224	23	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cr<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3185	0.053	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<3>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1295	0.256	6	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2096	0.239	32	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4381	1.277	42	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3284	0.132	16	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1366	0.112	12	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2033	0.289	12	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3869	0.346	93	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.3650	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1242	0.573	20	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2025	0.245	10	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Li<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0265	0.067	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Li<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8590	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mg<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.5670	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9978	0.135	6	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2332	0.199	4	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1758	0.339	20	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9512	0.743	5	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1630	0.214	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<9>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0100	0.445	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2261	0.372	8	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1804	0.292	34	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7219	1.026	14	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1783	0.142	4	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Os<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2242	0.493	15	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Os<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3083	0.121	3	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Os<9>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6080	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1145	0.321	75	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4171	0.623	7	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2354	0.089	5	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2372	0.470	51	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0530	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3055	0.369	4	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2499	0.452	41	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2720	0.344	23	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1311	0.288	8	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0913	0.200	3	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1352	0.539	36	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2238	0.523	23	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2349	0.260	10	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.8359	1.454	18	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<9>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7396	1.386	20	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.6980	0.144	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1902	0.471	38	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9779	0.403	13	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4100	0.120	3	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Hf<10>,1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Hf<10>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.9270	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ir<6>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.8890	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ir<6>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.5920	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ir<7>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<7>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.9670	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ir<7>,1|H<1>,1|N<3>,1|N<4>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<7>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.4130	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ir<7>,1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<7>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.2280	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ir<7>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.1710	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ir<7>,1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<7>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.8040	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ir<9>,1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<9>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.9380	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Li<5>,1|H<1>,1|N<3>,1|N<4>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Li<5>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.2065	0.842	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Mg<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Li<3>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.8940	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Mg<5>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mg<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.9820	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Mn<7>,1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<7>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.3800	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Mo<6>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0760	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ag<3>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0795	0.039	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ag<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2915	0.028	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ag<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3587	0.319	6	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Al<3>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4520	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Al<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4619	0.284	29	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Al<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.8700	0.137	9	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Au<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5965	0.023	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<3>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4200	0.789	24	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5650	0.910	154	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5291	0.535	13	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9655	0.669	4	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ba<13>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.9067	0.170	3	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ba<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1633	0.190	3	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Be<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.8067	0.039	4	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Bi<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3598	0.048	4	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Bi<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.8680	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.3132	0.726	627	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<5>,1|H<1>}	H(C[6]C[6]2)	120.2793	0.073	4	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|D<1>,1|H<1>}	H(C[6]C[6]2)	119.8010	0.011	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|F<1>,1|H<1>}	H(C[6]C[6]2)	120.3100	0.006	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|I<1>}	H(C[6]C[6]2)	120.5505	0.026	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|I<2>}	H(C[6]C[6]2)	120.4919	0.336	34	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|I<3>}	H(C[6]C[6]2)	120.6180	0.038	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.1646	0.707	49	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	120.7103	0.533	39	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.5983	0.387	41	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<3>}	H(C[6]C[6]2)	120.3885	0.015	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|P<4>}	H(C[6]C[6]2)	120.1586	0.437	17	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|U<8>}	H(C[6]C[6]2)	120.8516	0.299	7	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|V<5>}	H(C[6]C[6]2)	120.5892	0.092	9	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|V<6>}	H(C[6]C[6]2)	120.6735	0.135	12	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|W<6>}	H(C[6]C[6]2)	120.4336	0.709	19	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|W<7>}	H(C[6]C[6]2)	120.4098	0.238	6	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|W<8>}	H(C[6]C[6]2)	120.6610	0.150	6	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|W<9>}	H(C[6]C[6]2)	119.5050	0.438	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0475	0.726	474	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ca<12>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4322	0.045	4	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ca<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5550	0.109	3	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6126	0.265	12	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cd<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3672	0.231	9	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cd<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6240	0.423	32	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<3>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6110	0.040	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2448	0.570	17	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5552	0.869	16	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6470	0.580	253	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7036	0.151	5	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cr<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6842	0.245	6	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cr<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6155	0.308	20	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cr<9>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.2070	0.017	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<3>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6644	0.211	7	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5135	0.887	124	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5426	0.518	120	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6938	0.278	27	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6976	0.167	20	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7303	0.208	58	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6341	0.594	109	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7103	0.088	4	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.0103	1.967	15	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ga<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4138	1.408	23	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ga<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7230	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ge<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2690	0.045	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.2691	1.686	41	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|In<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4914	0.504	8	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|In<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4981	0.205	17	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<3>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.2335	0.057	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6155	0.496	57	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.0315	1.708	8	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Li<3>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4963	0.253	10	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Li<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6294	0.377	43	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Li<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.9700	0.021	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mg<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5713	0.941	19	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mg<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1998	0.171	6	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mg<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5003	0.343	15	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<3>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3320	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5637	0.416	15	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4948	0.129	11	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6945	0.808	78	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5980	0.279	23	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<9>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3207	0.732	3	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.8837	0.314	7	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7899	0.381	42	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5250	0.042	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<9>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.8796	0.085	10	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Nb<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4153	0.448	4	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Nb<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5457	0.273	16	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Nb<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.8906	0.397	14	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Nb<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.8730	0.092	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<3>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5900	0.066	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6251	0.254	98	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6673	0.245	21	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7140	0.362	173	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.9496	0.621	7	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Np<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5602	0.086	4	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Os<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.7230	0.038	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Os<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.8441	0.619	9	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Os<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.8500	0.405	3	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Os<9>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4808	0.282	4	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5222	0.839	394	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1086	0.554	10	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5492	0.408	112	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3330	0.226	8	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6929	0.342	19	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pu<11>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7087	0.098	4	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pu<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.5530	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5676	2.015	24	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.8561	0.396	75	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0565	1.090	11	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2537	0.997	7	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7391	1.322	50	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6358	0.723	9	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5938	1.427	34	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7608	0.589	177	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.2185	0.033	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7599	0.094	12	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<9>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6603	0.908	10	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sc<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.9940	0.045	4	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sc<9>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7495	0.028	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Si<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.8380	0.324	4	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Si<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7060	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sm<12>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4185	0.329	4	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sm<14>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4393	0.363	4	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2422	0.255	6	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sn<9>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3410	0.195	4	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sr<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3930	0.085	4	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sr<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4450	0.177	6	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ta<10>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5155	0.111	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ta<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.0198	0.652	5	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Tc<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7501	0.629	21	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ti<10>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5158	0.161	6	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ti<12>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.8055	0.223	11	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ti<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4583	0.202	9	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ti<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7954	0.268	28	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ti<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6548	0.108	11	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ti<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5706	0.112	14	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ti<9>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7345	0.784	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|V<11>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6640	0.025	4	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4533	0.627	68	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5521	0.506	113	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6656	0.234	26	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zr<10>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6610	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zr<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6800	0.096	3	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zr<9>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5190	0.136	3	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,3|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mg<4>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.6260	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,3|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mg<5>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.3010	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Os<10>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Os<10>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.2710	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Os<8>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Os<8>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.0817	0.104	3	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Re<8>,1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<8>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.0910	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Rh<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Al<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5240	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Rh<6>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.4235	0.104	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Rh<6>,1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<6>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.8625	0.104	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Rh<9>,1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<9>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.4710	0.450	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ru<10>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<10>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.0910	0.198	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ru<10>,1|H<1>,1|N<4>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<10>,1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.4600	0.049	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ru<6>,1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<6>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.8140	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ru<7>,1|H<1>,1|N<3>,1|N<4>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<7>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.0450	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ru<7>,1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<7>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.4810	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ru<7>,1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<7>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.3595	0.054	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ru<8>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<8>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.7770	0.262	3	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ru<8>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.5890	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ru<8>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	125.2650	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ru<9>,1|H<1>,1|N<3>,1|N<4>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<9>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.6950	0.059	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ru<9>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2420	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Sc<13>,1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sc<13>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	118.4540	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Se<1>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9370	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Se<2>,1|H<1>,1|N<3>,1|W<9>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<4>,1|H<1>,1|W<9>}	H(C[6]C[6]2)	120.3415	0.132	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Se<2>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	120.2690	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Se<2>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1460	0.016	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Se<2>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.7410	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Se<2>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.0490	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Se<2>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2070	0.444	3	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Si<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Al<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4950	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Si<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4895	0.419	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Si<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6545	0.292	10	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Si<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.8688	0.364	6	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Si<5>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.1280	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Si<5>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1668	0.317	8	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Sn<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Al<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7168	0.486	6	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Sn<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Al<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6965	0.559	4	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ta<10>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ta<10>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.6815	0.101	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Th<14>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Th<14>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.5410	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ti<10>,1|C<5>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ti<10>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.9380	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ti<11>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ti<11>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.7220	0.006	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ti<7>,1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ti<7>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.5870	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ti<9>,1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ti<9>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.7380	0.085	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|U<11>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|U<11>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8930	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|U<13>,1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|U<13>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.0290	0.182	4	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Yb<15>,1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Yb<15>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.7050	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Zr<13>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zr<13>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0360	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Zr<14>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zr<14>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.8543	0.238	3	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Zr<8>,1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zr<8>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.4305	0.120	2	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){3|Ru<9>,1|H<1>,1|N<4>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){2|Ru<9>,1|C<5>,1|H<1>}	H(C[6]C[6]2)	119.7610	0.000	1	120.3728	0.551	19783	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]I)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|I<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]I)(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	120.4437	0.426	3	120.0516	0.181	10	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]I)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|I<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]I)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8836	0.317	7	120.0516	0.181	10	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Al<5>,1|N<2>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Al<5>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	118.8140	0.000	1	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Al<5>,3|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Al<5>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.1040	0.127	3	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Al<7>,1|N<2>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Al<7>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.0820	0.054	2	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Br<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ir<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5520	0.000	1	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Br<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.4705	0.347	6	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Br<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ir<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4470	0.000	1	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.7223	0.120	3	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9556	0.143	5	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2520	0.000	1	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6080	0.000	1	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|N<4>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9890	0.000	1	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|N<5>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2380	0.000	1	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.3180	0.000	1	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Co<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	118.8953	0.673	3	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0173	0.341	19	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Li<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3950	0.059	2	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Li<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4640	0.000	1	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Mn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9755	0.090	2	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.6720	0.000	1	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8151	0.422	14	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Os<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1035	0.090	2	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.7192	0.268	6	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Pt<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9928	0.356	27	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Re<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9163	0.232	6	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Rh<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5540	0.000	1	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.7297	0.285	4	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0980	0.000	1	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<9>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.0380	0.327	2	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Zn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.7607	0.374	3	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Zn<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0380	0.120	2	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Zn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1975	0.029	2	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Al<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3190	0.000	1	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.3290	0.747	3	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.3276	2.245	5	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Fe<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5150	0.116	2	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Fe<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4985	0.577	4	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ir<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7650	0.282	5	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Mn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.3950	0.000	1	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.7877	0.293	3	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0340	0.000	1	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7060	0.424	2	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7377	0.135	6	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.1740	0.295	4	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.9427	0.222	6	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.1430	0.020	2	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<9>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.0020	0.000	1	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Zn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.5580	0.000	1	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Zn<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0242	0.976	4	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,1|N<4>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Li<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4030	0.000	1	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,1|N<5>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Os<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.7030	0.000	1	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,1|N<5>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.9300	0.164	2	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	119.0440	0.000	1	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.3376	0.501	50	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Co<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2100	0.000	1	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Co<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	117.9540	0.000	1	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9288	0.278	9	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Co<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3705	0.023	2	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.4180	1.235	14	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Fe<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9713	0.286	3	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1130	0.042	2	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Li<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8790	0.000	1	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Mn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.2360	0.000	1	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1715	0.188	13	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1562	0.662	5	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Sn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.5930	0.140	2	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Zn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8097	0.052	3	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Zn<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0078	0.442	19	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Zn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9590	0.438	2	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Cl<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Os<9>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5260	0.000	1	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Cl<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	116.7770	0.000	1	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|F<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ir<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3632	0.110	4	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Al<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4818	0.086	4	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.9755	0.242	11	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	120.2480	0.000	1	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.5703	2.084	21	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Co<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.8700	0.018	2	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1792	0.170	4	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Co<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2425	0.405	2	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cr<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2857	0.297	8	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cu<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.6065	0.598	2	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9557	0.506	3	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Fe<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2220	0.000	1	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1327	0.137	3	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ir<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0860	0.000	1	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ir<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4722	0.106	5	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Mn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5672	0.367	5	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Mo<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1367	0.263	11	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Mo<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2580	0.127	2	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9681	1.122	14	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Os<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4015	0.320	8	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Os<9>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4400	0.037	2	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9988	0.411	6	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Pt<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.0217	0.508	9	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Pt<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3740	0.000	1	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Re<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1282	0.877	14	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Re<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0700	0.000	1	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Rh<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0940	0.192	3	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Rh<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0747	0.349	3	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Rh<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3620	0.000	1	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.8857	0.388	15	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3285	0.018	2	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<9>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3890	0.223	3	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Zn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1607	0.142	7	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Zn<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9640	0.115	2	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Zn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4155	0.142	2	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|N<4>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	122.4935	1.339	2	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|N<4>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Zn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.3600	0.000	1	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ag<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1444	0.476	8	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Al<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2940	0.000	1	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Al<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.5625	0.185	2	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Al<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.5985	0.136	2	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|B<3>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.5225	0.353	2	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1285	0.146	2	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|B<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.4145	0.616	4	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.1333	0.449	23	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	120.1107	0.217	13	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.0187	0.227	8	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,1|H<1>,1|W<6>}	H(C[6]C[6]2)	119.8620	0.000	1	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.5784	0.778	207	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ca<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1545	0.132	2	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9090	0.122	2	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cd<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1815	0.033	2	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cd<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9725	0.052	2	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cd<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0820	0.093	3	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Co<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1610	0.343	22	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Co<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2586	0.246	122	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2614	0.428	22	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Co<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1955	0.220	10	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Co<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0075	0.146	2	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cr<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1748	0.257	22	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cr<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0978	0.258	23	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cr<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2995	0.042	2	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cu<3>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1032	0.263	5	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cu<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2507	0.204	31	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8895	1.261	42	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cu<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3424	0.165	16	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Fe<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1338	0.126	12	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Fe<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2302	0.280	11	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4021	0.357	78	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.3230	0.000	1	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ir<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8549	0.396	15	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ir<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9560	0.000	1	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Li<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9730	0.151	2	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Li<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.7490	0.000	1	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Mg<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.5360	0.000	1	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Mn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9805	0.113	6	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Mn<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2025	0.136	2	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Mn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1711	0.336	15	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Mn<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2754	0.597	5	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Mo<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1630	0.215	2	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Mo<9>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1140	0.491	2	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2336	0.375	10	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1837	0.273	34	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0149	1.016	15	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0902	0.231	4	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Os<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1991	0.482	15	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Os<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2333	0.079	3	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1607	0.347	51	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Pd<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4393	0.636	7	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Pd<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4160	0.000	1	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Pt<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2444	0.490	45	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Pt<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0370	0.000	1	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Pt<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4706	0.563	5	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Re<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3578	0.391	26	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Rh<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2834	0.390	23	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Rh<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1798	0.427	5	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0872	0.558	37	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4934	0.529	8	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1325	0.255	10	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.1692	1.597	13	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<9>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.7628	1.472	12	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Sn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.7055	0.046	2	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Zn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0514	0.473	37	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Zn<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9618	0.379	13	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Zn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3427	0.122	4	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Li<5>,3|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Li<5>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.2170	0.000	1	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<2>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4460	0.000	1	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Re<6>,1|C<2>,1|H<1>}	H(C[6]C[6]2)	120.3310	0.000	1	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<2>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.5013	0.117	3	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<2>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	118.9574	2.325	21	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<2>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cr<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.7590	0.000	1	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<2>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9018	0.293	6	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<2>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.1208	0.059	4	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<2>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Rh<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.1650	0.069	2	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<2>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8767	0.281	3	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.5675	0.009	2	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	118.7292	0.736	6	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cr<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8850	0.000	1	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.4485	0.083	2	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Li<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7520	0.040	2	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.8597	0.346	3	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Sn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6425	0.045	2	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Zn<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1870	0.000	1	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<4>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.5825	0.015	2	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<4>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.2417	0.294	3	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ni<5>,1|N<4>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<5>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	118.6785	0.257	2	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|O<2>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1500	0.000	1	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Pd<4>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.4620	0.000	1	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Pd<5>,3|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Pd<5>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.1750	0.000	1	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ru<7>,1|C<4>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<7>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.1045	0.049	2	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ru<7>,1|N<2>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<7>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.2360	0.000	1	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ru<8>,1|C<4>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<8>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.5920	0.096	2	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ru<9>,1|C<5>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<9>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.1230	0.000	1	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|S<2>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.7290	0.000	1	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ta<9>,3|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ta<9>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.0740	0.144	2	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Yb<14>,1|N<2>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Yb<14>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.7190	0.000	1	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){3|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.4674	0.172	8	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){3|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,1|H<1>,1|W<6>}	H(C[6]C[6]2)	119.8685	0.033	2	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){3|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,1|H<1>,1|W<7>}	H(C[6]C[6]2)	119.3418	0.074	5	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){3|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	118.8995	0.842	99	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){3|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cd<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3630	0.049	2	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){3|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Co<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.5352	0.167	4	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){3|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Co<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.7277	0.189	11	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){3|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9802	0.407	8	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){3|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cr<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8554	0.327	10	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){3|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cu<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.4101	0.320	15	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){3|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.5747	0.131	4	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){3|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cu<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.5250	0.021	2	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){3|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Fe<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.5760	0.220	7	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){3|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Fe<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.6867	0.118	7	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){3|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.6671	0.322	40	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){3|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Fe<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.5607	0.303	6	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){3|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ir<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4890	0.000	1	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){3|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Li<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.5870	0.423	4	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){3|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Mo<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.6813	0.120	12	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){3|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Mo<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.6787	0.088	6	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){3|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.5204	0.226	20	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){3|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.3952	0.375	9	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){3|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0182	0.251	10	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){3|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.6495	0.013	2	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){3|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Re<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.0870	0.081	2	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){3|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Rh<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.6668	0.453	5	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){3|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.4265	0.078	2	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){3|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.3195	0.117	4	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){3|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Zn<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8380	0.047	2	119.9208	0.592	2026	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.7735	0.046	2	119.9124	0.413	240	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Cd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.7770	0.000	1	119.9124	0.413	240	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Cd<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.4660	0.206	3	119.9124	0.413	240	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Cd<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8065	0.199	2	119.9124	0.413	240	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Cu<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.7152	0.131	5	119.9124	0.413	240	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8882	0.199	6	119.9124	0.413	240	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Cu<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.7920	0.232	2	119.9124	0.413	240	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Fe<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9800	0.871	2	119.9124	0.413	240	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2880	0.000	1	119.9124	0.413	240	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Ir<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9800	0.359	9	119.9124	0.413	240	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Mn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2022	0.116	13	119.9124	0.413	240	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Ni<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8653	0.246	4	119.9124	0.413	240	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3190	0.153	4	119.9124	0.413	240	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3810	0.201	2	119.9124	0.413	240	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Pt<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0088	0.394	4	119.9124	0.413	240	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Ru<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0488	0.423	5	119.9124	0.413	240	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Ru<9>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2405	0.032	2	119.9124	0.413	240	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Sn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	122.1210	0.115	2	119.9124	0.413	240	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Zn<3>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.7610	0.000	1	119.9124	0.413	240	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Zn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.6866	0.733	14	119.9124	0.413	240	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<2>,1|O<1>}	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9930	0.000	1	119.9124	0.413	240	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Al<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.4780	0.000	1	119.9124	0.413	240	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.5305	0.303	2	119.9124	0.413	240	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Cu<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2303	2.150	7	119.9124	0.413	240	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3038	0.171	5	119.9124	0.413	240	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0502	0.238	6	119.9124	0.413	240	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Mn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0215	0.043	2	119.9124	0.413	240	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Rh<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1375	0.329	4	119.9124	0.413	240	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Ru<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3195	0.172	2	119.9124	0.413	240	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Ru<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7684	0.185	5	119.9124	0.413	240	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Cl<1>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.1990	0.000	1	119.9124	0.413	240	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.8383	0.217	4	119.9124	0.413	240	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|C<3>,1|H<1>,1|I<3>}	H(C[6]C[6]2)	119.8650	0.000	1	119.9124	0.413	240	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|C<3>,1|H<1>,1|W<9>}	H(C[6]C[6]2)	120.1820	0.000	1	119.9124	0.413	240	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.5396	0.247	18	119.9124	0.413	240	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4065	0.303	2	119.9124	0.413	240	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Co<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1315	0.374	2	119.9124	0.413	240	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Cu<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9475	0.282	2	119.9124	0.413	240	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2830	0.000	1	119.9124	0.413	240	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.8087	0.073	3	119.9124	0.413	240	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Hg<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1950	0.099	2	119.9124	0.413	240	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Ir<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.8110	1.121	2	119.9124	0.413	240	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Ir<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1790	0.557	2	119.9124	0.413	240	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Mo<9>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0340	0.000	1	119.9124	0.413	240	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Os<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0650	0.000	1	119.9124	0.413	240	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3749	0.372	8	119.9124	0.413	240	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Pt<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.4980	0.000	1	119.9124	0.413	240	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Re<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5050	0.000	1	119.9124	0.413	240	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Rh<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.4980	0.000	1	119.9124	0.413	240	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Ru<9>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9925	0.054	2	119.9124	0.413	240	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ir<6>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.0060	0.000	1	119.9124	0.413	240	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<2>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Ru<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4770	0.303	2	119.9124	0.413	240	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,1|O<2>,1|S<3>}	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Rh<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	123.2700	0.000	1	119.9124	0.413	240	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|C<3>,1|H<1>,1|W<6>}	H(C[6]C[6]2)	119.6065	0.053	2	119.9124	0.413	240	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Co<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.7550	0.287	4	119.9124	0.413	240	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.1382	0.482	5	119.9124	0.413	240	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Ir<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.6313	0.193	7	119.9124	0.413	240	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Mo<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.6490	0.149	4	119.9124	0.413	240	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Ni<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.4260	0.034	2	119.9124	0.413	240	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.5192	0.142	4	119.9124	0.413	240	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Pt<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.2625	0.280	4	119.9124	0.413	240	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Re<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.5547	0.061	3	119.9124	0.413	240	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Rh<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.5672	0.385	14	119.9124	0.413	240	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Ru<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.7212	0.276	8	119.9124	0.413	240	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|O<2>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Ir<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.7220	0.119	3	119.9124	0.413	240	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|O<2>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Ru<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9120	0.000	1	119.9124	0.413	240	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|P<3>}	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Fe<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1410	0.028	2	120.3828	0.386	192	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|P<3>}	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Re<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	116.0740	0.000	1	120.3828	0.386	192	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|P<4>}	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Al<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9390	0.273	9	120.3828	0.386	192	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|P<4>}	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2000	0.000	1	120.3828	0.386	192	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|P<4>}	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Zn<3>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	117.5420	0.000	1	120.3828	0.386	192	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|P<4>}	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Zn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9280	0.000	1	120.3828	0.386	192	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,1|P<3>}	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Mo<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.9837	0.448	3	120.3828	0.386	192	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,1|P<3>}	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Zn<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0965	0.098	4	120.3828	0.386	192	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,1|P<4>}	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7330	0.000	1	120.3828	0.386	192	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,1|P<4>}	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Cu<3>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4295	0.233	11	120.3828	0.386	192	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,1|P<4>}	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Cu<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5763	0.054	3	120.3828	0.386	192	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,1|P<4>}	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Li<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.8270	0.000	1	120.3828	0.386	192	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,1|P<4>}	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Mo<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.9200	0.000	1	120.3828	0.386	192	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,1|P<4>}	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Mo<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5135	0.172	2	120.3828	0.386	192	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|F<1>,1|N<3>,1|P<4>}	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Cu<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7260	0.000	1	120.3828	0.386	192	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|P<3>}	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Ag<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.8730	0.000	1	120.3828	0.386	192	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|P<3>}	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|C<3>,1|H<1>,1|W<6>}	H(C[6]C[6]2)	120.2840	0.115	2	120.3828	0.386	192	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|P<3>}	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7990	0.145	12	120.3828	0.386	192	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|P<3>}	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.7463	0.658	4	120.3828	0.386	192	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|P<3>}	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Li<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2812	0.158	4	120.3828	0.386	192	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|P<3>}	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Zn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6270	0.000	1	120.3828	0.386	192	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|P<4>}	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Ag<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1687	0.234	3	120.3828	0.386	192	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|P<4>}	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.3795	0.204	2	120.3828	0.386	192	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|P<4>}	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.4620	0.000	1	120.3828	0.386	192	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|P<4>}	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1771	0.239	7	120.3828	0.386	192	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|P<4>}	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Co<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6940	0.427	2	120.3828	0.386	192	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|P<4>}	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	118.9823	2.682	3	120.3828	0.386	192	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|P<4>}	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Cu<3>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4847	0.150	3	120.3828	0.386	192	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|P<4>}	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Cu<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4752	0.329	85	120.3828	0.386	192	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|P<4>}	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Fe<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3450	0.000	1	120.3828	0.386	192	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|P<4>}	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.8067	0.106	3	120.3828	0.386	192	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|P<4>}	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3250	0.000	1	120.3828	0.386	192	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|P<4>}	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Ir<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.8280	0.476	3	120.3828	0.386	192	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|P<4>}	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Ir<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5555	0.750	2	120.3828	0.386	192	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|P<4>}	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4730	0.378	2	120.3828	0.386	192	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|P<4>}	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Rh<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4590	0.000	1	120.3828	0.386	192	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|P<4>}	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Rh<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.4330	0.000	1	120.3828	0.386	192	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|P<4>}	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Ru<9>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4180	0.000	1	120.3828	0.386	192	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|P<5>}	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.4840	0.000	1	120.3828	0.386	192	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|P<4>}	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Fe<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4167	0.080	4	120.3828	0.386	192	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|S<1>}	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9580	0.589	3	119.9551	3.451	191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.0010	0.262	2	119.9551	3.451	191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3845	0.142	2	119.9551	3.451	191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,1|S<1>}	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.4435	0.021	2	119.9551	3.451	191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3940	0.293	2	119.9551	3.451	191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3845	0.180	2	119.9551	3.451	191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<1>}	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.9010	0.000	1	119.9551	3.451	191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<1>}	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	118.2880	0.000	1	119.9551	3.451	191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<1>}	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.1500	0.000	1	119.9551	3.451	191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<1>}	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Si<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.7480	0.281	3	119.9551	3.451	191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2717	0.326	7	119.9551	3.451	191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.1800	0.272	4	119.9551	3.451	191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	119.2940	0.000	1	119.9551	3.451	191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3690	0.000	1	119.9551	3.451	191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	120.1213	0.309	21	119.9551	3.451	191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.0342	4.356	14	119.9551	3.451	191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7038	0.391	26	119.9551	3.451	191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	118.8813	0.771	3	119.9551	3.451	191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Co<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4130	0.000	1	119.9551	3.451	191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Cr<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3670	0.000	1	119.9551	3.451	191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.1220	0.000	1	119.9551	3.451	191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Ir<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3920	0.298	2	119.9551	3.451	191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Mo<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8550	0.354	4	119.9551	3.451	191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Mo<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3090	0.000	1	119.9551	3.451	191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Mo<9>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.2715	0.711	2	119.9551	3.451	191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Ni<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0950	0.000	1	119.9551	3.451	191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9300	0.074	2	119.9551	3.451	191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2660	0.166	7	119.9551	3.451	191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Rh<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5680	0.000	1	119.9551	3.451	191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Ru<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6200	0.471	5	119.9551	3.451	191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Si<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0590	0.000	1	119.9551	3.451	191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Sn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3162	0.288	8	119.9551	3.451	191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Sn<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3064	0.153	5	119.9551	3.451	191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Sn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.6157	0.263	3	119.9551	3.451	191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Zn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7180	0.000	1	119.9551	3.451	191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Zn<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1090	0.000	1	119.9551	3.451	191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<3>}	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	117.6908	2.831	4	119.9551	3.451	191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<3>}	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Cu<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5670	0.000	1	119.9551	3.451	191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<3>}	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Mo<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0050	0.000	1	119.9551	3.451	191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<3>}	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Mo<9>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8710	0.110	2	119.9551	3.451	191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<3>}	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9603	0.283	4	119.9551	3.451	191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<3>}	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3907	0.281	3	119.9551	3.451	191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<3>}	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Re<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7945	0.346	2	119.9551	3.451	191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<4>}	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1353	0.100	3	119.9551	3.451	191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,1|O<2>,1|S<3>}	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Rh<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	116.6320	0.000	1	119.9551	3.451	191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Rh<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5303	1.124	14	119.9551	3.451	191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Rh<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.9293	3.837	6	119.9551	3.451	191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Rh<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2990	6.394	6	119.9551	3.451	191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|S<2>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.7540	0.000	1	119.9551	3.451	191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]U)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|U<11>,1|C<4>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]U)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1020	0.000	1	120.0320	0.010	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]U)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|U<11>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]U)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9620	0.000	1	120.0320	0.010	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]N[6]V)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,1|V<6>}	C[6](C[6]C[6]H)(C[6]N[6]V)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0750	0.000	1	120.0750	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]O[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|O<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]O[6]H)(H){1|C<3>,1|H<1>,1|P<4>}	H(C[6]C[6]2)	120.1305	0.060	2	120.1305	0.004	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]P[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|O<2>,1|P<3>}	C[6](C[6]C[6]H)(C[6]P[6]C)(H){1|Cu<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	117.6605	0.064	2	118.5471	0.466	7	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]P[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|P<4>,2|C<2>}	C[6](C[6]C[6]H)(C[6]P[6]C)(H){1|H<1>,3|C<3>}	H(C[6]C[6]2)	118.9018	0.385	5	118.5471	0.466	7	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]P[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Cl<1>,1|H<1>,1|P<3>}	C[6](C[6]C[6]H)(C[6]P[6]H)(H){1|Re<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	118.1964	0.440	5	118.3870	0.466	9	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]P[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|O<2>,1|P<3>}	C[6](C[6]C[6]H)(C[6]P[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	118.1700	0.000	1	118.3870	0.466	9	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]P[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|O<2>,1|P<4>}	C[6](C[6]C[6]H)(C[6]P[6]H)(H){2|Cu<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	117.7260	0.000	1	118.3870	0.466	9	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]P[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|P<4>,2|H<1>}	C[6](C[6]C[6]H)(C[6]P[6]H)(H){1|C<3>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	119.3025	0.784	2	118.3870	0.466	9	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]P[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|O<2>,1|P<3>}	C[6](C[6]C[6]H)(C[6]P[6]O)(H){1|Cu<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	117.6650	0.103	2	117.7883	0.054	4	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]P[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|O<2>,1|P<3>}	C[6](C[6]C[6]H)(C[6]P[6]O)(H){1|Cu<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	118.1260	0.000	1	117.7883	0.054	4	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)(C[6]P[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|O<2>,1|P<4>}	C[6](C[6]C[6]H)(C[6]P[6]O)(H){2|Cu<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	117.6970	0.000	1	117.7883	0.054	4	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Al<4>,1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.0175	0.078	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Al<7>,1|C<3>,1|H<1>,1|H<2>}	C[6](C[6]C[6]H)2(H){1|C<4>,2|H<1>}	H(C[6]C[6]2)	120.0910	0.182	4	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|As<3>,1|C<2>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	124.5140	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|As<4>,1|C<2>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.5377	4.322	3	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|B<4>,1|C<2>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6480	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ba<10>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|Ba<10>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	118.9740	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ba<10>,1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Ba<10>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.0610	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Br<1>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	120.4900	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<2>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.6895	3.376	14	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<2>,1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,2|H<1>}	H(C[6]C[6]2)	120.0370	0.069	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<2>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.2322	5.428	14	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<2>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	115.5100	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<2>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0307	6.912	3	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<2>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.6620	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<2>,1|H<1>,1|P<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6520	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<2>,1|H<1>,1|P<4>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.9777	2.608	26	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<2>,1|H<1>,1|S<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	118.6740	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<2>,1|H<1>,1|S<4>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	122.6350	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<2>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<2>,1|H<1>}	H(C[6]C[6]2)	118.7825	5.893	4	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<2>,1|P<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.9276	0.115	5	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<2>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9946	3.314	55	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	119.7305	0.159	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Al<4>,1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.3660	0.549	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.7210	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|O<2>,1|V<6>}	H(C[6]C[6]2)	120.1380	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|O<1>,2|H<1>}	H(C[6]C[6]2)	119.9700	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,3|H<1>}	H(C[6]C[6]2)	121.2190	0.000	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Cu<4>,1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8550	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Li<3>,1|Ni<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1460	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Li<4>,1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7330	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ni<4>,1|Ni<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1100	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Pr<17>,1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.3460	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Zr<15>,1|C<3>,1|H<1>,1|H<2>}	H(C[6]C[6]2)	119.0750	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){2|Al<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8950	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){2|Li<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5700	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	116.5510	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.1320	0.057	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	121.7620	2.827	4	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(H){1|Br<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.3540	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	117.0730	4.789	4	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	119.8880	1.267	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|P<4>}	H(C[6]C[6]2)	119.3250	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8563	0.239	8	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.3366	0.536	36	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|O<2>,1|V<6>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.8880	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|O<2>,1|V<8>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<4>}	H(C[6]C[6]2)	119.7020	0.189	9	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|O<2>,1|V<9>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<4>}	H(C[6]C[6]2)	119.6620	0.791	6	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|P<4>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	123.8490	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,2|O<2>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	118.8300	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|As<3>,1|C<2>,1|H<1>}	H(C[6]C[6]2)	114.9080	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|As<4>,1|C<2>,1|H<1>}	H(C[6]C[6]2)	118.5107	2.513	3	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|B<4>,1|C<2>,1|H<1>}	H(C[6]C[6]2)	117.8010	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<2>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2821	3.816	13	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<2>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	121.6566	5.126	14	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<2>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	113.8120	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<2>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	117.6873	4.832	3	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<2>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	113.4050	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<2>,1|H<1>,1|P<3>}	H(C[6]C[6]2)	120.1110	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<2>,1|H<1>,1|P<4>}	H(C[6]C[6]2)	119.9065	2.645	26	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<2>,1|H<1>,1|S<3>}	H(C[6]C[6]2)	118.7180	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<2>,1|H<1>,1|S<4>}	H(C[6]C[6]2)	119.7910	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<2>,2|H<1>}	H(C[6]C[6]2)	119.9012	2.632	54	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ge<4>,1|C<2>,1|H<1>}	H(C[6]C[6]2)	116.5230	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|C<2>}	H(C[6]C[6]2)	119.9290	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Sn<5>,1|C<2>,1|H<1>}	H(C[6]C[6]2)	120.0800	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.3820	3.205	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|O<1>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.8190	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|P<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.8074	0.318	46	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	120.2421	0.467	7	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.1030	2.992	14	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,3|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.6880	0.000	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,3|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|P<4>}	H(C[6]C[6]2)	119.8786	0.240	5	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,3|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|C<4>}	H(C[6]C[6]2)	118.7350	1.430	4	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>,1|V<9>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>,1|V<9>}	H(C[6]C[6]2)	119.7366	0.202	19	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<4>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|O<2>,1|V<8>}	H(C[6]C[6]2)	120.0603	0.082	9	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<4>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|O<2>,1|V<9>}	H(C[6]C[6]2)	120.5050	0.981	6	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<4>}	C[6](C[6]C[6]H)2(H){1|W<10>,1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.0660	0.161	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	118.8515	0.050	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,2|O<2>}	H(C[6]C[6]2)	119.1190	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|O<2>,1|W<8>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|O<2>,1|W<8>}	H(C[6]C[6]2)	119.5140	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(H){1|H<1>,3|C<3>}	H(C[6]C[6]2)	118.6320	0.000	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|O<3>}	C[6](C[6]C[6]H)2(H){1|Ti<11>,1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8365	0.084	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|P<4>}	C[6](C[6]C[6]H)2(H){1|C<3>,3|H<1>}	H(C[6]C[6]2)	120.0034	0.261	5	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|P<4>}	C[6](C[6]C[6]H)2(H){1|Hf<13>,1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.8110	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|P<4>}	C[6](C[6]C[6]H)2(H){1|La<14>,1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.6000	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|P<4>}	C[6](C[6]C[6]H)2(H){1|Zr<13>,1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.0160	0.055	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|P<4>}	C[6](C[6]C[6]H)2(H){1|Zr<14>,1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.3420	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|S<3>}	C[6](C[6]C[6]H)2(H){1|Ti<8>,1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.1315	0.032	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|S<3>}	C[6](C[6]C[6]H)2(H){1|Y<12>,1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4720	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<2>,1|P<4>,2|H<1>}	H(C[6]C[6]2)	120.0204	0.048	5	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Al<7>,1|C<3>,1|H<1>,1|H<2>}	H(C[6]C[6]2)	120.1905	0.062	4	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<2>,1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0390	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	121.3765	0.033	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.5320	7.425	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|P<4>,2|H<1>}	H(C[6]C[6]2)	120.0631	0.467	41	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Cr<5>,1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.2530	0.006	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Cu<4>,1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.0738	0.149	4	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Cu<5>,1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.3065	0.084	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Er<16>,1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6166	0.988	8	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Ge<5>,1|Pd<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9965	0.019	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Hf<9>,1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.3765	0.090	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Li<4>,1|C<3>,1|H<1>,1|N<4>}	H(C[6]C[6]2)	121.1220	0.100	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Li<5>,1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.2725	0.021	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Mo<5>,1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.1110	0.071	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Ni<5>,1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2360	0.081	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Pd<4>,1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.0030	0.076	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Pd<5>,1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1030	0.049	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Pt<6>,1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3530	0.006	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Si<4>,1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.4330	0.079	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Ta<10>,1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0867	0.171	4	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Ta<6>,1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.6235	0.008	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Ta<9>,1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4134	0.653	8	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Ti<10>,1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0030	0.027	4	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Ti<11>,1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.6465	1.561	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|U<15>,1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5282	0.480	4	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Zn<4>,1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.4915	0.112	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Zr<10>,1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.3323	0.362	4	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Zr<11>,1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.6287	0.513	6	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Zr<12>,1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.3560	0.055	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Zr<13>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.9890	0.109	4	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Zr<8>,1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.7610	0.041	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Zr<9>,1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.1710	0.139	3	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){2|Cu<2>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9800	0.020	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){2|Li<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5821	0.497	8	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){2|Mg<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1740	0.023	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){2|Zn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1500	0.016	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,3|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,3|H<1>}	H(C[6]C[6]2)	122.1740	3.284	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,3|H<1>}	C[6](C[6]C[6]H)2(H){2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.9530	0.021	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ca<12>,1|C<4>,1|C<5>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ca<12>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.2610	0.167	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ca<12>,1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Ca<12>,1|C<4>,1|C<5>,1|H<1>}	H(C[6]C[6]2)	120.7085	0.176	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ca<8>,1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Ca<8>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	117.5100	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ca<8>,1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(H){1|Ca<8>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	122.8100	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ce<13>,1|C<4>,1|H<1>,1|H<2>}	C[6](C[6]C[6]H)2(H){1|Ce<13>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8460	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ce<13>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|Ce<13>,1|C<4>,1|H<1>,1|H<2>}	H(C[6]C[6]2)	119.1420	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ce<18>,1|C<4>,1|H<1>,1|H<2>}	C[6](C[6]C[6]H)2(H){1|Ce<18>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	120.9430	0.131	3	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ce<18>,1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(H){1|Ce<18>,1|C<4>,1|H<1>,1|H<2>}	H(C[6]C[6]2)	119.1433	0.121	3	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ce<22>,1|C<4>,1|F<2>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ce<22>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4660	0.167	3	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ce<22>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|Ce<22>,1|C<4>,1|F<2>,1|H<1>}	H(C[6]C[6]2)	119.2703	0.162	3	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Co<6>,1|B<4>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Co<6>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.7370	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Co<6>,1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Co<6>,1|B<4>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.0460	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Co<8>,1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(H){1|Co<8>,1|Ni<7>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.9345	0.145	4	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Co<8>,1|Ni<7>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Co<8>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.5147	0.046	3	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Cr<5>,1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.7540	0.471	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Cr<6>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|Cr<6>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.6175	0.145	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Cr<7>,1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Cr<7>,1|Si<5>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.0550	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Cr<7>,1|Si<5>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Cr<7>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.9260	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Cr<8>,1|C<3>,1|H<1>,1|O<3>}	C[6](C[6]C[6]H)2(H){1|Cr<8>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.5040	0.142	3	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Cr<8>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Cr<8>,1|C<3>,1|H<1>,1|O<3>}	H(C[6]C[6]2)	119.8252	0.103	4	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Cu<4>,1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.8697	0.159	4	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Cu<4>,1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Cu<4>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.5850	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Cu<4>,1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.1670	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Cu<4>,1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Cu<4>,1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.0880	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Cu<4>,1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Cu<4>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.7815	0.091	4	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Cu<5>,1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,2|H<1>}	H(C[6]C[6]2)	120.6820	0.068	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Cu<6>,1|B<4>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Cu<6>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.8299	0.174	7	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Cu<6>,1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Cu<6>,1|B<4>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.4441	0.279	7	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Dy<15>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|Dy<15>,1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.9280	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Dy<15>,1|C<4>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(H){1|Dy<15>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4770	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Er<16>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.6420	0.761	8	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Fe<10>,1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Fe<10>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	120.3220	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Fe<10>,1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(H){1|Fe<10>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.7760	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Fe<6>,1|B<4>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Fe<6>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.4294	1.057	5	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Fe<6>,1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Fe<6>,1|B<4>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.9976	1.128	5	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Fe<7>,1|B<4>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Fe<7>,1|C<4>,1|H<1>,1|P<4>}	H(C[6]C[6]2)	119.6485	0.462	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Fe<7>,1|C<4>,1|H<1>,1|P<4>}	C[6](C[6]C[6]H)2(H){1|Fe<7>,1|B<4>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.1580	0.185	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Fe<8>,1|B<5>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Fe<8>,1|C<4>,1|H<1>,1|P<4>}	H(C[6]C[6]2)	120.0140	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Fe<8>,1|C<4>,1|H<1>,1|P<4>}	C[6](C[6]C[6]H)2(H){1|Fe<8>,1|B<5>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.2800	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Fe<9>,1|C<4>,1|H<1>,1|S<3>}	C[6](C[6]C[6]H)2(H){1|Fe<9>,1|C<4>,1|H<1>,1|S<3>}	H(C[6]C[6]2)	119.5345	0.085	6	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ge<4>,1|C<2>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6810	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ge<5>,1|Pd<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.8590	0.088	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|C<2>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0060	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	120.2421	1.139	36	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	116.8043	10.381	14	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(H){1|C<3>,3|H<1>}	H(C[6]C[6]2)	119.4527	0.773	4	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(H){1|Hf<10>,1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2858	0.238	4	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(H){1|Hf<11>,1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2513	0.086	3	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(H){1|Hf<9>,1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0612	0.294	5	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(H){1|Li<5>,1|Ni<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8620	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(H){1|Mg<6>,1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7000	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(H){1|Nd<12>,1|C<3>,1|H<1>,1|N<4>}	H(C[6]C[6]2)	120.3633	0.054	3	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(H){1|U<16>,1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8360	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(H){1|Y<10>,1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2420	0.057	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(H){1|Yb<12>,1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8215	0.699	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(H){1|Zr<11>,1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2127	0.205	3	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(H){1|Zr<9>,1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2435	0.317	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(H){2|Li<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6290	0.172	3	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.5100	0.000	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,3|C<4>}	C[6](C[6]C[6]H)2(H){2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.8580	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Hf<10>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|C<4>}	H(C[6]C[6]2)	120.0415	0.194	4	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Hf<10>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|Hf<10>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	120.2440	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Hf<10>,1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(H){1|Hf<10>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7080	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Hf<11>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.9715	0.030	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Hf<13>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|P<4>}	H(C[6]C[6]2)	119.6550	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Hf<9>,1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.8135	0.125	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Hf<9>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|C<4>}	H(C[6]C[6]2)	120.2000	0.263	5	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Hf<9>,1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Hf<9>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	120.2620	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Hf<9>,1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(H){1|Hf<9>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.9590	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ir<5>,1|Ru<6>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ru<6>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.7200	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|La<14>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|P<4>}	H(C[6]C[6]2)	119.8190	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|La<18>,1|C<4>,1|H<1>,1|H<2>}	C[6](C[6]C[6]H)2(H){1|La<18>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	120.8573	0.137	3	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|La<18>,1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(H){1|La<18>,1|C<4>,1|H<1>,1|H<2>}	H(C[6]C[6]2)	119.1473	0.188	3	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Li<3>,1|Ni<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.8400	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Li<4>,1|C<3>,1|H<1>,1|N<4>}	C[6](C[6]C[6]H)2(H){1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.2410	0.629	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Li<4>,1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.2000	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Li<5>,1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.7085	0.090	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Li<5>,1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Li<5>,1|Ni<7>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.8890	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Li<5>,1|C<4>,1|H<1>,1|O<3>}	C[6](C[6]C[6]H)2(H){1|Li<5>,1|Zn<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.7267	0.215	3	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Li<5>,1|Ni<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.6860	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Li<5>,1|Ni<7>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Li<5>,1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.0860	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Li<5>,1|Zn<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Li<5>,1|C<4>,1|H<1>,1|O<3>}	H(C[6]C[6]2)	120.2467	0.107	3	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Li<6>,1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(H){1|Li<6>,1|Ni<7>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.0800	0.008	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Li<6>,1|Ni<7>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Li<6>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.6565	0.151	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Lu<11>,1|C<4>,1|H<1>,1|N<4>}	C[6](C[6]C[6]H)2(H){1|Lu<11>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	120.2960	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Lu<11>,1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(H){1|Lu<11>,1|C<4>,1|H<1>,1|N<4>}	H(C[6]C[6]2)	119.8060	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Mg<6>,1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|C<4>}	H(C[6]C[6]2)	120.3270	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Mg<7>,1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Mg<7>,1|Si<5>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.8680	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Mg<7>,1|Si<5>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Mg<7>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.9110	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Mn<7>,1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Mn<7>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	120.5030	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Mn<7>,1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(H){1|Mn<7>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.4770	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Mn<8>,1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(H){1|Mn<8>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.9403	0.578	28	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Mo<10>,1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Mo<10>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.9800	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Mo<10>,1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(H){1|Mo<10>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.7970	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Mo<5>,1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.7475	0.069	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Mo<7>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|Mo<7>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.6907	0.188	8	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Mo<8>,1|Mo<9>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Mo<9>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.7985	0.006	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Mo<9>,1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Mo<8>,1|Mo<9>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.4670	0.141	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Nd<12>,1|C<3>,1|H<1>,1|N<4>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.8933	0.050	3	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Nd<18>,1|C<4>,1|H<1>,1|H<2>}	C[6](C[6]C[6]H)2(H){1|Nd<18>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	120.7673	0.187	3	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Nd<18>,1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(H){1|Nd<18>,1|C<4>,1|H<1>,1|H<2>}	H(C[6]C[6]2)	119.1990	0.131	3	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ni<4>,1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){2|Ni<4>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.1580	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ni<4>,1|Ni<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.8810	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ni<5>,1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.8720	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ni<5>,1|B<4>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ni<5>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.3650	0.344	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ni<5>,1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Ni<5>,1|B<4>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.5635	0.344	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ni<5>,1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Ni<5>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.5445	1.318	11	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ni<5>,1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(H){1|Ni<5>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.6833	0.425	11	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ni<6>,1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ni<6>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	120.0000	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ni<6>,1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Ni<6>,1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.9740	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ni<6>,1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Ni<6>,1|Si<5>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.9480	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ni<6>,1|Si<5>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ni<6>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.6540	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ni<7>,1|Ni<8>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ni<8>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.5560	0.112	4	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ni<7>,1|Ni<9>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ni<9>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.4635	0.197	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ni<8>,1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(H){1|Ni<7>,1|Ni<8>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.8912	0.198	4	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ni<9>,1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(H){1|Ni<7>,1|Ni<9>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.7890	0.429	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Os<4>,1|Os<5>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){2|Os<5>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.9580	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Os<4>,1|Os<6>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Os<5>,1|Os<6>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.8780	0.207	3	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Os<5>,1|Os<6>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Os<4>,1|Os<6>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.2980	0.163	3	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Os<7>,1|Os<9>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Os<9>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.5270	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Os<9>,1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(H){1|Os<7>,1|Os<9>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.9920	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Os<9>,1|Ru<9>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ru<9>,1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.6150	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Os<9>,1|Ru<9>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ru<9>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.6980	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Pd<4>,1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.8035	0.029	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Pd<5>,1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,2|H<1>}	H(C[6]C[6]2)	120.0055	0.037	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Pd<5>,1|B<4>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Pd<5>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	120.1660	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Pd<5>,1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Pd<5>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.4360	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Pd<5>,1|C<3>,1|H<1>,1|N<4>}	C[6](C[6]C[6]H)2(H){1|Pd<5>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.0640	0.072	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Pd<5>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Pd<5>,1|C<3>,1|H<1>,1|N<4>}	H(C[6]C[6]2)	118.6555	0.844	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Pd<5>,1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Pd<5>,1|B<4>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.9350	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Pd<5>,1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Pd<5>,1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.0960	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Pd<5>,1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Pd<5>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.8618	0.251	5	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Pd<5>,1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(H){1|Pd<5>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.6220	0.338	6	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Pd<6>,1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Pd<6>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.8540	0.394	3	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Pd<6>,1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(H){1|Pd<6>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.8327	0.341	3	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Pd<6>,1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(H){1|Pd<6>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.6175	0.179	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Pr<17>,1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.1840	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Pr<18>,1|C<4>,1|H<1>,1|H<2>}	C[6](C[6]C[6]H)2(H){1|Pr<18>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	120.8987	0.187	3	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Pr<18>,1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(H){1|Pr<18>,1|C<4>,1|H<1>,1|H<2>}	H(C[6]C[6]2)	119.1863	0.086	3	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Pt<5>,1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Pt<5>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	120.0650	0.076	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Pt<5>,1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(H){1|Pt<5>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.4770	0.262	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Pt<6>,1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.7850	0.202	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Re<7>,1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Re<7>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.9655	0.301	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Re<8>,1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(H){1|Re<8>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.9660	0.492	6	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Rh<5>,1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Rh<5>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	120.4640	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Rh<5>,1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(H){1|Rh<5>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.5020	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Rh<6>,1|B<4>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Rh<6>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.4180	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Rh<6>,1|C<4>,1|C<5>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Rh<6>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.3370	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Rh<6>,1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Rh<6>,1|B<4>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.4700	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Rh<6>,1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Rh<6>,1|C<4>,1|C<5>,1|H<1>}	H(C[6]C[6]2)	120.0920	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ru<10>,1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Ru<10>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	120.1760	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ru<10>,1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(H){1|Ru<10>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.5100	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ru<5>,2|Ru<6>,1|C<5>,1|H<1>}	C[6](C[6]C[6]H)2(H){3|Ru<6>,1|C<5>,1|H<1>}	H(C[6]C[6]2)	119.9840	0.052	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ru<6>,1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Ir<5>,1|Ru<6>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.8280	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ru<6>,1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Ru<6>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.8320	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ru<6>,1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){2|Ru<6>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.1620	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ru<6>,1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(H){1|Ru<6>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.8080	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ru<7>,1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(H){1|Ru<7>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.8157	0.576	4	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ru<8>,1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Ru<8>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.9700	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ru<8>,1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(H){1|Ru<8>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.5540	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ru<9>,1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Os<9>,1|Ru<9>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.5580	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ru<9>,1|C<4>,1|H<1>,1|S<3>}	C[6](C[6]C[6]H)2(H){1|Ru<9>,1|C<4>,1|H<1>,1|S<3>}	H(C[6]C[6]2)	119.3769	0.322	8	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ru<9>,1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Ru<9>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.7560	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ru<9>,1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(H){1|Os<9>,1|Ru<9>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.5280	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ru<9>,1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(H){1|Ru<9>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	120.0870	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Sc<11>,1|C<4>,1|H<1>,1|N<4>}	C[6](C[6]C[6]H)2(H){1|Sc<11>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.7180	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Sc<11>,1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(H){1|Sc<11>,1|C<4>,1|H<1>,1|N<4>}	H(C[6]C[6]2)	119.6890	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Sc<13>,1|C<4>,1|H<1>,1|N<4>}	C[6](C[6]C[6]H)2(H){1|Sc<13>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.6070	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Sc<13>,1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Sc<13>,1|C<4>,1|H<1>,1|N<4>}	H(C[6]C[6]2)	120.2350	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Si<4>,1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,2|H<1>}	H(C[6]C[6]2)	120.6730	0.322	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Sn<5>,1|C<2>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0890	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ta<10>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.7400	0.152	4	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ta<6>,1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.6465	0.728	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ta<9>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.5076	0.724	8	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ta<9>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|Ta<9>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7430	0.331	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Te<2>,1|U<13>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|U<13>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.5630	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Th<17>,1|C<4>,1|H<1>,1|H<2>}	C[6](C[6]C[6]H)2(H){1|Th<17>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	120.7270	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Th<17>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|Th<17>,1|C<4>,1|H<1>,1|N<4>}	H(C[6]C[6]2)	119.5396	0.188	9	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Th<17>,1|C<4>,1|H<1>,1|N<4>}	C[6](C[6]C[6]H)2(H){1|Th<17>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3369	0.327	7	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Th<17>,1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(H){1|Th<17>,1|C<4>,1|H<1>,1|H<2>}	H(C[6]C[6]2)	119.3320	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Th<18>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|Th<18>,1|C<4>,1|H<1>,1|N<4>}	H(C[6]C[6]2)	119.5453	0.146	3	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Th<18>,1|C<4>,1|H<1>,1|N<4>}	C[6](C[6]C[6]H)2(H){1|Th<18>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3267	0.350	3	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Th<20>,1|C<4>,1|H<1>,1|H<2>}	C[6](C[6]C[6]H)2(H){1|Th<20>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	120.8110	0.085	3	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Th<20>,1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(H){1|Th<20>,1|C<4>,1|H<1>,1|H<2>}	H(C[6]C[6]2)	119.3223	0.056	3	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Th<21>,1|C<4>,1|H<1>,1|H<2>}	C[6](C[6]C[6]H)2(H){1|Th<21>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7675	0.122	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Th<21>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|Th<21>,1|C<4>,1|H<1>,1|H<2>}	H(C[6]C[6]2)	119.0065	0.042	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ti<10>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|C<4>,2|H<1>}	H(C[6]C[6]2)	120.0020	0.053	4	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ti<11>,1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,2|H<1>}	H(C[6]C[6]2)	120.2610	1.987	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ti<11>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|O<3>}	H(C[6]C[6]2)	119.5735	0.117	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ti<11>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|Ti<11>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8007	0.186	4	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ti<8>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|S<3>}	H(C[6]C[6]2)	119.4700	0.089	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|U<11>,1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|U<11>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	120.7210	0.190	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|U<11>,1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(H){1|U<11>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.4615	0.080	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|U<13>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Te<2>,1|U<13>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4350	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|U<15>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.5092	0.430	4	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|U<15>,1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|U<15>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.9740	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|U<15>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|U<15>,1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.3580	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|U<16>,1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|C<4>}	H(C[6]C[6]2)	120.9250	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|U<16>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|U<16>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.6697	0.252	8	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|U<16>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|U<16>,1|C<4>,1|H<1>,1|N<4>}	H(C[6]C[6]2)	119.3066	0.336	8	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|U<16>,1|C<4>,1|H<1>,1|N<4>}	C[6](C[6]C[6]H)2(H){1|U<16>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3947	0.295	9	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|U<18>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|U<18>,1|C<4>,1|H<1>,1|N<4>}	H(C[6]C[6]2)	119.6193	0.295	3	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|U<18>,1|C<4>,1|H<1>,1|N<4>}	C[6](C[6]C[6]H)2(H){1|U<18>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3477	0.287	3	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|V<12>,1|C<4>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(H){1|V<12>,1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.7623	0.341	18	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|W<10>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<4>}	H(C[6]C[6]2)	119.6300	0.055	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|W<10>,1|C<4>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(H){1|W<10>,1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.5218	0.657	24	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|W<11>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|W<11>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8315	0.391	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|W<11>,1|C<4>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(H){1|W<11>,1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	118.8080	1.687	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|W<12>,1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(H){1|W<12>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.8200	0.083	6	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Y<10>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|C<4>}	H(C[6]C[6]2)	120.5295	0.032	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Y<10>,1|C<4>,1|H<1>,1|H<2>}	C[6](C[6]C[6]H)2(H){1|Y<10>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	121.4670	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Y<10>,1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(H){1|Y<10>,1|C<4>,1|H<1>,1|H<2>}	H(C[6]C[6]2)	120.2830	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Y<12>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|S<3>}	H(C[6]C[6]2)	119.6600	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Y<13>,1|C<3>,1|H<1>,1|S<3>}	C[6](C[6]C[6]H)2(H){1|Y<13>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.1470	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Y<13>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Y<13>,1|C<3>,1|H<1>,1|S<3>}	H(C[6]C[6]2)	119.7070	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Y<17>,1|C<4>,1|H<1>,1|H<2>}	C[6](C[6]C[6]H)2(H){1|Y<17>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	120.6210	0.349	3	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Y<17>,1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(H){1|Y<17>,1|C<4>,1|H<1>,1|H<2>}	H(C[6]C[6]2)	119.4313	0.181	3	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Yb<10>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|Yb<10>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9060	0.553	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Yb<12>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|S<3>}	H(C[6]C[6]2)	119.4690	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Yb<12>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|C<4>}	H(C[6]C[6]2)	120.6790	0.100	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Yb<12>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|Yb<12>,1|C<4>,1|H<1>,1|O<3>}	H(C[6]C[6]2)	119.6650	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Yb<12>,1|C<4>,1|H<1>,1|O<3>}	C[6](C[6]C[6]H)2(H){1|Yb<12>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3710	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Yb<14>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|Yb<14>,1|C<4>,1|H<1>,1|O<3>}	H(C[6]C[6]2)	119.5360	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Yb<14>,1|C<4>,1|H<1>,1|O<3>}	C[6](C[6]C[6]H)2(H){1|Yb<14>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1700	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Yb<15>,1|C<4>,1|H<1>,1|H<2>}	C[6](C[6]C[6]H)2(H){1|Yb<15>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.9450	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Yb<15>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|Yb<15>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3110	0.625	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Yb<15>,1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Yb<15>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	120.1990	0.459	4	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Yb<15>,1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(H){1|Yb<15>,1|C<4>,1|H<1>,1|H<2>}	H(C[6]C[6]2)	119.8660	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Yb<15>,1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(H){1|Yb<15>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.5950	0.402	4	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Yb<16>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|Yb<16>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8100	0.182	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Zn<4>,1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,2|H<1>}	H(C[6]C[6]2)	120.2090	0.163	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Zr<10>,1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.7367	0.482	3	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Zr<10>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|Zr<10>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8530	0.041	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Zr<10>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|Zr<10>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	120.3335	0.323	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Zr<10>,1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Zr<10>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	120.4470	0.089	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Zr<10>,1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(H){1|Zr<10>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7565	0.125	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Zr<10>,1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(H){1|Zr<10>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.5245	0.135	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Zr<11>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|C<4>,2|H<1>}	H(C[6]C[6]2)	120.1267	0.259	6	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Zr<11>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|C<4>}	H(C[6]C[6]2)	120.0483	0.235	3	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Zr<12>,1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,2|H<1>}	H(C[6]C[6]2)	120.1415	0.716	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Zr<12>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|Zr<12>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.4720	1.404	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Zr<12>,1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Zr<12>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	120.1677	0.426	3	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Zr<12>,1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(H){1|Zr<12>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.8997	0.786	3	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Zr<13>,1|C<3>,1|C<5>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Zr<13>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.6000	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Zr<13>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|P<4>}	H(C[6]C[6]2)	119.4975	0.022	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Zr<13>,1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Zr<13>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	112.5570	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Zr<13>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Zr<13>,1|C<3>,1|C<5>,1|H<1>}	H(C[6]C[6]2)	120.0090	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Zr<13>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Zr<13>,1|C<3>,2|H<1>}	H(C[6]C[6]2)	126.9640	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Zr<13>,1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.8388	0.184	4	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Zr<14>,1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Zr<14>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.9356	0.300	5	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Zr<14>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|P<4>}	H(C[6]C[6]2)	119.8290	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Zr<14>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|Zr<14>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.3920	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Zr<14>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Zr<14>,1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.2134	0.287	5	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Zr<14>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Zr<14>,1|Cl<2>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1560	0.006	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Zr<14>,1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Zr<14>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5060	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Zr<14>,1|Cl<2>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Zr<14>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.8815	0.192	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Zr<15>,1|C<3>,1|C<5>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Zr<15>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.2950	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Zr<15>,1|C<3>,1|H<1>,1|H<2>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.9010	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Zr<15>,1|C<3>,1|H<1>,1|H<2>}	C[6](C[6]C[6]H)2(H){1|Zr<15>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.9460	0.000	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Zr<15>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Zr<15>,1|C<3>,1|C<5>,1|H<1>}	H(C[6]C[6]2)	120.1620	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Zr<15>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Zr<15>,1|C<3>,1|H<1>,1|H<2>}	H(C[6]C[6]2)	119.6720	0.000	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Zr<8>,1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.8285	0.056	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Zr<9>,1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.8183	0.150	4	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Zr<9>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|C<4>}	H(C[6]C[6]2)	120.0585	0.053	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Zr<9>,1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Zr<9>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	120.5415	0.080	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Zr<9>,1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(H){1|Zr<9>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.1555	0.515	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){2|Al<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.1950	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){2|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,3|H<1>}	H(C[6]C[6]2)	119.6860	0.133	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){2|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,3|C<4>}	H(C[6]C[6]2)	120.1940	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){2|Cu<2>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.9675	0.334	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){2|Li<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.9650	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){2|Li<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,2|H<1>}	H(C[6]C[6]2)	120.0825	0.668	8	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){2|Li<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|C<4>}	H(C[6]C[6]2)	120.0700	0.144	3	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){2|Mg<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.9605	0.097	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){2|Ni<4>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ni<4>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.5270	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){2|Os<5>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Os<4>,1|Os<5>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.0140	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){2|Os<5>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){2|Os<5>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.7650	0.482	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){2|Ru<6>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ru<6>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.6020	0.000	1	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){2|Zn<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.9970	0.201	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){3|Ru<6>,1|C<5>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ru<5>,2|Ru<6>,1|C<5>,1|H<1>}	H(C[6]C[6]2)	120.2030	0.216	2	119.9380	3.851	1406	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ir<7>,2|C<4>}	C[6](C[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<4>}	H(C[6]C[6]2)	119.5910	0.045	2	119.5910	0.002	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|B<4>,1|C<3>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|V<7>,2|C<3>}	H(C[6]C[6]2)	120.5800	0.000	1	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|B<4>,1|C<3>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Li<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.8750	0.177	2	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Br<1>,1|C<2>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|H<1>,3|C<3>}	H(C[6]C[6]2)	122.2030	0.000	1	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Br<1>,1|C<3>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.4695	0.265	2	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Br<1>,1|C<4>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ru<4>,1|C<3>,1|H<1>,1|O<3>,2|C<4>}	H(C[6]C[6]2)	120.6330	0.000	1	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<2>,1|C<3>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Co<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.5483	0.157	3	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<2>,1|C<3>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	121.1200	0.000	1	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<2>,1|C<3>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.3150	0.000	1	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<2>,1|C<3>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pt<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.9470	0.000	1	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<2>,1|C<3>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ru<9>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.3650	0.000	1	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ag<3>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.3010	0.035	2	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ag<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.2572	0.040	4	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cd<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.0210	0.145	4	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cd<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.9277	0.253	6	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Co<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.4862	2.028	10	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Co<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.1967	0.347	13	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cr<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.5430	0.000	1	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.5390	0.000	1	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.2623	0.424	44	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<5>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.9346	0.169	9	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<6>,1|C<3>,1|N<3>,1|N<4>,2|H<1>}	H(C[6]C[6]2)	120.1520	0.000	1	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.6380	0.042	2	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Fe<5>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.3600	0.172	6	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.1044	0.316	21	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Fe<7>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.0340	0.000	1	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|W<6>,2|C<3>}	H(C[6]C[6]2)	120.5650	0.000	1	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Hg<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.8970	0.488	2	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Li<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.2440	0.082	2	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Mn<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.9908	0.153	4	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Mo<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.3620	0.000	1	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ni<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.3330	0.126	3	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.0080	0.375	9	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.2030	0.468	3	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Re<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.5185	0.181	8	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.1487	0.522	11	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Zn<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.0307	0.272	8	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Zn<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.8324	0.415	7	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|F<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.1773	0.202	3	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|F<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ru<9>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.0290	0.023	2	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ag<3>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.1265	0.506	4	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ag<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.2745	0.690	23	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ag<5>,1|H<1>,1|N<2>,2|C<3>}	H(C[6]C[6]2)	120.7060	0.000	1	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ag<5>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.3409	0.633	8	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ag<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.5210	0.072	2	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Al<5>,1|C<3>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0930	0.000	1	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Al<5>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.0951	0.324	8	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Al<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.7318	1.417	6	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Au<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.8850	0.607	2	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Au<5>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.7510	0.000	1	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ba<12>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.1920	0.013	2	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Bi<5>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.6955	0.227	2	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Bi<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.3195	0.018	2	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Bi<7>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.0950	0.049	2	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|C<3>,1|N<2>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.8400	0.000	1	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|C<3>,2|H<1>,2|N<2>}	H(C[6]C[6]2)	119.8810	0.025	3	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.7750	0.809	6	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cd<5>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	121.3362	1.095	4	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cd<5>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.3264	0.437	17	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cd<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.3310	0.505	69	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cd<7>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.9840	0.268	4	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Co<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.5541	0.344	13	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Co<5>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.1600	0.423	21	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Co<6>,1|C<2>,1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.9820	0.000	1	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Co<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.4453	0.424	28	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Co<6>,1|C<3>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.5855	0.694	2	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Co<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.3018	0.681	469	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Co<7>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.4492	0.846	34	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Co<8>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.2990	0.241	3	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cr<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.3904	1.107	65	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cr<8>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.2897	0.219	4	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<3>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.5335	1.131	4	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.0588	1.226	10	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.1943	0.571	86	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|H<1>,1|N<4>,2|C<3>}	H(C[6]C[6]2)	120.3065	0.179	2	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<5>,1|C<2>,1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	116.4645	0.941	2	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.4287	0.329	10	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<5>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.1378	0.873	303	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.2752	0.618	71	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<7>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.3295	0.062	2	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Eu<10>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.6415	0.180	2	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Eu<13>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.6165	0.172	2	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Eu<8>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.7440	0.028	2	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Eu<8>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.4660	0.335	10	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Fe<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.4226	0.204	5	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Fe<5>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.2825	0.187	2	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Fe<5>,1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.7935	1.630	2	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Fe<5>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.6918	0.411	10	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.5012	0.190	9	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.4745	0.036	2	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.3390	0.932	232	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>,2|C<3>}	H(C[6]C[6]2)	120.7420	0.241	4	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<2>,2|C<3>}	H(C[6]C[6]2)	120.5260	0.202	21	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|V<5>,2|C<3>}	H(C[6]C[6]2)	119.0265	2.396	2	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|V<6>,2|C<3>}	H(C[6]C[6]2)	120.4149	0.332	20	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|V<7>,2|C<3>}	H(C[6]C[6]2)	120.2235	0.716	2	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|V<8>,2|C<3>}	H(C[6]C[6]2)	120.2585	0.214	4	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|W<6>,2|C<3>}	H(C[6]C[6]2)	120.5418	0.280	6	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|W<8>,2|C<3>}	H(C[6]C[6]2)	120.4540	0.168	2	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|H<1>,1|P<3>,1|W<6>,2|C<3>}	H(C[6]C[6]2)	120.6195	0.395	4	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Hg<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.2463	0.215	6	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Hg<5>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.9304	0.373	8	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.2440	0.000	1	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.3250	0.428	87	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.8233	1.712	7	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ir<7>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.2795	0.343	4	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ir<8>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.2060	0.571	29	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Li<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.3210	0.062	2	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Li<5>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.4735	0.097	2	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Li<5>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.2175	0.008	2	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Mg<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.1465	0.095	2	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Mg<5>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.4060	0.315	2	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Mg<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.3227	0.402	3	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Mn<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.3460	0.000	1	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Mn<5>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	121.4058	1.722	6	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Mn<5>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.6755	0.681	23	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.6315	0.482	11	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Mn<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.3259	0.554	266	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Mn<7>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	118.7567	3.532	12	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Mn<8>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.5482	0.199	4	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Mo<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.4257	0.502	46	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Mo<6>,1|H<1>,1|P<3>,2|C<3>}	H(C[6]C[6]2)	120.8630	0.000	1	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Mo<7>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.7542	0.322	6	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Mo<8>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.3544	0.229	5	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Mo<9>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	118.3680	0.000	1	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Mo<9>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.5220	0.075	2	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0518	0.514	29	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ni<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.1870	1.080	40	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ni<5>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.1391	0.407	11	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.5434	0.229	25	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.1863	0.992	409	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ni<7>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.1438	0.672	5	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Os<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.4148	0.616	174	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Os<8>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.4715	0.452	2	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pd<3>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.3205	0.063	2	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.5228	0.161	8	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.2938	0.552	156	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	123.4940	0.000	1	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pd<5>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.2415	1.675	2	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pd<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.4108	0.145	4	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pd<7>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.3295	0.047	4	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.6815	0.125	4	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,1|N<2>,2|C<3>}	H(C[6]C[6]2)	120.9083	0.162	3	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.3774	0.712	354	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.8737	0.884	3	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pt<5>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.1130	0.082	2	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pt<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.3339	0.361	62	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Re<5>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.6063	0.597	9	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Re<6>,1|C<3>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1460	0.255	2	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Re<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.8234	0.508	10	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Re<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.3599	0.668	217	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Re<7>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.3435	0.071	2	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Rh<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.1320	0.382	4	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Rh<5>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.1469	0.510	9	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Rh<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.3314	0.337	14	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Rh<7>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.6453	0.198	4	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Rh<8>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.3393	0.210	19	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ru<10>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.5795	0.217	2	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ru<5>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.3146	0.194	5	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.3434	0.767	15	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.4014	0.671	847	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ru<7>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.4808	0.576	24	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ru<8>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.5583	0.291	15	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ru<9>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.4118	0.225	24	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Sb<5>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.5040	0.000	1	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Sm<13>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.9335	0.333	2	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Sm<14>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.8000	0.000	1	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Sm<15>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.4145	0.682	2	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Sn<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.1604	0.348	10	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Sn<7>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.4425	0.231	4	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Sn<8>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.3065	0.089	4	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Sr<12>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.1105	0.112	2	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ti<11>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.6350	0.000	1	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ti<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.6740	0.000	1	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Zn<3>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.8710	0.000	1	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Zn<4>,1|C<3>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0890	0.000	1	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Zn<4>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.1430	0.000	1	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Zn<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.9515	0.885	35	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Zn<5>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.2515	0.299	133	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Zn<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.6277	0.227	3	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Zn<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.1388	1.354	93	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Zr<8>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.3578	0.309	4	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.8405	0.032	2	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<2>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ni<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.7523	0.169	3	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|N<4>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ru<8>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.0190	0.000	1	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|O<2>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.8330	0.287	4	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|O<2>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<5>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.7982	0.210	4	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|O<2>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.8075	0.261	2	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|O<2>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ir<8>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.8252	0.108	6	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|O<2>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Mn<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.2126	0.103	12	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|O<2>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.6050	0.000	1	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|O<2>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.0078	0.398	4	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|O<2>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.9185	0.407	4	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|O<2>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ru<9>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.2920	0.099	2	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|P<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Fe<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.1310	0.023	2	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|P<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Re<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	125.2630	0.000	1	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|P<4>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Al<5>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.9468	0.305	9	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|P<4>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Zn<3>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	122.3440	0.000	1	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|S<2>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Co<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.4065	0.155	2	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<5>,1|C<2>,1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8315	0.033	2	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pt<6>,1|C<2>,1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0930	0.000	1	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Co<5>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	121.2840	1.293	2	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.0975	0.268	16	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|V<7>,2|C<3>}	H(C[6]C[6]2)	120.6970	0.000	1	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Mn<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.9665	0.151	2	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ni<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.7110	0.000	1	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.7146	0.435	16	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.0655	0.100	2	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.2057	0.132	9	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Re<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.7437	0.557	6	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.7270	0.318	3	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ru<8>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.1600	0.000	1	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ru<9>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.0950	0.331	2	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Sm<14>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.0110	0.000	1	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Zn<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.8925	0.330	2	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Zn<5>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.0710	0.216	2	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Zn<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.1610	0.034	2	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|O<1>,2|O<2>}	H(C[6]C[6]2)	120.6807	0.090	3	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>,1|O<2>,2|C<4>}	H(C[6]C[6]2)	120.3770	0.000	1	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Co<4>,1|C<3>,1|C<4>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	123.4420	0.000	1	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cr<4>,1|C<3>,1|C<4>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.6150	0.008	2	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cr<6>,1|C<3>,2|H<1>,2|N<3>}	H(C[6]C[6]2)	120.3600	0.000	1	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cr<9>,1|Pd<4>,1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	120.6044	0.422	7	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cr<9>,1|Pd<5>,1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	120.4290	0.000	1	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cr<9>,1|Ru<6>,1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	120.2908	0.181	10	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<5>,1|C<3>,1|C<4>,1|N<4>,2|H<1>}	H(C[6]C[6]2)	119.9035	0.046	2	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<6>,1|C<3>,1|C<4>,1|N<4>,2|H<1>}	H(C[6]C[6]2)	120.3998	0.354	6	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Fe<5>,1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.6070	0.190	2	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|C<3>,1|C<4>,1|N<4>,2|H<1>}	H(C[6]C[6]2)	120.5150	0.286	2	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ir<11>,1|Ir<8>,1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	120.3780	0.000	1	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ir<8>,1|H<1>,1|O<2>,3|C<3>}	H(C[6]C[6]2)	120.4700	0.000	1	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Mn<7>,1|C<3>,1|C<4>,1|N<4>,2|H<1>}	H(C[6]C[6]2)	120.7820	0.274	2	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ni<4>,1|C<3>,1|C<4>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.7580	0.000	1	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|C<3>,1|C<4>,1|N<4>,2|H<1>}	H(C[6]C[6]2)	120.5275	0.179	2	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|C<3>,1|N<3>,1|N<4>,2|H<1>}	H(C[6]C[6]2)	120.2030	0.000	1	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ni<7>,1|C<3>,1|C<4>,1|N<4>,2|H<1>}	H(C[6]C[6]2)	120.7325	0.077	2	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Re<6>,1|C<3>,1|H<1>,1|O<2>,2|N<3>}	H(C[6]C[6]2)	121.1840	0.000	1	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ru<12>,1|Ru<6>,1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	120.3750	0.000	1	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ru<5>,1|C<3>,1|C<4>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.9620	0.000	1	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Zn<6>,1|C<3>,1|C<4>,1|N<4>,2|H<1>}	H(C[6]C[6]2)	120.4235	0.129	2	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Cl<1>,1|C<3>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.3659	0.155	7	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Cl<1>,1|C<3>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Re<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.8530	0.000	1	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Re<6>,1|C<3>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.4470	0.000	1	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ag<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	118.9875	0.237	2	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ag<5>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.4280	0.553	2	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Al<5>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.7309	0.356	14	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Al<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.4050	2.674	2	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Au<5>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	118.7970	0.000	1	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Bi<7>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.6780	0.004	2	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|V<7>,2|C<3>}	H(C[6]C[6]2)	120.4660	0.033	2	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|V<8>,2|C<3>}	H(C[6]C[6]2)	120.6835	0.025	2	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cd<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.1138	0.516	6	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Co<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.0917	0.120	3	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Co<5>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.9267	0.545	3	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Co<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	119.8260	0.000	1	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Co<6>,1|C<3>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	119.6850	0.250	3	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Co<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.6926	0.392	102	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cr<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.8421	0.400	26	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cr<8>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.1710	0.027	2	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|H<1>,1|N<2>,2|C<3>}	H(C[6]C[6]2)	120.2780	0.088	4	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.2602	0.412	51	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<5>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.5173	1.095	38	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Eu<10>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.8030	0.010	2	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Eu<13>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.5715	0.021	2	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Eu<8>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.0295	0.037	2	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Fe<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.1905	0.015	2	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Fe<5>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.1649	0.342	12	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	119.9530	0.055	3	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.7521	0.776	57	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Fe<8>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.2254	0.198	12	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>,2|C<3>}	H(C[6]C[6]2)	120.7990	0.000	1	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|V<5>,2|C<3>}	H(C[6]C[6]2)	119.5035	3.874	2	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|V<7>,2|C<3>}	H(C[6]C[6]2)	119.9125	0.071	2	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Hg<5>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.0020	0.006	2	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.9339	0.701	19	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Li<5>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.0515	0.005	2	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Mn<5>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.8440	0.280	6	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Mn<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.2440	0.748	38	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Mo<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.3421	0.165	8	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Mo<7>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.3243	0.031	3	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2965	0.066	2	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ni<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.2664	1.729	8	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ni<5>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.9132	0.234	6	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	119.5335	0.009	2	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.6192	1.535	65	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Os<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.5796	0.231	14	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	119.7460	0.357	4	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.5026	0.351	24	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.2158	0.533	105	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pt<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.7585	0.650	2	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Re<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.4663	0.388	15	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Re<7>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.2460	0.006	2	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Rh<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.9160	0.344	2	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Rh<5>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.4555	0.278	4	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Rh<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.6515	0.103	2	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.1755	0.008	2	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.7677	0.362	44	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Sm<15>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.4700	0.004	2	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ta<8>,1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.6300	0.911	6	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ti<7>,1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.7580	0.008	2	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Zn<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.2004	0.227	5	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Zn<5>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.9079	0.310	19	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Zn<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.6444	0.160	7	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Zr<10>,1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.2780	0.000	1	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|C<3>,1|O<1>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	120.5497	0.105	3	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|C<3>,1|C<4>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.6690	0.000	1	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|C<3>,1|C<4>,1|N<4>,2|H<1>}	H(C[6]C[6]2)	120.2225	0.575	2	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Re<6>,1|C<3>,1|O<2>,1|O<3>,2|H<1>}	H(C[6]C[6]2)	120.9480	0.000	1	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Re<6>,1|C<3>,2|H<1>,2|O<2>}	H(C[6]C[6]2)	120.0550	0.000	1	120.2372	0.597	6191	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]P[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|P<4>,2|H<1>}	C[6](C[6]C[6]P[5])(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,1|P<4>,3|C<4>}	H(C[6]C[6]2)	121.1100	0.000	1	121.1100	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]P[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<2>,1|H<1>,1|P<3>}	C[6](C[6]C[6]P[6])(C[6]C[6]H)(H){1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.4790	0.000	1	119.1495	0.217	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]P[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|P<4>}	C[6](C[6]C[6]P[6])(C[6]C[6]H)(H){1|C<2>,1|C<3>,2|H<1>,2|N<2>}	H(C[6]C[6]2)	118.8200	0.000	1	119.1495	0.217	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]Pd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Pd<4>,1|C<3>}	C[6](C[6]C[6]Pd)(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	126.3130	0.000	1	121.1650	20.207	3	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]Pd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Pd<5>,1|C<4>,1|H<1>}	C[6](C[6]C[6]Pd)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<4>}	H(C[6]C[6]2)	118.5910	0.813	2	121.1650	20.207	3	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]Sb)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Sb<5>,1|C<3>}	C[6](C[6]C[6]Sb)(C[6]C[6]H)(H){1|C<2>,2|H<1>}	H(C[6]C[6]2)	118.1315	0.463	2	118.1315	0.215	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]Se)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Se<2>,1|C<3>}	C[6](C[6]C[6]Se)(C[6]C[6]H)(H){1|C<2>,2|H<1>}	H(C[6]C[6]2)	118.2470	11.812	2	118.2470	139.512	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]Si)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Li<3>,1|Si<4>,2|Li<5>,1|C<5>}	C[6](C[6]C[6]Si)(C[6]C[6]H)(H){2|Li<5>,1|C<5>,1|H<1>,1|S<3>}	H(C[6]C[6]2)	118.1360	0.000	1	117.0305	33.110	10	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]Si)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Si<4>,1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]Si)(C[6]C[6]H)(H){1|C<4>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.4310	0.000	1	117.0305	33.110	10	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]Si)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Si<4>,1|C<3>}	C[6](C[6]C[6]Si)(C[6]C[6]H)(H){1|C<2>,2|H<1>}	H(C[6]C[6]2)	116.5923	6.431	8	117.0305	33.110	10	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]Sn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Sn<4>,1|C<3>}	C[6](C[6]C[6]Sn)(C[6]C[6]H)(H){1|C<2>,2|H<1>}	H(C[6]C[6]2)	121.4405	2.375	2	119.2987	13.739	4	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]Sn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Sn<5>,1|C<2>,1|H<1>}	C[6](C[6]C[6]Sn)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0920	0.000	1	119.2987	13.739	4	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]Sn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Sn<5>,1|C<3>}	C[6](C[6]C[6]Sn)(C[6]C[6]H)(H){1|C<2>,2|H<1>}	H(C[6]C[6]2)	114.2220	0.000	1	119.2987	13.739	4	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]Zr)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Zr<13>,1|C<4>,1|H<1>}	C[6](C[6]C[6]Zr)(C[6]C[6]H)(H){1|C<3>,1|C<5>,1|H<1>}	H(C[6]C[6]2)	120.0050	0.000	1	119.4314	4.953	12	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]Zr)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Zr<13>,1|C<4>,1|H<1>}	C[6](C[6]C[6]Zr)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	112.4040	0.000	1	119.4314	4.953	12	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]Zr)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Zr<14>,1|C<4>,1|H<1>}	C[6](C[6]C[6]Zr)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.1816	0.253	5	119.4314	4.953	12	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]Zr)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Zr<14>,1|C<4>,1|H<1>}	C[6](C[6]C[6]Zr)(C[6]C[6]H)(H){1|Cl<2>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1755	0.118	2	119.4314	4.953	12	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]Zr)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Zr<15>,1|C<4>,1|H<1>}	C[6](C[6]C[6]Zr)(C[6]C[6]H)(H){1|C<3>,1|C<5>,1|H<1>}	H(C[6]C[6]2)	120.0710	0.000	1	119.4314	4.953	12	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]Zr)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Zr<15>,1|C<4>,1|H<1>}	C[6](C[6]C[6]Zr)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|H<2>}	H(C[6]C[6]2)	119.7190	0.000	2	119.4314	4.953	12	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<2>,2|C<3>}	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.6561	0.290	10	120.0055	0.636	45	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|Al<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.3275	0.426	2	120.0055	0.636	45	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|Li<3>,1|Ni<7>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.1210	0.000	1	120.0055	0.636	45	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|Ni<4>,1|Ni<5>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.2660	0.000	1	120.0055	0.636	45	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,2|C<4>}	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|Pr<17>,1|H<1>,1|O<2>,3|C<3>}	H(C[6]C[6]2)	120.8260	1.028	2	120.0055	0.636	45	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,2|C<4>}	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|Th<12>,1|H<1>,1|O<2>,3|C<3>}	H(C[6]C[6]2)	119.7030	0.000	1	120.0055	0.636	45	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,2|C<3>}	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|Ga<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.7735	0.008	2	120.0055	0.636	45	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,2|C<3>}	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|Li<3>,1|Li<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.2700	0.000	1	120.0055	0.636	45	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,2|C<3>}	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|Pr<17>,1|H<1>,1|O<2>,3|C<3>}	H(C[6]C[6]2)	120.3180	0.000	1	120.0055	0.636	45	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,2|C<3>}	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|Th<12>,1|H<1>,1|O<2>,3|C<3>}	H(C[6]C[6]2)	119.6735	0.327	4	120.0055	0.636	45	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,2|C<3>}	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|Ti<10>,1|H<1>,1|O<2>,3|C<3>}	H(C[6]C[6]2)	120.2632	0.149	8	120.0055	0.636	45	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,2|C<3>}	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){2|Li<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.3755	0.023	2	120.0055	0.636	45	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|C<3>}	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,1|O<1>,3|C<3>}	H(C[6]C[6]2)	120.4040	0.022	3	120.0055	0.636	45	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ni<4>,1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|Ni<4>,1|Ni<5>,1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.8500	0.000	1	120.0055	0.636	45	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ni<6>,1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|Ni<6>,1|C<4>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7890	0.000	1	120.0055	0.636	45	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ta<10>,1|C<4>,2|C<3>}	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|Ta<10>,1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.4250	0.000	1	120.0055	0.636	45	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){2|C<3>}	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|C<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	116.3780	0.000	1	120.0055	0.636	45	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){3|C<3>}	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,1|O<1>,3|C<3>}	H(C[6]C[6]2)	120.6497	1.435	3	120.0055	0.636	45	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Br<1>,1|C<3>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|N<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8500	0.000	1	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<2>,1|C<3>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|N<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7840	0.000	1	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Al<5>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.1633	0.179	7	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.2740	0.208	2	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Co<5>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.3367	0.395	3	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Cu<5>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.3780	0.293	7	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Fe<5>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	121.2305	1.493	4	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.4020	0.181	2	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|H<1>,1|O<1>,3|C<3>}	H(C[6]C[6]2)	120.6010	0.000	1	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ir<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.6045	0.590	2	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Mn<6>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.9683	0.742	3	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|N<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.6017	0.543	7	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ni<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.3810	0.099	2	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ni<5>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.8616	0.674	8	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.5154	1.541	8	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ni<7>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.9865	1.129	2	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.2291	0.469	11	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.2357	0.505	3	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pt<6>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.4190	0.000	1	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Re<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	115.4800	0.000	1	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|H<1>,1|N<2>,2|C<3>}	H(C[6]C[6]2)	119.9970	0.000	1	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.7500	0.238	4	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Zn<5>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.1292	1.036	8	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|As<2>,1|H<1>,1|N<2>,2|C<3>}	H(C[6]C[6]2)	120.2210	0.000	1	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Au<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.2239	0.306	23	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Au<5>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.0540	0.000	1	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|B<4>,1|H<1>,1|N<2>,2|C<3>}	H(C[6]C[6]2)	120.8170	0.000	1	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|B<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.4875	0.039	2	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|C<3>,2|H<1>,2|N<2>}	H(C[6]C[6]2)	120.1214	0.242	17	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<2>,2|C<3>}	H(C[6]C[6]2)	119.2335	1.953	4	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	121.4580	1.155	2	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Co<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.3569	1.784	17	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Co<8>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.3100	0.000	1	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.3000	0.000	1	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.3985	0.105	4	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Cu<5>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.2894	0.274	5	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Eu<11>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.4320	0.000	1	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Fe<5>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	118.6940	0.000	1	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	118.6252	1.935	4	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|O<1>,2|C<3>}	H(C[6]C[6]2)	120.8798	0.741	4	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|H<1>,1|O<1>,3|C<3>}	H(C[6]C[6]2)	120.3250	0.800	2	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|H<1>,1|O<2>,3|C<3>}	H(C[6]C[6]2)	120.1820	0.000	1	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|H<1>,4|C<3>}	H(C[6]C[6]2)	120.3640	0.000	1	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|In<5>,1|H<1>,1|N<2>,2|C<3>}	H(C[6]C[6]2)	120.1670	0.000	1	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|H<1>,1|N<2>,2|C<3>}	H(C[6]C[6]2)	120.3372	0.614	5	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.2825	0.513	786	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ir<7>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.2881	0.545	50	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ir<8>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.3838	0.475	30	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ir<9>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	121.0345	1.211	2	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Mg<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.8830	0.000	1	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Mn<6>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.4180	0.173	5	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|N<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7761	0.923	92	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ni<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.4247	0.191	6	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Os<6>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.3309	0.458	23	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Os<9>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.4338	0.326	4	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,1|N<2>,2|C<3>}	H(C[6]C[6]2)	120.5523	0.245	8	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.8610	0.000	1	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.4687	1.023	66	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pd<6>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.1732	0.165	6	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pd<7>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.5983	0.064	3	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,1|N<2>,2|C<3>}	H(C[6]C[6]2)	120.4840	0.204	7	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.2524	0.402	245	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pt<5>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.9048	0.593	6	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pt<6>,1|H<1>,1|N<2>,2|C<3>}	H(C[6]C[6]2)	120.4290	0.000	1	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pt<6>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.2237	0.240	31	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Re<6>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.7840	0.000	1	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Rh<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.7100	0.000	1	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Rh<5>,1|H<1>,1|N<2>,2|C<3>}	H(C[6]C[6]2)	120.7870	0.158	2	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Rh<6>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.4220	0.282	8	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Rh<8>,1|H<1>,1|N<2>,2|C<3>}	H(C[6]C[6]2)	120.7385	0.172	2	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Rh<8>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.4511	0.310	45	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Rh<9>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.6497	0.012	4	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.3997	0.327	24	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ru<7>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.3340	0.225	2	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ru<9>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.2555	0.263	11	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Te<5>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.5920	0.000	1	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Te<7>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.3305	0.582	2	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Zn<4>,1|H<1>,1|N<2>,2|C<3>}	H(C[6]C[6]2)	120.2200	0.103	5	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Zn<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.4990	0.122	2	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.0744	0.975	5	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<2>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,1|N<2>,2|C<3>}	H(C[6]C[6]2)	120.5250	0.000	1	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<2>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.0720	0.952	2	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|N<5>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ru<5>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.4390	0.000	1	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|O<2>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.7810	0.000	1	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|O<2>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ir<8>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.6160	0.328	2	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|O<2>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ni<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.8080	0.170	3	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|O<2>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.3320	0.000	1	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|S<1>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|N<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	118.6653	0.671	3	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|S<2>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|N<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2290	0.270	2	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.1442	0.938	5	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Li<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.3820	0.052	2	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Li<5>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.4170	0.000	1	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.7770	0.285	3	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.7763	0.375	16	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Rh<8>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.5670	0.000	1	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.7555	0.029	2	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.3780	0.000	1	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Cr<5>,1|C<3>,2|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Cr<5>,1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.8035	0.429	2	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Cr<6>,1|C<3>,2|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Cr<6>,1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.6277	0.341	3	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Cr<7>,1|C<3>,2|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Cr<7>,1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.6615	0.155	2	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ir<6>,1|C<3>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|N<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.5730	0.170	4	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ag<2>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.9990	0.180	4	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Al<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.2714	0.506	7	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Al<5>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.2283	0.169	4	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Au<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.1287	0.405	26	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Au<5>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.3604	0.254	5	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|B<3>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.0622	0.452	5	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.4700	0.136	2	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Cd<6>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.7320	0.123	2	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Co<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.3323	0.204	3	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Co<5>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.2920	0.280	2	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Co<6>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.6665	0.175	2	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Cr<6>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.2901	0.147	10	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|H<1>,1|N<2>,2|C<3>}	H(C[6]C[6]2)	120.5370	0.000	1	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.3034	0.445	33	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Cu<5>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.4195	0.492	4	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Fe<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.0335	0.515	11	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Fe<5>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.4887	0.404	3	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.0600	0.000	1	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ga<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	121.0250	1.228	2	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|O<1>,2|C<3>}	H(C[6]C[6]2)	121.5420	0.000	1	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|H<1>,1|N<2>,2|C<3>}	H(C[6]C[6]2)	121.1200	0.359	2	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.5532	0.267	4	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ir<8>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.1540	0.006	2	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Mn<6>,1|H<1>,1|N<2>,2|C<3>}	H(C[6]C[6]2)	120.9230	0.000	1	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Mn<6>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.6871	0.215	8	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Mo<5>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.4800	0.031	2	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Mo<6>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.6220	0.000	1	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|N<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	117.4400	0.000	1	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ni<4>,1|H<1>,1|N<2>,2|C<3>}	H(C[6]C[6]2)	122.9740	0.000	1	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ni<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.4906	0.327	5	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ni<5>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.4640	0.100	2	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	121.2080	0.000	1	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Os<7>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.8610	0.000	1	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.9622	0.459	33	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.6864	0.501	96	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pt<6>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.8627	0.551	22	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Re<6>,1|H<1>,1|N<2>,2|C<3>}	H(C[6]C[6]2)	120.5886	0.568	7	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Re<6>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.4920	0.136	2	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|H<1>,1|N<2>,2|C<3>}	H(C[6]C[6]2)	120.6690	0.000	1	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.3231	0.349	7	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Zn<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.2670	0.287	4	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Zn<5>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.1653	0.208	4	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.5087	0.472	6	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Rh<8>,1|C<3>,2|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Rh<8>,1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.5720	0.163	2	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Rh<9>,1|C<3>,2|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Rh<9>,1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.3957	0.318	3	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ti<7>,1|C<3>,2|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ti<7>,1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.6605	0.318	4	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Zr<11>,1|C<3>,2|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Zr<11>,1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.1615	0.067	2	120.1959	0.407	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]Ga[6]Si)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ga<3>,2|Si<4>}	C[6](C[6]Ga[6]Si)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	116.3045	0.070	2	116.3045	0.005	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]Ge[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ge<3>,1|C<4>,1|H<1>}	C[6](C[6]Ge[6]C)(C[6]C[6]H)(H){1|Ru<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	118.0060	0.000	1	118.0060	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]Ge[6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ge<3>,1|C<4>,1|H<1>}	C[6](C[6]Ge[6]H)(C[6]C[6]H)(H){1|Ru<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	118.0010	0.000	1	117.5060	0.224	3	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]Ge[6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ge<3>,2|H<1>}	C[6](C[6]Ge[6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	117.2585	0.285	2	117.5060	0.224	3	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]In[6]Si)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|In<3>,2|Si<4>}	C[6](C[6]In[6]Si)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	115.4175	0.105	2	115.4175	0.011	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Al<5>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.2610	0.000	1	119.6209	0.305	301	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Cr<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.3380	0.000	2	119.6209	0.305	301	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Cr<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.1905	0.210	2	119.6209	0.305	301	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Fe<5>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.8360	0.614	4	119.6209	0.305	301	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.2443	0.585	14	119.6209	0.305	301	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.3867	0.208	3	119.6209	0.305	301	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Li<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.4555	0.095	2	119.6209	0.305	301	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Mn<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.6245	0.094	2	119.6209	0.305	301	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.2852	0.429	6	119.6209	0.305	301	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.3030	0.000	1	119.6209	0.305	301	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.1630	0.000	1	119.6209	0.305	301	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ru<5>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.8940	0.000	1	119.6209	0.305	301	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.1374	0.389	8	119.6209	0.305	301	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Sm<14>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.9260	0.000	1	119.6209	0.305	301	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Zn<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.6447	0.460	3	119.6209	0.305	301	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Zn<5>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.1590	0.000	1	119.6209	0.305	301	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,2|N<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.4080	0.000	1	119.6209	0.305	301	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,2|N<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.1000	0.285	6	119.6209	0.305	301	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,2|N<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Zn<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.7127	0.092	4	119.6209	0.305	301	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Cu<3>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.1190	0.000	1	119.6209	0.305	301	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.7560	0.000	1	119.6209	0.305	301	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Fe<5>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.1830	0.000	1	119.6209	0.305	301	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.3114	0.100	8	119.6209	0.305	301	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|In<6>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.3270	0.000	1	119.6209	0.305	301	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.4455	0.573	2	119.6209	0.305	301	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.3890	0.000	1	119.6209	0.305	301	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.8310	0.912	2	119.6209	0.305	301	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ir<8>,1|B<3>,1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.7080	0.000	1	119.6209	0.305	301	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ir<8>,1|B<3>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.8420	0.000	1	119.6209	0.305	301	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ir<8>,1|H<1>,1|N<2>,2|C<3>}	H(C[6]C[6]2)	120.2765	0.561	2	119.6209	0.305	301	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ir<8>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.2495	0.142	2	119.6209	0.305	301	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ir<8>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.2740	0.000	1	119.6209	0.305	301	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Mn<6>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.2235	0.106	4	119.6209	0.305	301	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Os<9>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.5180	0.000	1	119.6209	0.305	301	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.0950	0.102	5	119.6209	0.305	301	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.0512	0.300	12	119.6209	0.305	301	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Pd<6>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.2760	0.039	4	119.6209	0.305	301	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Re<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.2910	0.403	2	119.6209	0.305	301	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Re<6>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.9385	0.520	11	119.6209	0.305	301	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Rh<5>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.2225	0.282	2	119.6209	0.305	301	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Rh<6>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.9370	0.152	3	119.6209	0.305	301	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Rh<8>,1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3180	0.074	2	119.6209	0.305	301	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Rh<8>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.1150	0.130	2	119.6209	0.305	301	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.2340	0.000	1	119.6209	0.305	301	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.1171	0.288	12	119.6209	0.305	301	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ru<8>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.5510	0.000	1	119.6209	0.305	301	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ru<8>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.2020	0.042	3	119.6209	0.305	301	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ru<9>,1|H<1>,1|N<2>,2|C<3>}	H(C[6]C[6]2)	120.2660	0.233	4	119.6209	0.305	301	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ru<9>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.9277	0.510	3	119.6209	0.305	301	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<4>,2|N<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){2|Cu<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.7110	0.061	2	119.6209	0.305	301	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|O<2>,2|N<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ir<8>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.7883	0.051	3	119.6209	0.305	301	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){3|N<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ba<7>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.8815	0.053	2	119.6209	0.305	301	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){3|N<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.7785	0.037	2	119.6209	0.305	301	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){3|N<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ca<6>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.4053	0.228	6	119.6209	0.305	301	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){3|N<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Co<5>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.6153	0.305	8	119.6209	0.305	301	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){3|N<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.8030	0.221	2	119.6209	0.305	301	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){3|N<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Cu<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.3593	0.095	6	119.6209	0.305	301	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){3|N<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Fe<5>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.9910	0.212	2	119.6209	0.305	301	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){3|N<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.1578	0.264	45	119.6209	0.305	301	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){3|N<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.4780	0.538	10	119.6209	0.305	301	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){3|N<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|H<1>,1|V<6>,3|C<3>}	H(C[6]C[6]2)	119.0630	0.357	4	119.6209	0.305	301	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){3|N<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Mg<6>,1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.4865	0.005	2	119.6209	0.305	301	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){3|N<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	118.9423	0.092	4	119.6209	0.305	301	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){3|N<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.0040	0.000	1	119.6209	0.305	301	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){3|N<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	118.8260	0.000	2	119.6209	0.305	301	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){3|N<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.1770	0.220	6	119.6209	0.305	301	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){3|N<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.4636	0.680	25	119.6209	0.305	301	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){3|N<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ru<9>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.1965	0.095	2	119.6209	0.305	301	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){3|N<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Sr<7>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.7575	0.098	2	119.6209	0.305	301	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){3|N<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Zn<5>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.5750	0.000	1	119.6209	0.305	301	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){3|N<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Zn<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.1470	0.377	4	119.6209	0.305	301	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){3|N<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.0200	0.000	1	119.6209	0.305	301	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[5a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<2>,1|N<3>}	C[6](C[6]N[5a]C[6])(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	119.6070	0.000	1	120.2693	0.458	3	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[5a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[5a]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|O<1>,2|C<3>}	H(C[6]C[6]2)	120.2420	0.000	1	120.2693	0.458	3	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[5a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>}	C[6](C[6]N[5a]C[6])(C[6]C[6]H)(H){1|C<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.9590	0.000	1	120.2693	0.458	3	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	C[6](C[6]N[5a]N[6])(C[6]C[6]H)(H){1|Mn<6>,1|H<1>,1|N<2>,2|C<3>}	H(C[6]C[6]2)	120.5380	0.000	1	120.1242	0.242	17	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]N[5a]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.0840	0.355	5	120.1242	0.242	17	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]N[5a]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.5104	0.165	5	120.1242	0.242	17	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]N[5a]N[6])(C[6]C[6]H)(H){1|Re<6>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.3050	0.079	2	120.1242	0.242	17	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]N[5a]N[6])(C[6]C[6]H)(H){1|Ru<8>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.4670	0.000	1	120.1242	0.242	17	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){3|N<3>}	C[6](C[6]N[5a]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.7995	0.425	2	120.1242	0.242	17	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[5a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){3|N<3>}	C[6](C[6]N[5a]N[6])(C[6]C[6]H)(H){2|H<1>,3|C<3>}	H(C[6]C[6]2)	118.9250	0.000	1	120.1242	0.242	17	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]Al)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Al<4>,1|C<4>,1|N<3>}	C[6](C[6]N[6]Al)(C[6]C[6]H)(H){1|Li<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6263	0.107	12	120.5574	0.032	18	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]Al)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Al<4>,1|H<1>,1|N<3>}	C[6](C[6]N[6]Al)(C[6]C[6]H)(H){1|Li<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4197	0.220	6	120.5574	0.032	18	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]As)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|As<3>,1|C<4>,1|N<3>}	C[6](C[6]N[6]As)(C[6]C[6]H)(H){1|Co<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7920	0.137	2	120.5812	0.069	6	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]As)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|As<3>,1|C<4>,1|N<3>}	C[6](C[6]N[6]As)(C[6]C[6]H)(H){1|Ni<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6870	0.124	2	120.5812	0.069	6	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]As)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|As<4>,1|C<4>,1|N<3>}	C[6](C[6]N[6]As)(C[6]C[6]H)(H){1|Co<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2645	0.021	2	120.5812	0.069	6	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]Br)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Br<1>,1|C<3>,1|N<3>}	C[6](C[6]N[6]Br)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.4770	0.000	1	119.9573	1.782	49	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]Br)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Br<1>,1|C<3>,1|N<3>}	C[6](C[6]N[6]Br)(C[6]C[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7095	0.223	2	119.9573	1.782	49	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]Br)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Br<1>,1|C<3>,1|N<3>}	C[6](C[6]N[6]Br)(C[6]C[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4450	0.220	3	119.9573	1.782	49	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]Br)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Br<1>,1|C<3>,1|N<3>}	C[6](C[6]N[6]Br)(C[6]C[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4898	0.295	8	119.9573	1.782	49	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]Br)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Br<1>,1|C<3>,1|N<3>}	C[6](C[6]N[6]Br)(C[6]C[6]H)(H){1|Os<9>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3590	0.000	1	119.9573	1.782	49	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]Br)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Br<1>,1|C<4>,1|N<3>}	C[6](C[6]N[6]Br)(C[6]C[6]H)(H){1|Fe<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3270	0.000	1	119.9573	1.782	49	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]Br)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Br<1>,1|C<4>,1|N<3>}	C[6](C[6]N[6]Br)(C[6]C[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.1340	0.000	1	119.9573	1.782	49	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]Br)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Br<1>,1|C<4>,1|N<3>}	C[6](C[6]N[6]Br)(C[6]C[6]H)(H){1|Ru<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5148	0.114	4	119.9573	1.782	49	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]Br)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Br<1>,1|C<4>,1|N<3>}	C[6](C[6]N[6]Br)(C[6]C[6]H)(H){1|Ru<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8817	0.429	3	119.9573	1.782	49	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]Br)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Br<1>,1|C<4>,1|N<3>}	C[6](C[6]N[6]Br)(C[6]C[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2905	0.593	2	119.9573	1.782	49	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]Br)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Br<1>,1|H<1>,1|N<3>}	C[6](C[6]N[6]Br)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.4440	0.000	1	119.9573	1.782	49	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]Br)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Br<1>,1|H<1>,1|N<3>}	C[6](C[6]N[6]Br)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	118.8331	2.373	11	119.9573	1.782	49	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]Br)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Br<1>,1|N<2>,1|N<3>}	C[6](C[6]N[6]Br)(C[6]C[6]H)(H){1|Ir<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5290	0.000	1	119.9573	1.782	49	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]Br)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Br<1>,2|N<3>}	C[6](C[6]N[6]Br)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.4540	0.418	6	119.9573	1.782	49	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]Br)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Br<1>,2|N<3>}	C[6](C[6]N[6]Br)(C[6]C[6]H)(H){1|Ir<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5040	0.000	1	119.9573	1.782	49	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]Br)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Br<2>,1|H<1>,1|N<3>}	C[6](C[6]N[6]Br)(C[6]C[6]H)(H){1|Cu<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9050	0.000	1	119.9573	1.782	49	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]Br)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){2|Br<1>,1|N<3>}	C[6](C[6]N[6]Br)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	121.1930	0.037	2	119.9573	1.782	49	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Cl<1>,1|C<3>,1|N<3>}	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3900	0.280	2	120.2509	0.373	41	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Cl<1>,1|C<3>,1|N<3>}	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7411	1.040	7	120.2509	0.373	41	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Cl<1>,1|C<3>,1|N<3>}	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H){1|Re<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.8190	0.000	1	120.2509	0.373	41	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Cl<1>,1|C<4>,1|N<3>}	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H){1|Fe<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3095	0.146	2	120.2509	0.373	41	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Cl<1>,1|C<4>,1|N<3>}	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2078	0.414	4	120.2509	0.373	41	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Cl<1>,1|H<1>,1|N<3>}	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.2910	0.134	4	120.2509	0.373	41	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Cl<1>,1|H<1>,1|N<3>}	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8119	0.240	8	120.2509	0.373	41	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Cl<1>,1|H<1>,1|N<3>}	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.8200	0.000	1	120.2509	0.373	41	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Cl<1>,1|H<1>,1|N<3>}	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1585	0.639	2	120.2509	0.373	41	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Cl<1>,1|N<2>,1|N<3>}	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H){1|Os<9>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6610	0.000	1	120.2509	0.373	41	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Cl<1>,1|N<3>,1|O<2>}	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.1830	0.000	1	120.2509	0.373	41	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Cl<1>,1|Ni<6>,1|N<3>,1|O<2>}	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H){1|Ni<6>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.8180	0.000	1	120.2509	0.373	41	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Cl<1>,2|N<3>}	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	121.2330	0.000	1	120.2509	0.373	41	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){2|Cl<1>,1|N<3>}	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H){1|Al<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1630	0.246	4	120.2509	0.373	41	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){2|Cl<1>,1|N<3>}	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H){1|B<3>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8530	0.139	2	120.2509	0.373	41	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]Fe)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Fe<5>,1|H<1>,1|N<3>}	C[6](C[6]N[6]Fe)(C[6]C[6]H)(H){1|Fe<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9600	0.000	1	119.9600	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ir<6>,1|C<3>,1|N<3>}	C[6](C[6]N[6]Ir)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.6735	0.099	4	119.8037	0.442	10	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ir<6>,1|C<4>,1|N<3>}	C[6](C[6]N[6]Ir)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.5020	0.000	1	119.8037	0.442	10	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ir<6>,1|H<1>,1|N<3>}	C[6](C[6]N[6]Ir)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.9520	0.000	1	119.8037	0.442	10	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ir<6>,1|H<1>,1|N<3>}	C[6](C[6]N[6]Ir)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.5960	0.000	1	119.8037	0.442	10	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ir<6>,1|N<3>,1|O<2>}	C[6](C[6]N[6]Ir)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	118.9930	0.000	1	119.8037	0.442	10	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ir<6>,1|Si<4>,1|N<3>}	C[6](C[6]N[6]Ir)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7450	0.000	1	119.8037	0.442	10	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ir<7>,1|H<1>,1|N<3>}	C[6](C[6]N[6]Ir)(C[6]C[6]H)(H){1|Ir<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.5550	0.000	1	119.8037	0.442	10	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]Mg)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Mg<5>,1|H<1>,1|N<3>}	C[6](C[6]N[6]Mg)(C[6]C[6]H)(H){1|Mg<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.9540	0.000	1	120.9540	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]Mo)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Mo<6>,1|H<1>,1|N<3>}	C[6](C[6]N[6]Mo)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9890	0.000	1	119.9890	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]Ni)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ni<4>,1|C<4>,1|N<3>}	C[6](C[6]N[6]Ni)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.6790	0.116	2	119.6790	0.013	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]Os)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Os<6>,1|C<4>,1|N<3>}	C[6](C[6]N[6]Os)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.6150	0.000	1	119.7548	0.058	5	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]Os)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Os<7>,1|C<4>,1|N<3>}	C[6](C[6]N[6]Os)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.7040	0.000	1	119.7548	0.058	5	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]Os)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Os<7>,1|C<4>,1|N<3>}	C[6](C[6]N[6]Os)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7420	0.404	2	119.7548	0.058	5	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]Os)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Os<8>,1|C<4>,1|N<3>}	C[6](C[6]N[6]Os)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9710	0.000	1	119.7548	0.058	5	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]Pd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Pd<4>,2|N<3>}	C[6](C[6]N[6]Pd)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.4390	0.000	1	119.4390	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]Rh)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Rh<4>,1|H<1>,1|N<3>}	C[6](C[6]N[6]Rh)(C[6]C[6]H)(H){1|Al<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5140	0.000	1	120.4520	0.008	3	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]Rh)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Rh<6>,1|H<1>,1|N<3>}	C[6](C[6]N[6]Rh)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.4210	0.098	2	120.4520	0.008	3	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ru<10>,1|H<1>,1|N<4>}	C[6](C[6]N[6]Ru)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.4515	0.063	2	119.0984	3.597	7	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ru<8>,1|C<3>,1|N<3>}	C[6](C[6]N[6]Ru)(C[6]C[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3540	0.000	1	119.0984	3.597	7	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ru<8>,1|H<1>,1|N<3>}	C[6](C[6]N[6]Ru)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.7090	0.045	2	119.0984	3.597	7	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ru<8>,1|H<1>,1|N<3>}	C[6](C[6]N[6]Ru)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	114.8670	0.000	1	119.0984	3.597	7	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ru<9>,1|H<1>,1|N<3>}	C[6](C[6]N[6]Ru)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1470	0.000	1	119.0984	3.597	7	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]Se)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Se<1>,1|H<1>,1|N<3>}	C[6](C[6]N[6]Se)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9080	0.000	1	120.2415	0.180	8	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]Se)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Se<2>,1|H<1>,1|N<3>}	C[6](C[6]N[6]Se)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	120.2120	0.000	1	120.2415	0.180	8	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]Se)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Se<2>,1|H<1>,1|N<3>}	C[6](C[6]N[6]Se)(C[6]C[6]H)(H){1|Mo<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1320	0.000	1	120.2415	0.180	8	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]Se)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Se<2>,1|H<1>,1|N<3>}	C[6](C[6]N[6]Se)(C[6]C[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9410	0.000	1	120.2415	0.180	8	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]Se)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Se<2>,1|H<1>,1|N<3>}	C[6](C[6]N[6]Se)(C[6]C[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.0640	0.000	1	120.2415	0.180	8	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]Se)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Se<2>,1|H<1>,1|N<3>}	C[6](C[6]N[6]Se)(C[6]C[6]H)(H){1|Sn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2250	0.429	3	120.2415	0.180	8	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]Si)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ir<6>,1|Si<4>,1|N<3>}	C[6](C[6]N[6]Si)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7420	0.000	1	120.5642	0.224	39	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]Si)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Si<4>,1|C<4>,1|N<3>}	C[6](C[6]N[6]Si)(C[6]C[6]H)(H){1|Co<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.8640	0.000	1	120.5642	0.224	39	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]Si)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Si<4>,1|C<4>,1|N<3>}	C[6](C[6]N[6]Si)(C[6]C[6]H)(H){1|Fe<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7710	0.010	2	120.5642	0.224	39	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]Si)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Si<4>,1|C<4>,1|N<3>}	C[6](C[6]N[6]Si)(C[6]C[6]H)(H){1|Mo<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.9690	0.035	3	120.5642	0.224	39	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]Si)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Si<4>,1|H<1>,1|N<3>}	C[6](C[6]N[6]Si)(C[6]C[6]H)(H){1|Al<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6220	0.000	1	120.5642	0.224	39	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]Si)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Si<4>,1|H<1>,1|N<3>}	C[6](C[6]N[6]Si)(C[6]C[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.9015	0.565	2	120.5642	0.224	39	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]Si)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Si<4>,1|H<1>,1|N<3>}	C[6](C[6]N[6]Si)(C[6]C[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7198	0.281	10	120.5642	0.224	39	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]Si)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Si<4>,1|H<1>,1|N<3>}	C[6](C[6]N[6]Si)(C[6]C[6]H)(H){1|Pt<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.8118	0.408	6	120.5642	0.224	39	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]Si)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Si<5>,1|C<4>,1|N<3>}	C[6](C[6]N[6]Si)(C[6]C[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5995	0.152	2	120.5642	0.224	39	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]Si)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Si<5>,1|H<1>,1|N<3>}	C[6](C[6]N[6]Si)(C[6]C[6]H)(H){1|Cu<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.8540	0.000	1	120.5642	0.224	39	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]Si)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Si<5>,1|H<1>,1|N<3>}	C[6](C[6]N[6]Si)(C[6]C[6]H)(H){1|Pt<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1623	0.383	8	120.5642	0.224	39	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]Si)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){2|Si<4>,1|N<3>}	C[6](C[6]N[6]Si)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.5525	0.074	2	120.5642	0.224	39	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]Sn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Sn<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6]Sn)(C[6]C[6]H)(H){1|Al<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5768	0.554	4	120.6529	0.256	8	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]Sn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Sn<4>,1|H<1>,1|N<3>}	C[6](C[6]N[6]Sn)(C[6]C[6]H)(H){1|Al<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7290	0.524	4	120.6529	0.256	8	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]Th)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Th<14>,1|H<1>,1|N<3>}	C[6](C[6]N[6]Th)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.4720	0.000	1	119.4720	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]Zr)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Zr<13>,1|C<2>,1|N<3>}	C[6](C[6]N[6]Zr)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.7760	0.000	1	119.9433	0.037	3	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]Zr)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Zr<13>,1|H<1>,1|N<3>}	C[6](C[6]N[6]Zr)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1530	0.000	1	119.9433	0.037	3	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]Zr)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Zr<9>,1|C<4>,1|N<3>}	C[6](C[6]N[6]Zr)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9010	0.000	1	119.9433	0.037	3	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]N[6a]N[6])(C[6]C[6]H)(H){1|H<1>,1|O<1>,3|C<3>}	H(C[6]C[6]2)	120.8437	0.158	3	120.5902	0.133	5	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	C[6](C[6]N[6a]N[6])(C[6]C[6]H)(H){1|Ir<8>,1|B<3>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.2100	0.049	2	120.5902	0.133	5	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]P[6]Cl)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Cl<1>,1|H<1>,1|P<3>}	C[6](C[6]P[6]Cl)(C[6]C[6]H)(H){1|Re<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	118.2046	0.415	5	118.2046	0.172	5	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]Si[6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Si<4>,1|C<3>}	C[6](C[6]Si[6]C[6])(C[6]C[6]H)(H){1|C<2>,1|C<3>,2|H<1>,2|O<2>}	H(C[6]C[6]2)	121.2630	0.000	1	121.2630	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	119.8792	0.170	4	119.6623	0.068	9	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.2460	0.000	1	119.6623	0.068	9	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	119.5495	0.118	4	119.6623	0.068	9	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<4>}	C[6](C[6]C[6]H)2(H){1|Ir<7>,2|C<4>}	H(C[6]C[6]2)	120.0420	0.328	2	120.0420	0.108	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[4])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[4])(C[6]C[6]H)(H){1|C<4>,1|O<2>,2|C<3>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<2>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	124.8410	0.000	1	124.8410	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[5])(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]C[6]H)(H){1|C<3>,1|H<1>,4|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.6370	0.000	1	119.6370	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[5])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]I)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]C[6]H)(H){1|C<2>,1|H<1>,1|I<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]C[6]I)(H){1|C<3>,1|N<3>}	H(C[6]C[6]2)	125.9460	0.000	1	125.9460	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[5])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|H<1>,1|N<2>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|N<3>}	H(C[6]C[6]2)	128.3010	0.000	1	128.3010	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[5])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|N<3>}	H(C[6]C[6]2)	121.0490	0.434	3	120.8623	0.265	4	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[5])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|N<3>}	H(C[6]C[6]2)	120.3020	0.000	1	120.8623	0.265	4	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|C<3>,1|C<4>,1|N<2>,1|N<3>}	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H){1|Fe<10>,1|C<3>,1|H<1>,1|N<3>,2|C<4>}	H(C[6]C[6]2)	120.0490	0.000	1	120.0797	0.040	6	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|C<4>,1|N<3>,2|C<3>}	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H){1|Fe<10>,1|C<3>,1|H<1>,1|N<3>,2|C<4>}	H(C[6]C[6]2)	120.0305	0.105	2	120.0797	0.040	6	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|C<4>,1|N<3>,2|C<3>}	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H){1|Fe<10>,1|C<3>,1|H<1>,1|N<3>,2|C<4>}	H(C[6]C[6]2)	120.1227	0.298	3	120.0797	0.040	6	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[5x3,5x5,20x6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|C<6>,1|N<3>,2|C<3>}	C[6](C[6]C[5x3,5x5,20x6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<5>,1|H<1>,1|N<3>,4|B<6>}	H(C[6]C[6]2)	120.0020	0.000	1	120.0463	0.025	3	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[5x3,5x5,20x6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|C<6>,1|N<3>,2|C<3>}	C[6](C[6]C[5x3,5x5,20x6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<6>,1|H<1>,1|N<3>,4|B<6>}	H(C[6]C[6]2)	120.0685	0.216	2	120.0463	0.025	3	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|N<3>,3|C<3>}	C[6](C[6]C[6]2)(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.2259	0.402	15	120.2259	0.162	15	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]B)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|B<3>,1|N<3>,2|C<3>}	C[6](C[6]C[6]B)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5570	0.000	1	120.5570	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]Br)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Br<1>,1|C<3>,1|C<4>,1|H<1>,1|O<1>,1|O<2>}	C[6](C[6]C[6]Br)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.4200	0.000	1	120.0643	0.211	8	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]Br)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Br<1>,1|Ir<6>,1|N<3>,2|C<3>}	C[6](C[6]C[6]Br)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4000	0.311	3	120.0643	0.211	8	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]Br)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Br<1>,1|Re<6>,1|N<3>,2|C<3>}	C[6](C[6]C[6]Br)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8135	0.521	2	120.0643	0.211	8	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]Br)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Br<1>,1|Ru<6>,1|N<3>,2|C<3>}	C[6](C[6]C[6]Br)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1335	0.354	2	120.0643	0.211	8	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Co<6>,1|N<3>,3|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4510	0.150	4	120.2417	0.292	250	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Co<8>,1|C<4>,1|N<3>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6940	0.000	1	120.2417	0.292	250	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cr<6>,1|C<4>,1|N<3>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4140	0.033	2	120.2417	0.292	250	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|C<2>,1|N<3>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2660	0.298	3	120.2417	0.292	250	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|C<4>,1|N<3>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6844	0.578	9	120.2417	0.292	250	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|N<3>,3|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3460	0.485	4	120.2417	0.292	250	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<5>,1|C<4>,1|N<3>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3526	0.328	14	120.2417	0.292	250	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<5>,1|N<3>,3|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3225	0.015	2	120.2417	0.292	250	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<6>,1|C<4>,1|N<3>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8965	0.390	2	120.2417	0.292	250	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Eu<13>,1|C<4>,1|N<3>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1050	0.180	2	120.2417	0.292	250	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|C<4>,1|N<3>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2652	0.196	16	120.2417	0.292	250	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|N<3>,3|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3810	0.106	5	120.2417	0.292	250	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Hg<4>,1|C<4>,1|N<3>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5840	0.257	2	120.2417	0.292	250	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|C<2>,1|N<3>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.4350	0.000	1	120.2417	0.292	250	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|N<3>,3|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4370	0.208	2	120.2417	0.292	250	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Mo<6>,1|N<3>,3|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4080	0.170	2	120.2417	0.292	250	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ni<4>,1|C<4>,1|N<3>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2110	0.141	4	120.2417	0.292	250	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|C<4>,1|N<3>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2199	0.383	9	120.2417	0.292	250	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|N<3>,3|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3393	0.026	3	120.2417	0.292	250	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|C<2>,1|N<3>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8590	0.000	1	120.2417	0.292	250	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|C<4>,1|N<3>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1713	0.273	6	120.2417	0.292	250	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|N<3>,3|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8982	0.285	6	120.2417	0.292	250	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|C<2>,1|N<3>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0313	0.474	40	120.2417	0.292	250	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|C<4>,1|N<3>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3254	0.362	21	120.2417	0.292	250	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|N<3>,3|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1986	0.701	5	120.2417	0.292	250	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pt<6>,1|C<4>,1|N<3>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2070	0.607	2	120.2417	0.292	250	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pt<6>,1|N<3>,3|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.9610	2.276	7	120.2417	0.292	250	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Re<6>,1|C<2>,1|N<3>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2081	0.298	7	120.2417	0.292	250	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Re<6>,1|C<4>,1|N<3>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1595	0.253	13	120.2417	0.292	250	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Re<6>,1|N<3>,3|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2680	0.052	2	120.2417	0.292	250	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Rh<8>,1|N<3>,3|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9928	0.343	4	120.2417	0.292	250	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|C<2>,1|N<3>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2353	0.306	3	120.2417	0.292	250	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|C<4>,1|N<3>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8865	0.435	11	120.2417	0.292	250	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|N<3>,3|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2601	0.367	14	120.2417	0.292	250	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ru<8>,1|C<2>,1|N<3>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3590	0.000	1	120.2417	0.292	250	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ru<9>,1|C<4>,1|N<3>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3915	0.183	2	120.2417	0.292	250	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Zn<4>,1|C<4>,1|N<3>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2912	0.480	4	120.2417	0.292	250	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Zn<5>,1|C<4>,1|N<3>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4970	0.209	2	120.2417	0.292	250	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Zn<6>,1|C<4>,1|N<3>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3308	0.343	12	120.2417	0.292	250	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cl<1>,1|C<2>,1|H<1>,2|C<3>}	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|C<3>,1|N<3>}	H(C[6]C[6]2)	120.1500	0.000	1	120.1557	0.080	4	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cl<1>,1|Re<6>,1|N<3>,2|C<3>}	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1577	0.347	3	120.1557	0.080	4	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]F)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ru<9>,1|F<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]F)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1224	0.282	5	120.1224	0.079	5	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Co<6>,2|C<3>,2|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8520	0.219	2	119.7130	0.150	19	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Fe<5>,1|C<4>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	118.8630	0.000	1	119.7130	0.150	19	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Fe<6>,2|C<3>,2|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8318	0.203	5	119.7130	0.150	19	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.4335	0.138	2	119.7130	0.150	19	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ir<6>,2|C<3>,2|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.6740	0.000	1	119.7130	0.150	19	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|N<2>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.5590	0.037	2	119.7130	0.150	19	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pt<4>,2|C<3>,2|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1770	0.000	1	119.7130	0.150	19	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pt<6>,2|C<3>,2|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7970	0.542	5	119.7130	0.150	19	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ir<8>,1|N<3>,1|O<2>,2|C<3>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0330	0.351	2	120.0330	0.123	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|N<3>}	H(C[6]C[6]2)	120.9549	0.126	7	120.9534	0.014	8	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.9430	0.000	1	120.9534	0.014	8	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ag<3>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.4475	0.054	2	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ag<3>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3915	0.365	4	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ag<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.6060	0.130	4	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ag<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2287	0.761	23	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ag<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	121.1680	0.533	2	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ag<5>,1|H<1>,1|N<2>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6350	0.000	1	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ag<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8107	0.482	8	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ag<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.6340	0.570	2	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ag<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5660	0.010	2	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Al<5>,1|C<3>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2220	0.000	1	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Al<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4616	0.237	8	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Al<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|P<4>}	H(C[6]C[6]2)	120.7253	0.223	9	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Al<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.9654	0.235	14	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Al<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7075	0.940	6	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Al<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	121.7790	0.536	2	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Au<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.4800	0.552	2	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Au<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2020	0.000	1	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Au<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.8130	0.000	1	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ba<12>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2060	0.058	2	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Bi<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7640	0.546	2	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Bi<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3675	0.077	2	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Bi<7>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5245	0.025	2	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Bi<7>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.7575	0.247	2	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|O<1>,2|O<2>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.3830	0.168	3	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>,1|O<2>,2|C<4>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.3440	0.000	1	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|C<3>,1|N<2>,1|N<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5110	0.000	1	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|C<3>,1|O<1>,2|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	H(C[6]C[6]2)	119.2867	0.154	3	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|C<3>,2|H<1>,2|N<2>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6610	0.140	3	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7182	1.087	6	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|V<7>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.0830	0.245	2	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|V<8>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.8100	0.119	2	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cd<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.4450	0.048	3	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cd<5>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7938	1.358	4	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cd<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2913	0.297	18	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cd<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.6202	0.299	6	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cd<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4713	0.895	70	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cd<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.5363	0.191	6	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cd<7>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1960	0.276	4	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Co<4>,1|C<3>,1|C<4>,1|N<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	118.7860	0.000	1	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Co<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	121.2721	1.757	10	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Co<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1284	0.402	13	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Co<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.5983	0.099	4	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Co<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4694	0.404	22	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Co<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	H(C[6]C[6]2)	121.3235	1.302	2	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Co<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.7747	0.329	3	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Co<6>,1|C<2>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5850	0.000	1	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Co<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8734	0.423	29	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Co<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	121.0820	0.000	1	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Co<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6735	0.306	2	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Co<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.8977	0.331	3	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Co<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<2>,1|C<3>,1|N<3>}	H(C[6]C[6]2)	120.1700	0.348	3	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Co<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.7322	0.148	13	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Co<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4573	0.576	475	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Co<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	120.4575	0.121	2	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Co<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.7379	0.364	105	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Co<7>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5756	0.593	34	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Co<8>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4963	0.186	3	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cr<4>,1|C<3>,1|C<4>,1|N<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2205	0.064	2	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cr<6>,1|C<3>,2|H<1>,2|N<3>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.2530	0.000	1	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cr<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.7020	0.000	1	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cr<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4736	0.650	65	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cr<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.5905	0.312	25	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cr<8>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2475	0.276	4	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cr<8>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.9970	0.106	2	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cr<9>,1|Pd<4>,1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1077	0.409	7	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cr<9>,1|Pd<5>,1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0830	0.000	1	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cr<9>,1|Ru<6>,1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3220	0.183	10	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<3>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4235	0.447	4	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.7930	0.000	1	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.7000	2.851	10	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|H<1>,1|N<2>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.8928	0.196	4	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.6812	0.356	44	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3323	0.579	87	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.6715	0.301	4	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.4949	0.218	50	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|H<1>,1|N<4>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3255	0.100	2	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<5>,1|C<2>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	122.9210	0.935	2	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<5>,1|C<2>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>}	H(C[6]C[6]2)	123.7040	1.735	2	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<5>,1|C<3>,1|C<4>,1|N<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7050	0.081	2	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6947	0.266	10	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.6091	0.121	9	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5778	0.796	305	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.9437	0.145	4	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	121.0029	0.441	39	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<6>,1|C<3>,1|C<4>,1|N<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6670	0.232	6	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<6>,1|C<3>,1|N<3>,1|N<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.7040	0.000	1	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.9335	0.101	2	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4397	0.512	70	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.9385	0.114	2	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<7>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5425	0.148	2	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Eu<10>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9265	0.252	2	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Eu<10>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.5800	0.136	2	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Eu<13>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7955	0.026	2	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Eu<13>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.6030	0.000	1	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Eu<8>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5715	0.216	2	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Eu<8>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1320	0.518	10	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Eu<8>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.6775	0.076	2	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Fe<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2676	0.233	5	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Fe<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|P<3>}	H(C[6]C[6]2)	120.8315	0.257	2	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Fe<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.6855	0.060	2	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Fe<5>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5950	0.173	2	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Fe<5>,1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2030	0.040	2	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Fe<5>,1|C<4>,1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.1885	0.845	2	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Fe<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.5078	0.201	6	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Fe<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3541	0.699	10	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Fe<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.6710	0.690	12	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|C<3>,1|C<4>,1|N<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6210	0.139	2	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6447	0.220	10	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.8690	0.092	3	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5365	0.039	2	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|Br<1>,1|C<3>,1|N<3>}	H(C[6]C[6]2)	120.3425	0.088	2	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.6303	0.219	21	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|F<1>,1|N<3>}	H(C[6]C[6]2)	120.3280	0.075	3	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3662	0.669	236	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	H(C[6]C[6]2)	120.8142	0.202	15	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|Cl<1>,1|C<3>,1|N<3>}	H(C[6]C[6]2)	120.4235	0.176	8	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.7985	1.067	57	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Fe<7>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.5320	0.000	1	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Fe<8>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.5041	0.204	11	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.6190	0.524	5	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.2550	0.000	1	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<2>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.4764	0.461	21	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|V<5>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	123.4200	2.475	2	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|V<5>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	121.0735	1.776	2	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|V<6>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8633	1.323	19	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|V<7>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|B<4>,1|C<3>,1|N<3>}	H(C[6]C[6]2)	120.6190	0.000	1	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|V<7>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2295	0.291	2	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|V<7>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	H(C[6]C[6]2)	120.3990	0.000	1	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|V<7>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.6765	0.244	2	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|V<8>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5400	0.277	4	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|W<6>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.3160	0.000	1	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|W<6>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1673	0.208	6	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|W<8>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1315	0.336	2	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|H<1>,1|P<3>,1|W<6>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8945	0.456	4	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|Br<1>,1|C<2>,1|N<3>}	H(C[6]C[6]2)	121.1710	0.000	1	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Hg<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.2375	0.538	2	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Hg<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0075	0.600	6	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Hg<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5348	0.418	8	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Hg<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.4155	0.221	2	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ir<11>,1|Ir<8>,1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6510	0.000	1	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|C<3>,1|C<4>,1|N<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	H(C[6]C[6]2)	120.1740	0.000	1	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3830	0.277	2	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<2>,1|C<3>,1|N<3>}	H(C[6]C[6]2)	120.3130	0.000	1	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2446	0.611	86	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.7434	0.614	19	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3844	0.509	8	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ir<7>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3277	0.194	4	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ir<8>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5475	0.548	30	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ir<8>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.9283	0.266	6	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ir<8>,1|H<1>,1|O<2>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7420	0.000	1	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Li<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|B<4>,1|C<3>,1|N<3>}	H(C[6]C[6]2)	120.3015	0.025	2	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Li<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.4350	0.311	2	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Li<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4300	0.140	2	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Li<5>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6990	0.141	2	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Li<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5640	0.130	2	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Li<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.6520	0.085	2	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Mg<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4530	0.116	2	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Mg<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6130	0.358	2	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Mg<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3087	0.370	3	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Mn<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2590	0.000	1	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Mn<5>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.8228	1.927	6	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Mn<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4367	0.989	22	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Mn<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.6795	1.856	6	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4588	0.522	11	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Mn<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.7040	0.154	4	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Mn<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3792	0.735	271	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Mn<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.6289	0.093	12	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Mn<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	H(C[6]C[6]2)	120.8920	0.047	2	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Mn<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.4050	0.628	37	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Mn<7>,1|C<3>,1|C<4>,1|N<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2465	0.199	2	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Mn<7>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3073	0.934	11	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Mn<8>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6735	0.204	4	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Mo<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.9890	0.000	1	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Mo<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2687	0.487	46	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Mo<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.8610	0.177	7	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Mo<6>,1|H<1>,1|P<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.5900	0.000	1	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Mo<7>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0590	0.337	6	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Mo<7>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.4120	0.123	3	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Mo<8>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2098	0.118	5	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Mo<9>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	123.3420	0.000	1	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Mo<9>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3280	0.089	2	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2953	0.441	29	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.6640	0.407	2	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ni<4>,1|C<3>,1|C<4>,1|N<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2480	0.000	1	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ni<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.4960	0.315	3	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ni<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3969	1.107	38	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ni<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.9890	0.210	3	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ni<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	H(C[6]C[6]2)	120.6870	0.000	1	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ni<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.4995	0.779	8	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ni<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4821	0.177	11	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ni<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.6368	0.137	6	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|C<3>,1|C<4>,1|N<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3200	0.086	2	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|C<3>,1|C<4>,1|N<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	H(C[6]C[6]2)	120.9320	0.908	2	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8401	0.296	25	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	121.2045	0.339	2	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|C<3>,1|N<3>,1|N<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3740	0.000	1	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.8514	0.223	8	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5383	0.954	405	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	H(C[6]C[6]2)	121.2338	0.450	16	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	121.0888	1.193	66	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ni<7>,1|C<3>,1|C<4>,1|N<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2645	0.187	2	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ni<7>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5936	0.586	5	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Os<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1992	0.636	178	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Os<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.4695	0.367	16	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Os<8>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7095	0.554	2	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pd<3>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4985	0.062	2	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5973	0.277	7	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.5613	0.387	4	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.5723	0.246	3	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2717	0.464	157	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	119.9870	0.000	1	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	H(C[6]C[6]2)	120.6965	0.005	2	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.7935	0.200	25	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0570	0.000	1	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pd<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6850	2.585	2	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pd<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4597	0.340	4	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pd<7>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3180	0.205	4	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3133	0.496	4	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,1|N<2>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9247	0.511	3	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<2>,1|C<3>,1|N<3>}	H(C[6]C[6]2)	120.7640	0.000	1	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.3960	0.000	1	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2616	0.678	362	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.5898	0.355	4	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	H(C[6]C[6]2)	120.5923	0.194	9	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.8370	0.585	106	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5677	0.671	3	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pt<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2800	0.054	2	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pt<6>,1|C<2>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>}	H(C[6]C[6]2)	120.2030	0.000	1	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pt<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<2>,1|C<3>,1|N<3>}	H(C[6]C[6]2)	119.6480	0.000	1	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pt<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2396	0.367	63	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pt<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.5380	0.081	2	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Re<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0064	0.845	9	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Re<6>,1|C<3>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6060	0.000	1	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Re<6>,1|C<3>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	121.2680	0.000	1	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Re<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4932	0.558	10	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Re<6>,1|C<3>,1|H<1>,1|O<2>,2|N<3>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7390	0.000	1	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Re<6>,1|C<3>,1|O<2>,1|O<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	H(C[6]C[6]2)	120.3350	0.000	1	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Re<6>,1|C<3>,2|H<1>,2|O<2>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<4>}	H(C[6]C[6]2)	121.2860	0.000	1	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Re<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.5231	0.168	8	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Re<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2341	0.585	214	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Re<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|P<3>}	H(C[6]C[6]2)	118.2670	0.000	1	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Re<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	H(C[6]C[6]2)	120.4053	0.279	6	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Re<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|Cl<1>,1|C<3>,1|N<3>}	H(C[6]C[6]2)	120.5120	0.000	1	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Re<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.3105	0.369	15	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Re<7>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5125	0.107	2	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Re<7>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.6115	0.125	2	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Rh<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2045	0.439	4	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Rh<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.8035	0.322	2	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Rh<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6794	0.286	9	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Rh<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.5242	0.356	4	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Rh<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2829	0.223	15	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Rh<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.6595	0.193	2	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Rh<7>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9002	0.073	4	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Rh<8>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2848	0.196	19	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ru<10>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3175	0.168	2	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ru<12>,1|Ru<6>,1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5300	0.000	1	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ru<4>,1|C<3>,1|H<1>,1|O<3>,2|C<4>}	C[6](C[6]C[6]H)2(H){1|Br<1>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.0920	0.000	1	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ru<5>,1|C<3>,1|C<4>,1|N<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2890	0.000	1	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ru<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1778	0.150	5	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.9957	1.360	15	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.3400	0.489	2	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.6147	0.375	11	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2221	0.784	849	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.5727	0.271	4	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	H(C[6]C[6]2)	120.5925	0.060	2	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.6866	0.392	43	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ru<7>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2527	0.445	23	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ru<8>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2700	0.225	15	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ru<8>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|N<4>}	H(C[6]C[6]2)	120.3670	0.000	1	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ru<8>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	H(C[6]C[6]2)	120.6020	0.000	1	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ru<9>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<2>,1|C<3>,1|N<3>}	H(C[6]C[6]2)	120.2670	0.000	1	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ru<9>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|F<1>,1|N<3>}	H(C[6]C[6]2)	120.4445	0.066	2	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ru<9>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3308	0.135	24	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ru<9>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.7420	0.126	2	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ru<9>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	H(C[6]C[6]2)	121.0810	0.437	2	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Sb<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9730	0.000	1	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Sm<13>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5025	0.269	2	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Sm<14>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9730	0.000	1	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Sm<14>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	H(C[6]C[6]2)	120.6000	0.000	1	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Sm<15>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3600	0.303	2	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Sm<15>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.2265	0.073	2	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Sn<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3534	0.108	10	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Sn<7>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3978	0.162	4	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Sn<8>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2680	0.231	4	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Sr<12>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3835	0.011	2	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ta<8>,1|C<4>,1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.5832	0.707	6	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ti<11>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.4860	0.000	1	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ti<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.9190	0.000	1	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ti<7>,1|C<4>,1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.8515	0.233	2	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Zn<3>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.1970	0.000	1	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Zn<3>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|P<4>}	H(C[6]C[6]2)	121.2270	0.000	1	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Zn<4>,1|C<3>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1890	0.000	1	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Zn<4>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1740	0.000	1	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Zn<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.5590	0.187	8	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Zn<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4777	0.603	35	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Zn<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	H(C[6]C[6]2)	120.9193	0.432	3	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Zn<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.6226	0.178	5	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Zn<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5798	0.308	130	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Zn<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	H(C[6]C[6]2)	120.8995	0.213	2	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Zn<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.7371	0.236	20	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Zn<6>,1|C<3>,1|C<4>,1|N<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5820	0.318	2	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Zn<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7680	0.355	3	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Zn<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.6863	0.196	6	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Zn<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5059	0.804	95	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Zn<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	H(C[6]C[6]2)	120.8415	0.327	2	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Zn<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.7284	0.230	7	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Zr<10>,1|C<4>,1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.6820	0.000	1	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Zr<8>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0520	0.371	4	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){2|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3660	0.127	2	120.4354	0.520	6219	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<5>,2|C<3>,2|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<5>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	120.9270	0.018	2	120.8375	0.020	11	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ni<6>,2|C<3>,2|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ni<6>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	120.8176	0.152	9	120.8375	0.020	11	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|N<3>,3|C<3>}	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.1714	0.378	9	120.1691	0.119	20	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|N<3>,3|C<3>}	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.6340	0.000	1	120.1691	0.119	20	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|N<3>,3|C<3>}	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.2517	0.225	3	120.1691	0.119	20	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Mn<6>,1|N<3>,3|C<3>}	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.1460	0.000	1	120.1691	0.119	20	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|N<3>,3|C<3>}	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|C<6>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.4270	0.000	1	120.1691	0.119	20	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Re<6>,1|N<3>,3|C<3>}	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.0030	0.000	1	120.1691	0.119	20	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|N<3>,3|C<3>}	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	119.9688	0.415	4	120.1691	0.119	20	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]N[5a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Re<6>,2|C<3>,2|N<3>}	C[6](C[6]N[5a]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	119.9655	0.359	2	119.9655	0.129	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Ni)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Ni)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<4>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	119.4320	0.000	1	119.4320	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]P[5])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]P[5])(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,1|P<4>,3|C<4>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|P<4>,2|H<1>}	H(C[6]C[6]2)	120.3330	0.000	1	120.3330	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]P[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]P[6])(C[6]C[6]H)(H){1|C<2>,1|C<3>,2|H<1>,2|N<2>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|P<4>}	H(C[6]C[6]2)	126.2470	0.000	1	123.2785	17.624	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]P[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]P[6])(C[6]C[6]H)(H){1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<2>,1|H<1>,1|P<3>}	H(C[6]C[6]2)	120.3100	0.000	1	123.2785	17.624	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Pd)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Pd)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	119.8670	0.000	1	119.8670	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Pd)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Pd)(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Pd<4>,1|C<3>}	H(C[6]C[6]2)	120.0530	0.000	1	120.5697	0.795	3	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Pd)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Pd)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<4>}	C[6](C[6]C[6]H)2(H){1|Pd<5>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.8280	1.090	2	120.5697	0.795	3	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Pt)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Pt)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|O<1>}	H(C[6]C[6]2)	119.6815	0.498	10	119.7493	0.272	13	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Pt)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Pt)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<6>,1|C<3>,1|O<1>}	H(C[6]C[6]2)	120.7140	0.000	1	119.7493	0.272	13	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Pt)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Pt)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){2|Pt<4>,1|C<3>}	H(C[6]C[6]2)	119.6060	0.103	2	119.7493	0.272	13	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Sb)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Sb)(C[6]C[6]H)(H){1|C<2>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Sb<5>,1|C<3>}	H(C[6]C[6]2)	117.8940	7.838	2	117.8940	61.428	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Se)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Se)(C[6]C[6]H)(H){1|C<2>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Se<2>,1|C<3>}	H(C[6]C[6]2)	120.9040	3.336	2	120.9040	11.130	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Si)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Si)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|Si<4>,1|C<3>}	H(C[6]C[6]2)	119.3960	0.000	1	119.3960	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Si)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Si)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,1|Si<4>,1|C<3>}	H(C[6]C[6]2)	119.7706	0.201	16	119.7373	0.057	17	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Si)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Si)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Si<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.2050	0.000	1	119.7373	0.057	17	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Si)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Si)(C[6]C[6]H)(H){1|C<2>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Si<4>,1|C<3>}	H(C[6]C[6]2)	120.8556	5.051	8	120.4925	20.453	10	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Si)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Si)(C[6]C[6]H)(H){1|C<4>,1|N<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Si<4>,1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	118.7050	0.000	1	120.4925	20.453	10	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Si)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Si)(C[6]C[6]H)(H){2|Li<5>,1|C<5>,1|H<1>,1|S<3>}	C[6](C[6]C[6]H)2(H){1|Li<3>,1|Si<4>,2|Li<5>,1|C<5>}	H(C[6]C[6]2)	119.3750	0.000	1	120.4925	20.453	10	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Sn)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Sn)(C[6]C[6]H)(H){1|C<2>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Sn<4>,1|C<3>}	H(C[6]C[6]2)	120.4200	0.403	2	120.0653	1.627	4	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Sn)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Sn)(C[6]C[6]H)(H){1|C<2>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Sn<5>,1|C<3>}	H(C[6]C[6]2)	118.2590	0.000	1	120.0653	1.627	4	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Sn)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Sn)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Sn<5>,1|C<2>,1|H<1>}	H(C[6]C[6]2)	121.1620	0.000	1	120.0653	1.627	4	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Zr)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Zr)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Zr<14>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	118.8240	0.000	2	118.8240	0.000	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Zr)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Zr)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Zr<14>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	118.7966	0.306	5	119.3417	2.559	12	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Zr)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Zr)(C[6]C[6]H)(H){1|C<3>,1|C<5>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Zr<13>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.4870	0.000	1	119.3417	2.559	12	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Zr)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Zr)(C[6]C[6]H)(H){1|C<3>,1|C<5>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Zr<15>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	118.6020	0.000	1	119.3417	2.559	12	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Zr)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Zr)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|H<2>}	C[6](C[6]C[6]H)2(H){1|Zr<15>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.5720	0.000	2	119.3417	2.559	12	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Zr)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Zr)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Zr<13>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	124.2000	0.000	1	119.3417	2.559	12	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Zr)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Zr)(C[6]C[6]H)(H){1|Cl<2>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Zr<14>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	118.3420	0.126	2	119.3417	2.559	12	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.0495	0.626	2	120.0495	0.392	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|La<13>,1|H<1>,2|C<3>,2|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|La<13>,1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.5160	0.000	1	119.5160	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,1|O<1>,3|C<3>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.0498	0.397	4	118.9610	0.157	5	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,1|O<1>,3|C<3>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){3|C<3>}	H(C[6]C[6]2)	118.6060	0.000	1	118.9610	0.157	5	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.5790	0.000	1	120.0649	0.062	15	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<6>,2|C<3>}	H(C[6]C[6]2)	120.1880	0.280	2	120.0649	0.062	15	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,2|C<3>}	H(C[6]C[6]2)	120.0875	0.177	4	120.0649	0.062	15	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cd<6>,2|C<3>}	H(C[6]C[6]2)	120.2420	0.000	1	120.0649	0.062	15	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<6>,2|C<3>}	H(C[6]C[6]2)	120.0143	0.332	3	120.0649	0.062	15	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<6>,2|C<3>}	H(C[6]C[6]2)	120.1715	0.136	2	120.0649	0.062	15	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,2|C<3>}	H(C[6]C[6]2)	120.0200	0.351	2	120.0649	0.062	15	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|C<3>,1|N<2>,1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<6>,2|C<3>}	H(C[6]C[6]2)	120.3210	0.000	1	119.9632	0.393	50	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|C<3>,1|N<2>,1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<5>,2|C<3>}	H(C[6]C[6]2)	120.4410	0.000	1	119.9632	0.393	50	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|C<3>,1|N<2>,1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.7077	0.248	3	119.9632	0.393	50	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|C<3>,1|N<2>,1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<6>,2|C<3>}	H(C[6]C[6]2)	120.4680	0.000	1	119.9632	0.393	50	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,2|C<3>}	H(C[6]C[6]2)	119.2413	0.286	3	119.9632	0.393	50	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<6>,2|C<3>}	H(C[6]C[6]2)	120.3785	0.060	2	119.9632	0.393	50	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.4817	0.306	7	119.9632	0.393	50	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,2|C<3>}	H(C[6]C[6]2)	119.8800	0.474	6	119.9632	0.393	50	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<4>,2|C<3>}	H(C[6]C[6]2)	120.0024	0.586	7	119.9632	0.393	50	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<6>,2|C<3>}	H(C[6]C[6]2)	119.8480	0.246	2	119.9632	0.393	50	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<6>,2|C<3>}	H(C[6]C[6]2)	120.1150	0.000	1	119.9632	0.393	50	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|N<3>,2|H<1>,2|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<6>,2|C<3>}	H(C[6]C[6]2)	120.5810	0.361	6	119.9632	0.393	50	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|N<3>,2|H<1>,2|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<9>,2|C<3>}	H(C[6]C[6]2)	120.6550	0.544	6	119.9632	0.393	50	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|Ta<13>,1|H<1>,1|N<3>,1|O<2>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ta<13>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	118.8320	0.298	2	119.9632	0.393	50	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|Ti<9>,1|H<1>,1|N<3>,1|O<2>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ti<9>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	119.3835	0.323	2	119.9632	0.393	50	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ir<8>,2|C<3>}	H(C[6]C[6]2)	120.1800	0.000	1	119.3624	0.258	7	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	118.9060	0.431	2	119.3624	0.258	7	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<6>,2|C<3>}	H(C[6]C[6]2)	119.3863	0.303	4	119.3624	0.258	7	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|Al<4>,2|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.7730	0.871	2	119.4829	0.269	45	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|C<2>,2|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){2|C<3>}	H(C[6]C[6]2)	118.2200	0.000	1	119.4829	0.269	45	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|Ga<3>,2|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<4>,2|C<3>}	H(C[6]C[6]2)	119.1635	0.047	2	119.4829	0.269	45	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,1|O<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	118.7520	0.177	3	119.4829	0.269	45	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,1|O<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){3|C<3>}	H(C[6]C[6]2)	119.5593	0.822	3	119.4829	0.269	45	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<2>,2|C<3>}	H(C[6]C[6]2)	119.7406	0.376	10	119.4829	0.269	45	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|Li<3>,1|Li<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<4>,2|C<3>}	H(C[6]C[6]2)	119.7310	0.000	1	119.4829	0.269	45	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|Li<3>,1|Ni<7>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.0020	0.000	1	119.4829	0.269	45	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|Ni<4>,1|Ni<5>,1|C<4>,1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|Ni<4>,1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.6380	0.000	1	119.4829	0.269	45	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|Ni<4>,1|Ni<5>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.5740	0.000	1	119.4829	0.269	45	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|Ni<6>,1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Ni<6>,1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.3160	0.000	1	119.4829	0.269	45	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|Pr<17>,1|H<1>,1|O<2>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,2|C<4>}	H(C[6]C[6]2)	119.6865	1.201	2	119.4829	0.269	45	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|Pr<17>,1|H<1>,1|O<2>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<4>,2|C<3>}	H(C[6]C[6]2)	119.4470	0.000	1	119.4829	0.269	45	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|Ta<10>,1|C<4>,1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|Ta<10>,1|C<4>,2|C<3>}	H(C[6]C[6]2)	119.3150	0.000	1	119.4829	0.269	45	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|Th<12>,1|H<1>,1|O<2>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,2|C<4>}	H(C[6]C[6]2)	119.4970	0.000	1	119.4829	0.269	45	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|Th<12>,1|H<1>,1|O<2>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<4>,2|C<3>}	H(C[6]C[6]2)	119.5405	0.322	4	119.4829	0.269	45	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|Ti<10>,1|H<1>,1|O<2>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<4>,2|C<3>}	H(C[6]C[6]2)	119.2071	0.239	8	119.4829	0.269	45	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){2|Li<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<4>,2|C<3>}	H(C[6]C[6]2)	119.7925	0.136	2	119.4829	0.269	45	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|C<6>,1|N<3>,3|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	118.8690	0.000	1	119.9298	0.123	20	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	119.9740	0.277	9	119.9298	0.123	20	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.3430	0.000	1	119.9298	0.123	20	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	119.9147	0.256	3	119.9298	0.123	20	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Mn<6>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.3260	0.000	1	119.9298	0.123	20	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Re<6>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	119.7010	0.000	1	119.9298	0.123	20	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	119.9617	0.134	4	119.9298	0.123	20	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|C<4>,1|F<1>,4|C<3>}	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|O<2>,2|C<4>,3|C<3>}	H(C[6]C[6]2)	117.5710	0.000	1	119.1603	1.056	18	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|Mo<7>,1|C<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|Mo<7>,1|C<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	118.9283	1.475	4	119.1603	1.056	18	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|Ni<4>,1|C<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|Ni<4>,1|C<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.2067	1.060	4	119.1603	1.056	18	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|Ni<5>,1|C<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|Ni<5>,1|C<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.8740	0.257	2	119.1603	1.056	18	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|O<2>,2|C<4>,3|C<3>}	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|C<4>,1|F<1>,4|C<3>}	H(C[6]C[6]2)	117.4470	0.000	1	119.1603	1.056	18	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|Pt<5>,1|C<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|Pt<5>,1|C<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.5967	0.171	6	119.1603	1.056	18	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pt<4>,4|C<3>}	H(C[6]C[6]2)	119.8340	0.000	1	119.8115	0.186	19	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Co<4>,4|C<3>}	H(C[6]C[6]2)	120.2908	0.394	6	119.8115	0.186	19	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ir<6>,4|C<3>}	H(C[6]C[6]2)	119.5028	0.268	6	119.8115	0.186	19	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pd<4>,4|C<3>}	H(C[6]C[6]2)	119.5640	0.021	2	119.8115	0.186	19	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pt<4>,4|C<3>}	H(C[6]C[6]2)	119.6735	0.150	4	119.8115	0.186	19	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6a]O[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|N<2>,1|O<2>,3|C<3>}	C[6](C[6]C[6a]O[6])(C[6]C[6]H)(H){4|C<3>}	H(C[6]C[6]2)	118.4590	0.000	1	118.4590	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]B)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|B<3>,3|C<3>}	C[6](C[6]C[6]B)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9350	0.000	1	119.9350	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]Br)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Br<1>,1|Ir<6>,3|C<3>}	C[6](C[6]C[6]Br)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.4145	0.998	2	119.4145	0.995	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Au<4>,1|C<4>,3|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.5000	0.212	2	119.6411	1.904	51	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|C<2>,1|H<1>,1|N<2>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	110.4100	0.000	1	119.6411	1.904	51	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<2>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1740	0.000	1	119.6411	1.904	51	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|C<4>,3|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3950	0.096	2	119.6411	1.904	51	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|C<4>,3|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9020	0.477	24	119.6411	1.904	51	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|C<4>,3|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.6988	0.276	21	119.6411	1.904	51	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|N<3>,3|C<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7870	1.824	2	119.8464	0.970	9	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.6995	0.197	2	119.8464	0.970	9	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<2>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.2230	0.000	1	119.8464	0.970	9	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|N<3>,3|C<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	118.9100	0.016	2	119.8464	0.970	9	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|N<3>,3|C<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3010	0.165	2	119.8464	0.970	9	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|O<2>,3|C<3>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6530	0.000	1	120.6530	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|P<4>,2|C<3>}	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4530	0.000	1	120.4530	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){2|C<3>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Re<6>,1|C<3>,1|N<2>}	H(C[6]C[6]2)	120.3020	0.000	1	120.3020	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ag<2>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.9437	0.428	4	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Al<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.2993	0.250	7	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Al<5>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.0523	0.190	7	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Al<5>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.4642	0.258	4	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|As<2>,1|H<1>,1|N<2>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1760	0.000	1	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Au<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9379	0.353	23	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Au<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.5650	0.493	27	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Au<5>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7480	0.000	1	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Au<5>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.5988	0.505	5	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|B<3>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.5870	0.941	5	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|B<4>,1|H<1>,1|N<2>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.2640	0.000	1	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|B<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7800	0.141	2	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<2>}	H(C[6]C[6]2)	118.7890	1.010	2	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|C<3>,2|H<1>,2|N<2>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5860	0.578	15	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<2>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	122.4907	2.422	4	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.0115	0.170	2	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0090	0.765	2	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.8475	0.050	2	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Cd<6>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.1160	0.000	1	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Co<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.0727	0.203	3	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Co<5>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	121.1020	0.891	3	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Co<5>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.6670	0.078	2	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Co<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5565	1.291	16	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Co<6>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.8475	0.216	2	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Co<8>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2880	0.000	1	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Cr<5>,1|C<4>,1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|Cr<5>,1|C<3>,2|N<3>}	H(C[6]C[6]2)	120.1420	0.297	2	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Cr<6>,1|C<4>,1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|Cr<6>,1|C<3>,2|N<3>}	H(C[6]C[6]2)	120.1773	0.225	3	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Cr<6>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.9892	0.198	12	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Cr<7>,1|C<4>,1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|Cr<7>,1|C<3>,2|N<3>}	H(C[6]C[6]2)	120.0665	0.015	2	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>,2|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8980	0.000	1	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|H<1>,1|N<2>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.0340	0.000	1	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.6900	0.000	1	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9818	0.256	4	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.3307	0.498	35	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Cu<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3288	0.233	5	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Cu<5>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.1115	0.344	8	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Cu<5>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.0518	0.529	5	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Eu<11>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5530	0.000	1	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Fe<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.5499	1.133	12	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Fe<5>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.5613	1.852	4	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Fe<5>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	118.5490	0.000	1	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Fe<5>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.9030	0.154	3	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.4265	0.668	2	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.5033	1.734	4	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	H(C[6]C[6]2)	120.7012	1.064	5	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.3260	0.000	1	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ga<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.9515	0.831	2	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|O<1>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6730	1.779	4	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|O<1>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	122.7900	0.000	1	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|H<1>,1|O<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	119.3170	0.000	1	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|H<1>,1|O<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.1895	2.887	2	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|H<1>,1|O<2>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.4320	0.000	1	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|H<1>,4|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.6320	0.000	1	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|In<5>,1|H<1>,1|N<2>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0950	0.000	1	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ir<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	119.7275	0.985	2	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|H<1>,1|N<2>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6660	0.431	5	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|H<1>,1|N<2>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.9230	0.226	2	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8669	0.497	782	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.5865	1.081	4	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ir<7>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8255	0.511	49	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ir<8>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8036	0.301	28	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ir<8>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	119.9755	0.019	2	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ir<8>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.1565	0.035	2	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ir<9>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.2170	1.018	2	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Li<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	H(C[6]C[6]2)	120.4675	0.274	2	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Li<5>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	H(C[6]C[6]2)	120.4170	0.000	1	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Mg<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1700	0.000	1	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Mn<6>,1|H<1>,1|N<2>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.8860	0.000	1	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Mn<6>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	122.2770	1.372	3	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Mn<6>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9788	0.106	5	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Mn<6>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.7680	0.218	8	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Mo<5>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.8765	0.049	2	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Mo<6>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.0680	0.023	2	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|N<2>,2|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Br<1>,1|C<3>,1|N<3>}	H(C[6]C[6]2)	118.7230	0.000	1	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|N<2>,2|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<2>,1|C<3>,1|N<3>}	H(C[6]C[6]2)	120.4270	0.000	1	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|N<2>,2|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.7087	0.564	7	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|N<2>,2|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2218	0.828	93	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|N<2>,2|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|S<1>}	H(C[6]C[6]2)	121.0967	0.707	3	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|N<2>,2|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	120.7950	0.215	2	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|N<2>,2|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Ir<6>,1|C<3>,1|N<3>}	H(C[6]C[6]2)	120.7082	0.255	4	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|N<2>,2|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.6490	0.000	1	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ni<4>,1|H<1>,1|N<2>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	123.4060	0.000	1	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ni<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	119.1320	0.000	1	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ni<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0370	0.147	7	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ni<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.0807	0.318	3	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ni<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.6712	0.740	5	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ni<5>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.4349	0.553	8	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ni<5>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.3625	0.292	2	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	121.5954	2.393	8	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.2630	0.000	1	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ni<7>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.5190	0.000	1	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Os<6>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7674	0.321	21	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Os<7>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.1770	0.000	1	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Os<9>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9168	0.254	4	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,1|N<2>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0121	0.352	9	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,1|N<2>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	119.9380	0.000	1	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2410	0.000	1	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	118.9153	1.876	9	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2209	1.520	65	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.1520	0.000	1	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	H(C[6]C[6]2)	120.6704	0.334	5	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.5466	1.831	33	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pd<6>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2565	0.186	6	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pd<7>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2087	0.529	3	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,1|N<2>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1926	0.262	7	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.2670	0.374	3	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9719	0.432	242	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	H(C[6]C[6]2)	120.6045	0.214	16	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.2766	0.503	99	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pt<5>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9426	0.416	5	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pt<6>,1|H<1>,1|N<2>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1250	0.000	1	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pt<6>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.5270	0.000	1	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pt<6>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1010	0.232	33	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pt<6>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.1416	0.472	23	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Re<6>,1|H<1>,1|N<2>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.9490	0.391	7	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Re<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	124.5050	0.000	1	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Re<6>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.4010	0.000	1	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Re<6>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.2265	0.158	2	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Rh<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8740	0.000	1	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Rh<5>,1|H<1>,1|N<2>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7330	0.095	2	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Rh<6>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0001	0.183	8	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Rh<8>,1|C<4>,1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|Rh<8>,1|C<3>,2|N<3>}	H(C[6]C[6]2)	120.0325	0.235	2	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Rh<8>,1|H<1>,1|N<2>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7720	0.399	2	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Rh<8>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9512	0.336	45	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Rh<8>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	H(C[6]C[6]2)	119.9050	0.000	1	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Rh<9>,1|C<4>,1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|Rh<9>,1|C<3>,2|N<3>}	H(C[6]C[6]2)	120.4287	0.273	3	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Rh<9>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.6427	0.235	3	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ru<5>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,1|N<5>}	H(C[6]C[6]2)	120.0980	0.000	1	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|H<1>,1|N<2>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.5090	0.000	1	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|H<1>,1|N<2>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.6910	0.000	1	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.3660	0.254	4	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8880	0.343	25	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	H(C[6]C[6]2)	120.3830	0.158	2	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.0395	0.247	8	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ru<7>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0475	0.083	2	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ru<9>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9801	0.240	11	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Te<5>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.0960	0.000	1	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Te<7>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5280	0.470	2	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ti<7>,1|C<4>,1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|Ti<7>,1|C<3>,2|N<3>}	H(C[6]C[6]2)	120.1265	0.259	4	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Zn<4>,1|H<1>,1|N<2>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4277	0.201	6	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Zn<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9953	0.141	3	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Zn<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.1393	0.258	4	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Zn<5>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.8280	0.711	7	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Zn<5>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.8173	0.282	4	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Zr<11>,1|C<4>,1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|Zr<11>,1|C<3>,2|N<3>}	H(C[6]C[6]2)	120.2135	0.163	2	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){2|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0676	0.639	5	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){2|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	H(C[6]C[6]2)	120.2880	0.000	1	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){2|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.3615	1.795	6	120.0357	0.537	2086	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Co<4>,4|C<3>}	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	119.5427	0.406	6	119.7938	0.114	19	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ir<6>,4|C<3>}	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	119.9642	0.239	6	119.7938	0.114	19	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pd<4>,4|C<3>}	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	119.9560	0.188	2	119.7938	0.114	19	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pt<4>,4|C<3>}	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.4410	0.000	1	119.7938	0.114	19	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pt<4>,4|C<3>}	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	119.9220	0.187	4	119.7938	0.114	19	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]O[6])(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]O[6])(C[6]C[6]H)(H){4|C<3>}	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|N<2>,1|O<2>,3|C<3>}	H(C[6]C[6]2)	120.1110	0.000	1	120.1110	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]Ga[6]Si)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]Ga[6]Si)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|Ga<3>,2|Si<4>}	H(C[6]C[6]2)	115.6335	0.108	2	115.6335	0.012	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]Ge[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]Ge[6]C)(C[6]C[6]H)(H){1|Ru<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ge<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	114.7670	0.000	1	114.7670	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]Ge[6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]Ge[6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|Ge<3>,2|H<1>}	H(C[6]C[6]2)	117.0650	4.115	2	117.3563	8.723	3	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]Ge[6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]Ge[6]H)(C[6]C[6]H)(H){1|Ru<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ge<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	117.9390	0.000	1	117.3563	8.723	3	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]Ge[6]H)(C[6]C[6]H)(H)	C[6](C[6]Ge[6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]Ge[6]H)(C[6]C[6]H)(H){1|Ge<3>,1|C<3>,1|H<1>}	C[6](C[6]Ge[6]H)(C[6]C[6]H)(H){1|Ge<3>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	115.8940	0.000	1	115.8940	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]In[6]Si)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]In[6]Si)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|In<3>,2|Si<4>}	H(C[6]C[6]2)	114.4925	0.272	2	114.4925	0.074	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[3x6]C)(C[6]C[6]H)(H)	C[6](C[6]C[3x6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[3x6]C)(C[6]C[6]H)(H){1|Ge<3>,1|C<3>,1|H<1>}	C[6](C[6]C[3x6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	119.7980	0.000	1	119.7980	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[3x6]H)(C[6]C[6]H)(H)	C[6](C[6]C[3x6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[3x6]H)(C[6]C[6]H)(H){1|As<3>,1|C<3>,1|H<1>}	C[6](C[6]C[3x6]H)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|P<3>}	H(C[6]C[6]2)	120.2697	0.242	3	120.5766	0.135	8	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[3x6]H)(C[6]C[6]H)(H)	C[6](C[6]C[3x6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[3x6]H)(C[6]C[6]H)(H){1|Nb<5>,1|C<3>,1|H<1>}	C[6](C[6]C[3x6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7880	0.000	1	120.5766	0.135	8	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[3x6]H)(C[6]C[6]H)(H)	C[6](C[6]C[3x6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[3x6]H)(C[6]C[6]H)(H){1|Nb<6>,1|C<3>,1|H<1>}	C[6](C[6]C[3x6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2540	0.000	1	120.5766	0.135	8	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[3x6]H)(C[6]C[6]H)(H)	C[6](C[6]C[3x6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[3x6]H)(C[6]C[6]H)(H){1|Nb<7>,1|C<3>,1|H<1>}	C[6](C[6]C[3x6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.9207	0.149	3	120.5766	0.135	8	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[4,6]C)(C[6]C[6]H)(H)	C[6](C[6]C[4,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[4,6]C)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[4,6]H)(C[6]C[6]H)(H){1|C<4>,2|N<3>}	H(C[6]C[6]2)	120.1340	0.000	1	119.9533	0.161	6	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[4,6]C)(C[6]C[6]H)(H)	C[6](C[6]C[4,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[4,6]C)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[4,6]H)(C[6]C[6]H)(H){1|N<3>,2|C<4>}	H(C[6]C[6]2)	119.7120	0.037	2	119.9533	0.161	6	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[4,6]C)(C[6]C[6]H)(H)	C[6](C[6]C[4,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[4,6]C)(C[6]C[6]H)(H){1|Ge<3>,1|C<3>,1|H<1>}	C[6](C[6]C[4,6]H)(C[6]C[6]H)(H){1|C<4>,2|N<3>}	H(C[6]C[6]2)	120.3760	0.038	2	119.9533	0.161	6	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[4,6]C)(C[6]C[6]H)(H)	C[6](C[6]C[4,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[4,6]C)(C[6]C[6]H)(H){1|Si<4>,1|C<3>,1|H<1>}	C[6](C[6]C[4,6]H)(C[6]C[6]H)(H){1|N<3>,2|C<4>}	H(C[6]C[6]2)	119.4100	0.000	1	119.9533	0.161	6	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[4,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[4,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[4,6]H)(C[6]C[6]H)(H){1|Si<5>,1|C<3>,1|H<1>}	C[6](C[6]C[4,6]H)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	120.2568	0.159	4	120.3137	0.027	6	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[4,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[4,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[4,6]H)(C[6]C[6]H)(H){1|Si<6>,1|C<3>,1|H<1>}	C[6](C[6]C[4,6]H)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	120.4275	0.144	2	120.3137	0.027	6	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[4,6]N)(C[6]C[6]H)(H)	C[6](C[6]C[4,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[4,6]N)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[4,6]H)(C[6]C[6]H)(H){3|N<3>}	H(C[6]C[6]2)	120.1790	0.195	3	120.1790	0.038	3	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]C)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]C)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|N<3>,2|C<4>}	H(C[6]C[6]2)	119.7635	0.100	4	120.0423	0.262	21	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]C)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]C)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	119.4840	0.223	3	120.0423	0.262	21	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]C)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]C)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<4>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	119.8900	0.109	2	120.0423	0.262	21	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]C)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<2>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.8880	0.659	2	120.0423	0.262	21	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]C)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<4>,2|N<3>}	H(C[6]C[6]2)	119.5000	0.037	2	120.0423	0.262	21	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]C)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]C)(C[6]C[6]H)(H){1|Ga<4>,1|C<3>,1|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.5810	0.116	2	120.0423	0.262	21	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]C)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]C)(C[6]C[6]H)(H){1|In<4>,1|C<3>,1|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.5340	0.000	1	120.0423	0.262	21	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]C)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]C)(C[6]C[6]H)(H){1|In<6>,1|C<3>,1|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.6262	0.226	5	120.0423	0.262	21	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]C[6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<2>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.3440	0.000	1	119.3440	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]C[6a])(C[6]C[6]H)(H){1|Ga<4>,1|H<1>,1|N<2>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.7730	0.171	2	120.7730	0.029	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]Cl)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]Cl)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Cl<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.9288	0.147	6	120.9288	0.022	6	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]Br)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Br<1>,2|C<4>}	C[6](C[6]C[5,6]Br)(C[6]C[6]H)(H){1|C<4>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.4620	0.134	2	120.4620	0.018	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|In<6>,2|C<3>}	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5685	0.136	2	120.2728	0.182	4	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|N<2>,2|C<3>}	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	119.9770	0.423	2	120.2728	0.182	4	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]Cl)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Cl<1>,1|C<3>,1|C<4>}	C[6](C[6]C[5,6]Cl)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.2570	0.000	1	120.2570	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|B<3>,1|C<3>,1|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9060	0.000	1	120.2443	0.319	243	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4296	0.259	20	120.2443	0.319	243	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6382	0.133	5	120.2443	0.319	243	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|B<6>,1|C<3>,1|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5735	0.151	2	120.2443	0.319	243	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1217	0.514	3	120.2443	0.319	243	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0257	0.197	3	120.2443	0.319	243	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.3665	0.018	2	120.2443	0.319	243	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.4850	0.128	4	120.2443	0.319	243	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.2000	0.000	1	120.2443	0.319	243	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	119.6450	0.949	3	120.2443	0.319	243	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Se<2>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6930	0.000	1	120.2443	0.319	243	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.5042	0.221	4	120.2443	0.319	243	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.7360	0.621	2	120.2443	0.319	243	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	120.5000	0.185	2	120.2443	0.319	243	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<2>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.3600	0.000	1	120.2443	0.319	243	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<2>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	119.9610	0.000	2	120.2443	0.319	243	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0790	0.000	1	120.2443	0.319	243	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8960	0.202	2	120.2443	0.319	243	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<6>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1525	0.100	2	120.2443	0.319	243	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<6>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.3030	0.000	1	120.2443	0.319	243	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ga<4>,1|C<3>,1|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.9117	0.815	3	120.2443	0.319	243	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ga<4>,1|C<3>,1|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6185	0.578	2	120.2443	0.319	243	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ga<4>,1|C<3>,1|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Si<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6670	0.312	3	120.2443	0.319	243	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ga<5>,1|C<3>,1|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4046	0.218	9	120.2443	0.319	243	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ga<5>,1|C<3>,1|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Si<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4575	0.310	2	120.2443	0.319	243	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ga<6>,1|C<3>,1|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6011	0.475	37	120.2443	0.319	243	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ga<6>,1|C<3>,1|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4377	0.175	7	120.2443	0.319	243	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ge<2>,1|C<3>,1|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4695	0.088	2	120.2443	0.319	243	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ge<3>,1|C<3>,1|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4055	0.080	2	120.2443	0.319	243	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ge<4>,1|C<3>,1|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4625	0.018	2	120.2443	0.319	243	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.3354	0.460	33	120.2443	0.319	243	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8086	0.335	5	120.2443	0.319	243	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.9820	0.000	1	120.2443	0.319	243	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|P<2>}	H(C[6]C[6]2)	119.9118	0.204	6	120.2443	0.319	243	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|P<6>}	H(C[6]C[6]2)	120.3340	0.000	1	120.2443	0.319	243	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	119.6573	0.282	6	120.2443	0.319	243	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|In<4>,1|C<3>,1|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Si<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4985	0.013	2	120.2443	0.319	243	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|In<5>,1|C<3>,1|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7290	0.000	1	120.2443	0.319	243	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|In<6>,1|C<3>,1|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6759	0.298	14	120.2443	0.319	243	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|In<6>,1|C<3>,1|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7643	0.160	4	120.2443	0.319	243	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|In<6>,1|C<3>,1|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.8120	0.000	1	120.2443	0.319	243	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|In<7>,1|C<3>,1|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6340	0.000	1	120.2443	0.319	243	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Nb<6>,1|C<3>,1|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5480	0.201	2	120.2443	0.319	243	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Se<2>,1|C<3>,1|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3730	0.000	1	120.2443	0.319	243	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Si<4>,1|C<3>,1|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4487	0.161	6	120.2443	0.319	243	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Si<5>,1|C<3>,1|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3835	0.081	4	120.2443	0.319	243	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Si<5>,1|C<3>,1|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4360	0.202	10	120.2443	0.319	243	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Si<6>,1|C<3>,1|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2302	0.150	14	120.2443	0.319	243	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]N)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]N)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,2|N<3>}	H(C[6]C[6]2)	119.8130	0.000	1	119.8130	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]P)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]P)(C[6]C[6]H)(H){1|Ga<4>,1|C<3>,1|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|N<3>,1|P<3>}	H(C[6]C[6]2)	120.4370	0.057	2	120.5156	0.106	12	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]P)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]P)(C[6]C[6]H)(H){1|Ga<5>,1|C<3>,1|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|N<3>,1|P<4>}	H(C[6]C[6]2)	120.3890	0.093	2	120.5156	0.106	12	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]P)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]P)(C[6]C[6]H)(H){1|In<5>,1|C<3>,1|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|N<3>,1|P<3>}	H(C[6]C[6]2)	120.0210	0.321	2	120.5156	0.106	12	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]P)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]P)(C[6]C[6]H)(H){1|In<5>,1|C<3>,1|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|N<3>,1|P<4>}	H(C[6]C[6]2)	120.7760	0.208	4	120.5156	0.106	12	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]P)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]P)(C[6]C[6]H)(H){1|In<6>,1|C<3>,1|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|N<3>,1|P<4>}	H(C[6]C[6]2)	120.6945	0.224	2	120.5156	0.106	12	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|C<4>,3|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.9250	0.000	1	120.9250	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Cd<6>,1|Cl<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|C<3>,2|N<3>}	H(C[6]C[6]2)	121.2765	0.284	2	121.3140	0.029	6	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Cl<1>,1|Cu<6>,1|N<3>,2|C<3>}	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|C<3>,2|N<3>}	H(C[6]C[6]2)	121.2745	0.084	2	121.3140	0.029	6	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Cl<1>,1|Ni<6>,1|N<3>,2|C<3>}	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|C<3>,2|N<3>}	H(C[6]C[6]2)	121.3910	0.198	2	121.3140	0.029	6	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|N<3>,3|C<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	121.1630	0.000	1	121.1630	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|N<2>,1|O<2>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]O)(H){2|N<3>}	H(C[6]C[6]2)	121.4760	0.000	1	121.4760	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Al<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	H(C[6]C[6]2)	120.9370	0.000	1	121.3782	0.325	304	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ba<7>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){3|N<3>}	H(C[6]C[6]2)	121.1980	0.059	2	121.3782	0.325	304	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,2|N<3>}	H(C[6]C[6]2)	120.4410	0.000	1	121.3782	0.325	304	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){3|N<3>}	H(C[6]C[6]2)	120.7660	0.042	2	121.3782	0.325	304	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ca<6>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){3|N<3>}	H(C[6]C[6]2)	121.6333	0.370	6	121.3782	0.325	304	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Co<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){3|N<3>}	H(C[6]C[6]2)	121.5391	0.201	9	121.3782	0.325	304	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Cr<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	H(C[6]C[6]2)	122.0830	0.000	2	121.3782	0.325	304	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Cr<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	H(C[6]C[6]2)	121.2320	0.122	2	121.3782	0.325	304	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	121.4390	0.000	1	121.3782	0.325	304	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){3|N<3>}	H(C[6]C[6]2)	121.2490	0.071	2	121.3782	0.325	304	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Cu<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){3|N<3>}	H(C[6]C[6]2)	121.3195	0.325	6	121.3782	0.325	304	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Fe<5>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	H(C[6]C[6]2)	121.4707	0.550	4	121.3782	0.325	304	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Fe<5>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.3280	0.000	1	121.3782	0.325	304	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Fe<5>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){3|N<3>}	H(C[6]C[6]2)	120.9545	0.134	2	121.3782	0.325	304	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	H(C[6]C[6]2)	121.8962	1.094	14	121.3782	0.325	304	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){3|N<3>}	H(C[6]C[6]2)	121.6098	0.228	45	121.3782	0.325	304	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	121.0480	0.263	8	121.3782	0.325	304	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){3|N<3>}	H(C[6]C[6]2)	121.3066	0.670	10	121.3782	0.325	304	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|H<1>,1|V<6>,3|C<3>}	C[6](C[6]C[6]H)2(H){3|N<3>}	H(C[6]C[6]2)	121.6830	0.306	4	121.3782	0.325	304	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|In<6>,2|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	119.8730	0.000	1	121.3782	0.325	304	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|C<4>,1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	121.4325	0.261	2	121.3782	0.325	304	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	121.6570	0.000	1	121.3782	0.325	304	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	H(C[6]C[6]2)	121.4393	0.047	3	121.3782	0.325	304	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.9355	0.719	2	121.3782	0.325	304	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ir<8>,1|B<3>,1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.0930	0.000	1	121.3782	0.325	304	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ir<8>,1|B<3>,1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.4820	0.000	1	121.3782	0.325	304	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ir<8>,1|H<1>,1|N<2>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	121.1445	0.380	2	121.3782	0.325	304	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ir<8>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	121.1700	0.066	2	121.3782	0.325	304	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ir<8>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|O<2>,2|N<3>}	H(C[6]C[6]2)	121.3600	0.459	3	121.3782	0.325	304	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Li<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	H(C[6]C[6]2)	122.2585	0.039	2	121.3782	0.325	304	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Mg<6>,1|C<4>,1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(H){3|N<3>}	H(C[6]C[6]2)	121.4180	0.069	2	121.3782	0.325	304	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Mn<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	H(C[6]C[6]2)	121.2520	0.011	2	121.3782	0.325	304	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Mn<6>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	121.1382	0.058	4	121.3782	0.325	304	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	H(C[6]C[6]2)	121.5792	0.448	5	121.3782	0.325	304	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){3|N<3>}	H(C[6]C[6]2)	121.6908	0.177	4	121.3782	0.325	304	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){3|N<3>}	H(C[6]C[6]2)	122.0770	0.000	1	121.3782	0.325	304	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Os<9>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.9930	0.000	1	121.3782	0.325	304	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|C<4>,1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(H){3|N<3>}	H(C[6]C[6]2)	120.7350	0.000	2	121.3782	0.325	304	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	H(C[6]C[6]2)	121.6210	0.000	1	121.3782	0.325	304	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	121.4102	0.159	6	121.3782	0.325	304	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	H(C[6]C[6]2)	121.5560	0.000	1	121.3782	0.325	304	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	121.2203	0.456	11	121.3782	0.325	304	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){3|N<3>}	H(C[6]C[6]2)	121.5407	0.382	6	121.3782	0.325	304	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Pd<6>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	121.2045	0.053	4	121.3782	0.325	304	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Re<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	121.2920	0.000	1	121.3782	0.325	304	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Re<6>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	121.1861	0.533	11	121.3782	0.325	304	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Rh<5>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	121.0280	0.236	2	121.3782	0.325	304	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Rh<6>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	121.4320	0.200	3	121.3782	0.325	304	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Rh<8>,1|C<4>,1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.0685	0.078	2	121.3782	0.325	304	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Rh<8>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.9450	0.191	2	121.3782	0.325	304	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ru<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	H(C[6]C[6]2)	121.2530	0.000	1	121.3782	0.325	304	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	H(C[6]C[6]2)	121.3530	0.520	8	121.3782	0.325	304	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	121.3125	0.103	2	121.3782	0.325	304	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<4>,2|N<3>}	H(C[6]C[6]2)	120.9400	0.452	6	121.3782	0.325	304	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.9226	0.505	12	121.3782	0.325	304	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){3|N<3>}	H(C[6]C[6]2)	121.5592	0.940	28	121.3782	0.325	304	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ru<8>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.8400	0.000	1	121.3782	0.325	304	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ru<8>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.8327	0.169	3	121.3782	0.325	304	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ru<9>,1|H<1>,1|N<2>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	121.3240	0.318	4	121.3782	0.325	304	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ru<9>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	121.2442	0.157	4	121.3782	0.325	304	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ru<9>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){3|N<3>}	H(C[6]C[6]2)	120.9860	0.256	2	121.3782	0.325	304	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Sm<14>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	H(C[6]C[6]2)	121.0950	0.000	1	121.3782	0.325	304	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Sr<7>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){3|N<3>}	H(C[6]C[6]2)	121.3010	0.017	2	121.3782	0.325	304	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Zn<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	H(C[6]C[6]2)	121.3143	0.196	3	121.3782	0.325	304	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Zn<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	H(C[6]C[6]2)	121.3760	0.000	1	121.3782	0.325	304	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Zn<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){3|N<3>}	H(C[6]C[6]2)	121.4270	0.185	2	121.3782	0.325	304	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Zn<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<4>,2|N<3>}	H(C[6]C[6]2)	121.6595	0.089	4	121.3782	0.325	304	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Zn<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){3|N<3>}	H(C[6]C[6]2)	121.7133	0.262	4	121.3782	0.325	304	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){2|Cu<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|N<4>,2|N<3>}	H(C[6]C[6]2)	121.3340	0.409	2	121.3782	0.325	304	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){2|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){3|N<3>}	H(C[6]C[6]2)	122.2390	0.000	1	121.3782	0.325	304	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5a,6]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5a,6]C[6a])(C[6]C[6]H)(H){1|H<1>,4|C<3>}	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	117.1670	0.000	1	117.1670	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	C[6](C[6]C[5a,6]C)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	119.4940	0.000	1	119.7050	0.089	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	C[6](C[6]C[5a,6]C)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	119.9160	0.000	1	119.7050	0.089	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.3914	1.841	10	120.4748	2.072	39	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.7310	0.283	5	120.4748	2.072	39	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	123.2600	0.000	1	120.4748	2.072	39	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.6220	0.000	1	120.4748	2.072	39	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.6924	0.489	10	120.4748	2.072	39	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	119.4537	0.372	3	120.4748	2.072	39	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.3092	1.532	9	120.4748	2.072	39	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5a]C[6])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<6>,1|C<3>,1|N<3>}	H(C[6]C[6]2)	120.7790	0.000	1	120.7790	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[5a]C[6])(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)2(H){1|C<2>,1|N<3>}	H(C[6]C[6]2)	117.3190	0.000	1	119.3913	3.719	3	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[5a]C[6])(C[6]C[6]H)(H){1|C<2>,2|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>}	H(C[6]C[6]2)	121.1330	0.000	1	119.3913	3.719	3	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[5a]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|O<1>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7220	0.000	1	119.3913	3.719	3	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5a]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Re<6>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	120.7100	0.064	2	120.7100	0.004	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[5a]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){3|N<3>}	H(C[6]C[6]2)	120.8540	0.436	2	120.5748	0.366	19	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[5a]N[6])(C[6]C[6]H)(H){1|Mn<6>,1|H<1>,1|N<2>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,2|N<3>}	H(C[6]C[6]2)	120.5070	0.000	1	120.5748	0.366	19	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[5a]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.5252	0.184	6	120.5748	0.366	19	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[5a]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	119.9742	0.266	6	120.5748	0.366	19	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[5a]N[6])(C[6]C[6]H)(H){1|Re<6>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	121.1655	0.029	2	120.5748	0.366	19	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[5a]N[6])(C[6]C[6]H)(H){1|Ru<8>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	121.2710	0.000	1	120.5748	0.366	19	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[5a]N[6])(C[6]C[6]H)(H){2|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){3|N<3>}	H(C[6]C[6]2)	122.1090	0.000	1	120.5748	0.366	19	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]C)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	119.9580	0.167	2	119.8834	0.062	5	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]C)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.8337	0.317	3	119.8834	0.062	5	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,2|N<2>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.8900	0.000	1	119.8900	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]Cl)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]Cl)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Cl<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.8140	0.000	1	120.8140	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|C<4>}	C[6](C[6]C[6,6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8830	0.000	1	120.8830	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]Cl)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|Cl<1>,2|C<3>}	C[6](C[6]C[6,6]Cl)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.0870	0.000	1	120.0870	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8376	0.471	63	120.7010	0.399	150	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5980	0.145	10	120.7010	0.399	150	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.6153	0.133	12	120.7010	0.399	150	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.8470	0.000	1	120.7010	0.399	150	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.6197	0.170	3	120.7010	0.399	150	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6426	0.952	24	120.7010	0.399	150	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3857	0.303	3	120.7010	0.399	150	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<4>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.1305	0.182	2	120.7010	0.399	150	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.6477	0.180	3	120.7010	0.399	150	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|N<4>}	H(C[6]C[6]2)	120.4490	0.000	1	120.7010	0.399	150	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	122.7535	2.467	2	120.7010	0.399	150	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){2|H<1>,2|N<3>}	H(C[6]C[6]2)	120.1400	0.091	2	120.7010	0.399	150	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<3>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9720	0.000	1	120.7010	0.399	150	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|Ga<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4545	0.026	2	120.7010	0.399	150	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|Ga<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7450	0.273	2	120.7010	0.399	150	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|Ge<3>,1|C<3>,1|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	121.0720	0.065	3	120.7010	0.399	150	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|Ge<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5517	0.305	4	120.7010	0.399	150	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9283	0.442	3	120.7010	0.399	150	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.6160	0.000	1	120.7010	0.399	150	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	119.9170	0.000	1	120.7010	0.399	150	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.2905	0.780	2	120.7010	0.399	150	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|In<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6735	0.138	2	120.7010	0.399	150	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|In<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.7430	0.055	2	120.7010	0.399	150	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|Nb<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7640	0.000	1	120.7010	0.399	150	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]N)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6,6]N)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	118.6220	0.000	1	118.4615	0.052	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]N)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|N<3>,2|C<3>}	C[6](C[6]C[6,6]N)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	118.3010	0.000	1	118.4615	0.052	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|O<2>}	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.0775	0.186	2	119.5371	0.214	7	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|O<2>,2|C<3>}	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	119.2765	0.362	4	119.5371	0.214	7	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|O<3>,2|C<3>}	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	119.4990	0.000	1	119.5371	0.214	7	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]O)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]O)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<4>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	119.8170	0.802	2	119.8170	0.643	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]S)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]S)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<4>,1|N<3>,1|S<1>}	H(C[6]C[6]2)	120.4910	0.000	1	120.4910	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6a]C)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6a]C)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	119.5690	0.000	1	119.5690	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6a]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6a]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|C<4>}	C[6](C[6]C[6,6a]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.0000	0.000	1	120.7480	0.127	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6a]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6a]H)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6,6a]C)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.4960	0.000	1	120.7480	0.127	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6a]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6a]H)(C[6]C[6]H)(H){3|C<3>}	C[6](C[6]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.3925	0.103	2	120.3925	0.011	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6a]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6a]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8250	0.000	1	120.0257	0.148	14	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6a]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6a]H)(C[6]C[6]H)(H){1|Ge<3>,1|C<3>,1|H<1>}	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6930	0.000	1	120.0257	0.148	14	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6a]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6a]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9391	0.266	9	120.0257	0.148	14	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6a]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6a]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	119.7365	0.180	2	120.0257	0.148	14	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6a]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6a]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	119.9170	0.000	1	120.0257	0.148	14	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6a]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6a]Ru)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H){1|Ru<7>,1|C<3>,1|N<4>}	H(C[6]C[6]2)	119.9900	0.000	1	119.9900	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]Al)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]Al)(C[6]C[6]H)(H){1|Ca<6>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Al<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	118.9043	0.018	6	118.9507	0.033	9	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]Al)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]Al)(C[6]C[6]H)(H){1|Li<4>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Al<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.0433	0.336	3	118.9507	0.033	9	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]Al)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]Al)(C[6]C[6]H)(H){1|Li<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Al<4>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	119.4278	0.081	13	119.3831	0.022	19	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]Al)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]Al)(C[6]C[6]H)(H){1|Li<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Al<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.2862	0.218	6	119.3831	0.022	19	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]As)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]As)(C[6]C[6]H)(H){1|C<3>,2|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|As<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.5100	0.000	1	119.5100	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]As)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]As)(C[6]C[6]H)(H){1|Co<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|As<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.2735	0.257	2	120.7492	0.524	6	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]As)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]As)(C[6]C[6]H)(H){1|Co<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|As<4>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	121.6260	0.489	2	120.7492	0.524	6	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]As)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]As)(C[6]C[6]H)(H){1|Ni<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|As<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.3480	0.041	2	120.7492	0.524	6	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]Br)(C[6]C[6]H)(H)	C[6](C[6]C[6]Br)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]Br)(C[6]C[6]H)(H){1|Br<1>,1|C<3>,1|C<4>}	C[6](C[6]C[6]Br)(C[6]C[6]H)(H){1|Br<1>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.6093	0.564	3	119.7610	0.304	4	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]Br)(C[6]C[6]H)(H)	C[6](C[6]C[6]Br)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]Br)(C[6]C[6]H)(H){1|Br<1>,1|C<3>,1|H<1>}	C[6](C[6]C[6]Br)(C[6]C[6]H)(H){1|Br<1>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2160	0.000	1	119.7610	0.304	4	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]Br)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]Br)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Br<1>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5720	0.000	1	120.5720	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]Br)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]I)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]Br)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|I<1>}	C[6](C[6]C[6]H)(C[6]C[6]I)(H){1|Br<1>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5240	0.000	1	120.5240	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]Br)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]Br)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Br<1>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3700	0.000	1	121.1051	0.713	49	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]Br)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]Br)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Br<1>,1|C<3>,1|N<3>}	H(C[6]C[6]2)	120.7870	0.000	1	121.1051	0.713	49	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]Br)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]Br)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Br<1>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.6214	1.484	11	121.1051	0.713	49	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]Br)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]Br)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Br<1>,2|N<3>}	H(C[6]C[6]2)	121.1490	0.601	6	121.1051	0.713	49	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]Br)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]Br)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){2|Br<1>,1|N<3>}	H(C[6]C[6]2)	120.1835	0.688	2	121.1051	0.713	49	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]Br)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]Br)(C[6]C[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Br<1>,1|C<3>,1|N<3>}	H(C[6]C[6]2)	120.5645	0.489	2	121.1051	0.713	49	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]Br)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]Br)(C[6]C[6]H)(H){1|Cu<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Br<2>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.6110	0.000	1	121.1051	0.713	49	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]Br)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]Br)(C[6]C[6]H)(H){1|Fe<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Br<1>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	121.4640	0.000	1	121.1051	0.713	49	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]Br)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]Br)(C[6]C[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Br<1>,1|C<3>,1|N<3>}	H(C[6]C[6]2)	120.9127	0.556	3	121.1051	0.713	49	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]Br)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]Br)(C[6]C[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Br<1>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.5100	0.000	1	121.1051	0.713	49	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]Br)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]Br)(C[6]C[6]H)(H){1|Ir<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Br<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.8170	0.000	1	121.1051	0.713	49	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]Br)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]Br)(C[6]C[6]H)(H){1|Ir<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Br<1>,2|N<3>}	H(C[6]C[6]2)	120.7190	0.000	1	121.1051	0.713	49	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]Br)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]Br)(C[6]C[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Br<1>,1|C<3>,1|N<3>}	H(C[6]C[6]2)	121.1369	0.220	8	121.1051	0.713	49	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]Br)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]Br)(C[6]C[6]H)(H){1|Os<9>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Br<1>,1|C<3>,1|N<3>}	H(C[6]C[6]2)	120.2410	0.000	1	121.1051	0.713	49	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]Br)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]Br)(C[6]C[6]H)(H){1|Ru<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Br<1>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.9670	0.232	4	121.1051	0.713	49	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]Br)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]Br)(C[6]C[6]H)(H){1|Ru<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Br<1>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	121.4253	0.032	3	121.1051	0.713	49	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]Br)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]Br)(C[6]C[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Br<1>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.7155	0.428	2	121.1051	0.713	49	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H){2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cl<1>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.9540	0.000	1	120.9540	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H){1|Re<6>,1|N<2>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Cl<1>,1|N<3>}	H(C[6]C[6]2)	119.8750	0.000	1	119.8750	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H){1|Al<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){2|Cl<1>,1|N<3>}	H(C[6]C[6]2)	120.7777	0.272	4	120.8176	0.342	41	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H){1|B<3>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){2|Cl<1>,1|N<3>}	H(C[6]C[6]2)	120.5640	0.115	2	120.8176	0.342	41	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Cl<1>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5517	0.123	4	120.8176	0.342	41	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Cl<1>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6904	0.223	8	120.8176	0.342	41	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Cl<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	121.2130	0.000	1	120.8176	0.342	41	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Cl<1>,2|N<3>}	H(C[6]C[6]2)	121.8810	0.000	1	120.8176	0.342	41	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Cl<1>,1|C<3>,1|N<3>}	H(C[6]C[6]2)	120.7835	0.228	2	120.8176	0.342	41	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H){1|Fe<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Cl<1>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.9895	0.303	2	120.8176	0.342	41	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Cl<1>,1|C<3>,1|N<3>}	H(C[6]C[6]2)	120.6466	1.248	7	120.8176	0.342	41	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Cl<1>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	121.2240	0.221	4	120.8176	0.342	41	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Cl<1>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7810	0.000	1	120.8176	0.342	41	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H){1|Ni<6>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Cl<1>,1|Ni<6>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	121.1220	0.000	1	120.8176	0.342	41	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H){1|Os<9>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Cl<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.6090	0.000	1	120.8176	0.342	41	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Cl<1>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.1275	0.573	2	120.8176	0.342	41	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Cl<1>,1|C<3>,1|N<3>}	H(C[6]C[6]2)	120.7220	0.000	1	120.8176	0.342	41	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H)	C[6](C[6]N[6]Pd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H){1|Pd<4>,1|N<3>}	C[6](C[6]N[6]Pd)(C[6]C[6]H)(H){1|Cl<1>,1|C<4>,1|N<2>}	H(C[6]C[6]2)	121.9400	0.000	1	121.9400	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]Fe)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]Fe)(C[6]C[6]H)(H){1|Fe<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Fe<5>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.4450	0.000	1	119.4450	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]Ir)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ir<6>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	118.8320	0.000	1	118.8454	0.095	10	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]Ir)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Ir<6>,1|C<3>,1|N<3>}	H(C[6]C[6]2)	118.8940	0.124	4	118.8454	0.095	10	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]Ir)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Ir<6>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	118.8840	0.000	1	118.8454	0.095	10	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]Ir)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Ir<6>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	118.6490	0.000	1	118.8454	0.095	10	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]Ir)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Ir<6>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	119.3690	0.000	1	118.8454	0.095	10	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]Ir)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Ir<6>,1|Si<4>,1|N<3>}	H(C[6]C[6]2)	118.9800	0.000	1	118.8454	0.095	10	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]Ir)(C[6]C[6]H)(H){1|Ir<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ir<7>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	118.1640	0.000	1	118.8454	0.095	10	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]Mg)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]Mg)(C[6]C[6]H)(H){1|Li<3>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Mg<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	118.7720	0.000	1	118.4140	0.256	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]Mg)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]Mg)(C[6]C[6]H)(H){1|Mg<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Mg<5>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	118.0560	0.000	1	118.4140	0.256	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]Mo)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]Mo)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Mo<6>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.9390	0.000	1	120.9390	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]Ni)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]Ni)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ni<4>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	121.5845	0.097	2	121.5845	0.009	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]Os)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]Os)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Os<7>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	121.4200	0.000	1	119.0694	1.758	5	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]Os)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]Os)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Os<6>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	118.5910	0.000	1	119.0694	1.758	5	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]Os)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]Os)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Os<7>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	118.5220	0.269	2	119.0694	1.758	5	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]Os)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]Os)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Os<8>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	118.2920	0.000	1	119.0694	1.758	5	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]Pd)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]Pd)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Pd<4>,2|N<3>}	H(C[6]C[6]2)	120.2750	0.000	1	120.2750	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]Pd)(C[6]C[6]H)(H)	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]Pd)(C[6]C[6]H)(H){1|Cl<1>,1|C<4>,1|N<2>}	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H){1|Pd<4>,1|N<3>}	H(C[6]C[6]2)	119.2880	0.000	1	119.2880	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]Rh)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]Rh)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(H){1|Rh<6>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	118.5695	0.081	2	118.5695	0.007	2	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]Ru)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ru<9>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	118.6560	0.000	1	119.6226	0.882	7	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]Ru)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ru<10>,1|H<1>,1|N<4>}	H(C[6]C[6]2)	120.1330	0.113	2	119.6226	0.882	7	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]Ru)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ru<8>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.0575	0.224	2	119.6226	0.882	7	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]Ru)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|Ru<8>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.2910	0.000	1	119.6226	0.882	7	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]Ru)(C[6]C[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ru<8>,1|C<3>,1|N<3>}	H(C[6]C[6]2)	119.0300	0.000	1	119.6226	0.882	7	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]Se)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]Se)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(H){1|Se<2>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.9310	0.000	1	120.5391	0.127	9	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]Se)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]Se)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Se<1>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2190	0.000	1	120.5391	0.127	9	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]Se)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]Se)(C[6]C[6]H)(H){1|Mo<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Se<2>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7175	0.327	2	120.5391	0.127	9	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]Se)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]Se)(C[6]C[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Se<2>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1330	0.000	1	120.5391	0.127	9	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]Se)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]Se)(C[6]C[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Se<2>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4250	0.000	1	120.5391	0.127	9	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]Se)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]Se)(C[6]C[6]H)(H){1|Sn<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Se<2>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5697	0.453	3	120.5391	0.127	9	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]Si)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]Si)(C[6]C[6]H)(H){1|Al<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Si<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.3830	0.000	1	119.8288	0.916	39	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]Si)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]Si)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Ir<6>,1|Si<4>,1|N<3>}	H(C[6]C[6]2)	120.2700	0.000	1	119.8288	0.916	39	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]Si)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]Si)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){2|Si<4>,1|N<3>}	H(C[6]C[6]2)	119.8735	0.289	2	119.8288	0.916	39	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]Si)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]Si)(C[6]C[6]H)(H){1|Co<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Si<4>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	119.8850	0.000	1	119.8288	0.916	39	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]Si)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]Si)(C[6]C[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Si<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3790	2.208	2	119.8288	0.916	39	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]Si)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]Si)(C[6]C[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Si<5>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.3485	0.069	2	119.8288	0.916	39	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]Si)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]Si)(C[6]C[6]H)(H){1|Cu<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Si<5>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	115.0110	0.000	1	119.8288	0.916	39	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]Si)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]Si)(C[6]C[6]H)(H){1|Fe<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Si<4>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	119.7385	0.107	2	119.8288	0.916	39	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]Si)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]Si)(C[6]C[6]H)(H){1|Mo<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Si<4>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.0730	0.053	3	119.8288	0.916	39	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]Si)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]Si)(C[6]C[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Si<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.6888	0.341	10	119.8288	0.916	39	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]Si)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]Si)(C[6]C[6]H)(H){1|Pt<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Si<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.6653	0.338	6	119.8288	0.916	39	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]Si)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]Si)(C[6]C[6]H)(H){1|Pt<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Si<5>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3745	0.277	8	119.8288	0.916	39	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]Sn)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]Sn)(C[6]C[6]H)(H){1|Eu<6>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Sn<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.5057	0.077	3	119.6175	0.114	15	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]Sn)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]Sn)(C[6]C[6]H)(H){1|Li<4>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Sn<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.6455	0.374	12	119.6175	0.114	15	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]Sn)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]Sn)(C[6]C[6]H)(H){1|Al<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Sn<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.2055	0.342	6	118.9880	0.191	10	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]Sn)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]Sn)(C[6]C[6]H)(H){1|Al<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Sn<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	118.6617	0.377	4	118.9880	0.191	10	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]Th)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]Th)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Th<14>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7040	0.000	1	119.7040	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]Zr)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]Zr)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Zr<13>,1|C<2>,1|N<3>}	H(C[6]C[6]2)	120.4930	0.000	1	120.5777	0.056	3	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]Zr)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]Zr)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Zr<13>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8440	0.000	1	120.5777	0.056	3	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]Zr)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]Zr)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Zr<9>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.3960	0.000	1	120.5777	0.056	3	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6a]C[6])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|N<3>}	H(C[6]C[6]2)	120.9574	0.056	10	120.9574	0.003	10	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6a]N[6])(C[6]C[6]H)(H){1|H<1>,1|O<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	119.7727	0.270	3	119.9328	0.089	5	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6a]N[6])(C[6]C[6]H)(H){1|Ir<8>,1|B<3>,1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.1730	0.141	2	119.9328	0.089	5	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]P[5,6,6]Si)(C[6]C[6]H)(H)	C[6](C[6]C[5,3x6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]P[5,6,6]Si)(C[6]C[6]H)(H){1|Au<2>,1|C<4>,1|H<1>,1|P<3>}	C[6](C[6]C[5,3x6]H)(C[6]C[6]H)(H){1|Si<4>,1|C<3>,1|C<4>,1|P<4>}	H(C[6]C[6]2)	116.7340	0.000	1	116.4942	1.241	4	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]P[5,6,6]Si)(C[6]C[6]H)(H)	C[6](C[6]C[5,3x6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]P[5,6,6]Si)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|P<3>}	C[6](C[6]C[5,3x6]H)(C[6]C[6]H)(H){1|Si<4>,1|C<3>,1|C<4>,1|P<3>}	H(C[6]C[6]2)	114.8580	0.000	1	116.4942	1.241	4	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]P[5,6,6]Si)(C[6]C[6]H)(H)	C[6](C[6]C[5,3x6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]P[5,6,6]Si)(C[6]C[6]H)(H){1|Cu<3>,1|C<4>,1|H<1>,1|P<3>}	C[6](C[6]C[5,3x6]H)(C[6]C[6]H)(H){1|Si<4>,1|C<3>,1|C<4>,1|P<4>}	H(C[6]C[6]2)	117.1925	0.112	2	116.4942	1.241	4	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]P[6]Cl)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]P[6]Cl)(C[6]C[6]H)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Cl<1>,1|H<1>,1|P<3>}	H(C[6]C[6]2)	118.3252	0.278	5	118.3252	0.077	5	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]P[6]Si)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]P[6]Si)(C[6]C[6]H)(H){1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Si<4>,1|P<2>,1|P<3>}	H(C[6]C[6]2)	117.2380	0.000	1	116.0671	1.083	7	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]P[6]Si)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]P[6]Si)(C[6]C[6]H)(H){1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Si<4>,1|P<2>,1|P<4>}	H(C[6]C[6]2)	117.3900	0.000	1	116.0671	1.083	7	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]P[6]Si)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]P[6]Si)(C[6]C[6]H)(H){1|Ru<6>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Si<4>,1|P<3>,1|P<4>}	H(C[6]C[6]2)	115.2453	0.812	3	116.0671	1.083	7	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]P[6]Si)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]P[6]Si)(C[6]C[6]H)(H){1|Ru<8>,1|O<2>,2|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Si<4>,1|H<1>,2|P<4>}	H(C[6]C[6]2)	116.0530	0.187	2	116.0671	1.083	7	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]Si[6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]Si[6]C[6])(C[6]C[6]H)(H){1|C<2>,1|C<3>,2|H<1>,2|O<2>}	C[6](C[6]C[6]H)2(H){1|Si<4>,1|C<3>}	H(C[6]C[6]2)	117.7030	0.000	1	117.7030	0.000	1	120.3484	0.878	97679	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:I-1:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]I)(H)	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(I)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]I)(H){1|O<1>,2|C<3>}	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(I){1|O<1>,2|C<3>}	H(C[6]C[6]2)	118.8540	0.000	1	118.8540	0.000	1	120.3802	0.555	134	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:I-1:	C[6]-3:	C[6](C[6]C[6,6a]S)(C[6]C[6]I)(H)	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(I)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]S)(C[6]C[6]I)(H){1|O<1>,2|C<3>}	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(I){1|C<3>,1|N<2>,1|S<4>}	H(C[6]C[6]2)	119.5380	0.000	1	119.5380	0.000	1	120.3802	0.555	134	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:I-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]I)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(I)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]I)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(I){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.1940	0.000	2	120.1940	0.000	2	120.3802	0.555	134	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:I-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]I)(H)	C[6](C[6]C[6]H)2(I)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]I)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(I){1|H<1>,2|C<3>}	H(C[6]C[6]2)	116.1650	0.000	1	116.1650	0.000	1	120.3802	0.555	134	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:I-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]I)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(I)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]I)(H){1|Br<1>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(I){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	118.8010	0.000	1	120.2592	0.266	53	120.3802	0.555	134	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:I-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]I)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(I)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]I)(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(I){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.5648	0.138	5	120.2592	0.266	53	120.3802	0.555	134	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:I-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]I)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(I)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]I)(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(I){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.7190	0.000	1	120.2592	0.266	53	120.3802	0.555	134	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:I-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]I)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(I)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]I)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(I){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.5602	0.411	23	120.2592	0.266	53	120.3802	0.555	134	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:I-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]I)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(I)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]I)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(I){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0997	0.290	18	120.2592	0.266	53	120.3802	0.555	134	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:I-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]I)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(I)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]I)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(I){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.9290	0.000	1	120.2592	0.266	53	120.3802	0.555	134	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:I-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]I)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(I)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]I)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(I){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.8090	0.000	1	120.2592	0.266	53	120.3802	0.555	134	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:I-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]I)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(I)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]I)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(I){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6810	0.000	1	120.2592	0.266	53	120.3802	0.555	134	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:I-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]I)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(I)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]I)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(I){1|Zn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1495	0.540	2	120.2592	0.266	53	120.3802	0.555	134	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:I-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]I)(H)	C[6](C[6]C[6]H)2(I)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]I)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(I){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1317	0.516	12	120.4368	1.454	13	120.3802	0.555	134	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:I-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]I)(H)	C[6](C[6]C[6]H)2(I)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]I)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(I){1|H<1>,2|C<3>}	H(C[6]C[6]2)	124.0970	0.000	1	120.4368	1.454	13	120.3802	0.555	134	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:I-1:	C[6]-3:	C[6](C[6]C[6]I)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(I)	H(C[6]C[6]2)	C[6](C[6]C[6]I)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(I){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	119.5370	0.255	2	119.2637	0.257	3	120.3802	0.555	134	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:I-1:	C[6]-3:	C[6](C[6]C[6]I)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(I)	H(C[6]C[6]2)	C[6](C[6]C[6]I)(C[6]C[6]O)(H){1|H<1>,1|O<1>,2|C<4>}	C[6](C[6]C[6]H)(C[6]C[6]O)(I){1|C<4>,1|O<1>,2|H<1>}	H(C[6]C[6]2)	118.7170	0.000	1	119.2637	0.257	3	120.3802	0.555	134	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:I-1:	C[6]-3:	C[6](C[6]C[6]I)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(I)	H(C[6]C[6]2)	C[6](C[6]C[6]I)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(I){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.5946	0.394	30	120.5946	0.145	34	120.3802	0.555	134	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:I-1:	C[6]-3:	C[6](C[6]C[6]I)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(I)	H(C[6]C[6]2)	C[6](C[6]C[6]I)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(I){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.3295	0.005	2	120.5946	0.145	34	120.3802	0.555	134	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:I-1:	C[6]-3:	C[6](C[6]C[6]I)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(I)	H(C[6]C[6]2)	C[6](C[6]C[6]I)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(I){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8595	0.049	2	120.5946	0.145	34	120.3802	0.555	134	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:I-1:	C[6]-3:	C[6](C[6]C[6]I)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(I)	H(C[6]C[6]2)	C[6](C[6]C[6]I)2(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(I){1|C<3>,2|I<1>}	H(C[6]C[6]2)	120.8570	0.040	2	120.8570	0.002	2	120.3802	0.555	134	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:I-1:	C[6]-3:	C[6](C[6]C[6]I)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(I)	H(C[6]C[6]2)	C[6](C[6]C[6]I)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(I){1|C<3>,1|C<4>,1|I<1>}	H(C[6]C[6]2)	120.7187	0.640	16	120.7187	0.410	16	120.3802	0.555	134	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:I-1:	C[6]-3:	C[6](C[6]C[6]I)2(H)	C[6](C[6]C[6]H)2(I)	H(C[6]C[6]2)	C[6](C[6]C[6]I)2(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(I){1|C<3>,2|I<1>}	H(C[6]C[6]2)	120.8170	0.065	2	120.8170	0.004	2	120.3802	0.555	134	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:I-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]I)(H)	C[6](C[6]C[6]H)2(I)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]I)(H){1|Pt<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(I){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.9725	0.088	2	120.5697	0.222	4	120.3802	0.555	134	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:I-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]I)(H)	C[6](C[6]C[6]H)2(I)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]I)(H){1|Ru<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(I){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1670	0.103	2	120.5697	0.222	4	120.3802	0.555	134	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:I-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]I)(H)	C[6](C[6]C[6]H)2(I)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]I)(H){1|Pt<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(I){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.7270	0.595	2	120.7270	0.354	2	120.3802	0.555	134	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(N)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(N){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7293	0.250	4	119.7293	0.063	4	119.7063	0.109	6	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(N)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(N){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.0790	0.000	1	120.0790	0.000	1	119.7063	0.109	6	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(N)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N)(H){1|C<4>,2|H<1>,3|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(N){1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.2420	0.000	1	119.2420	0.000	1	119.7063	0.109	6	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[3,5,6]O)(C[6]C[6]O)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[3,5,6]O)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|H<1>,1|O<2>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(O){1|O<2>,2|C<4>}	H(C[6]C[6]2)	119.2760	0.000	1	119.2760	0.000	1	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[3,6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(O)	H(C[6]C[6]2)	C[6](C[6]C[3,6]C)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(O){1|H<1>,2|C<4>}	H(C[6]C[6]2)	118.3030	0.000	1	118.3030	0.000	1	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[3,6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(O)	H(C[6]C[6]2)	C[6](C[6]C[3,6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(O){1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.6820	0.000	1	119.6820	0.000	1	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[4,6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(O)	H(C[6]C[6]2)	C[6](C[6]C[4,6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(O){1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.1295	0.062	2	119.1295	0.004	2	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,5,6]H)(C[6]C[6]O)(H)	C[6](C[6]C[5,6]Cl)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,5,6]H)(C[6]C[6]O)(H){1|Cl<1>,1|C<3>,2|C<4>}	C[6](C[6]C[5,6]Cl)(C[6]C[6]H)(O){1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	118.5440	0.000	1	118.5440	0.000	1	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,5,6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(O)	H(C[6]C[6]2)	C[6](C[6]C[5,5,6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(O){1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.1535	0.060	2	119.1535	0.004	2	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6,6]H)(C[6]C[6]O)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6,6]H)(C[6]C[6]O)(H){1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(O){1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.0060	0.000	1	119.0060	0.000	1	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6,6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6,6]H)(C[6]C[6]O)(H){1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(O){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.3070	0.000	1	119.3070	0.000	1	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6,6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6,6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(O){1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.1370	0.457	2	119.1370	0.209	2	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[6]O)(H)	C[6](C[6]C[5,6]C)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[6]O)(H){1|C<3>,3|C<4>}	C[6](C[6]C[5,6]C)(C[6]C[6]H)(O){1|O<2>,2|C<4>}	H(C[6]C[6]2)	118.0910	0.076	2	118.0910	0.006	2	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[6]O)(H){1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(O){3|C<4>}	H(C[6]C[6]2)	118.7405	0.442	2	118.7017	0.181	9	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[6]O)(H){1|H<1>,1|N<2>,2|C<3>}	C[6](C[6]C[6]H)2(O){1|H<1>,2|C<4>}	H(C[6]C[6]2)	118.2720	0.000	1	118.7017	0.181	9	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[6]O)(H){1|H<1>,1|O<2>,2|C<3>}	C[6](C[6]C[6]H)2(O){1|C<3>,1|C<4>,1|O<2>}	H(C[6]C[6]2)	119.2585	0.527	2	118.7017	0.181	9	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[6]O)(H){1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(O){3|C<4>}	H(C[6]C[6]2)	118.5113	0.089	4	118.7017	0.181	9	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6]C[6a])(C[6]C[6]O)(H)	C[6](C[6]C[5,6]C[6a])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C[6a])(C[6]C[6]O)(H){1|N<2>,4|C<3>}	C[6](C[6]C[5,6]C[6a])(C[6]C[6]H)(O){1|O<2>,4|C<3>}	H(C[6]C[6]2)	118.0610	0.000	1	118.0610	0.000	1	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6]Cl)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]Cl)(C[6]C[6]O)(H){1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(O){1|Cl<1>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.0620	0.000	1	119.0620	0.000	1	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(O){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.0280	0.000	1	119.0050	0.001	2	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|H<1>,1|O<2>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(O){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	118.9820	0.000	1	119.0050	0.001	2	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(O){1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.3425	0.129	2	119.0890	0.340	83	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(O){1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.1296	0.221	5	119.0890	0.340	83	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(O){1|C<4>,2|H<1>}	H(C[6]C[6]2)	118.8794	1.071	10	119.0890	0.340	83	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)2(O){1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.1718	0.087	4	119.0890	0.340	83	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)2(O){1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.0420	0.193	4	119.0890	0.340	83	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(O){1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.2767	0.250	4	119.0890	0.340	83	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|C<4>,1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(O){1|C<4>,2|H<1>}	H(C[6]C[6]2)	118.7435	1.190	10	119.0890	0.340	83	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|H<1>,1|N<2>,2|C<3>}	C[6](C[6]C[6]H)2(O){1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.1248	0.141	4	119.0890	0.340	83	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|H<1>,1|N<2>,2|C<3>}	C[6](C[6]C[6]H)2(O){1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.3620	0.000	1	119.0890	0.340	83	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(O){1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.2010	0.177	15	119.0890	0.340	83	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(O){1|Cl<1>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	118.7350	0.000	1	119.0890	0.340	83	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|H<1>,1|O<2>,2|C<3>}	C[6](C[6]C[6]H)2(O){1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.1670	0.180	10	119.0890	0.340	83	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(O){1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.1989	0.274	13	119.0890	0.340	83	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6]O)(C[6]C[6]O)(H)	C[6](C[6]C[5,6]C)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]O)(C[6]C[6]O)(H){1|C<4>,2|C<3>}	C[6](C[6]C[5,6]C)(C[6]C[6]H)(O){1|C<3>,2|O<2>}	H(C[6]C[6]2)	120.1550	0.000	1	120.1550	0.000	1	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6]O)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]O)(C[6]C[6]O)(H){1|C<4>,1|O<2>,2|C<3>}	C[6](C[6]C[6]H)(C[6]C[6]O)(O){1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.0020	0.000	1	119.3065	0.185	2	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6]O)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]O)(C[6]C[6]O)(H){2|C<3>,2|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(O){1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.6110	0.000	1	119.3065	0.185	2	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6]O)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]O)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(O){1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.8260	0.243	2	118.7960	2.105	8	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6]O)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]O)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(O){1|C<4>,2|O<2>}	H(C[6]C[6]2)	116.4870	0.335	2	118.7960	2.105	8	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6]O)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]O)(C[6]C[6]O)(H){1|C<4>,1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(O){1|C<4>,2|O<2>}	H(C[6]C[6]2)	119.4180	0.025	2	118.7960	2.105	8	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6]O)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]O)(C[6]C[6]O)(H){1|H<1>,1|O<2>,2|C<3>}	C[6](C[6]C[6]H)2(O){1|C<3>,1|C<4>,1|O<2>}	H(C[6]C[6]2)	119.4530	0.379	2	118.7960	2.105	8	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(C[6]C[6]O)(H)	C[6](C[6]C[5a,6]C)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)(C[6]C[6]O)(H){1|N<3>,2|C<3>}	C[6](C[6]C[5a,6]C)(C[6]C[6]H)(O){1|H<1>,2|C<3>}	H(C[6]C[6]2)	118.8760	0.226	2	118.8760	0.051	2	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5a,6]N)(C[6]C[6]O)(H)	C[6](C[6]C[5a,6]O)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]N)(C[6]C[6]O)(H){1|O<1>,2|C<3>}	C[6](C[6]C[5a,6]O)(C[6]C[6]H)(O){1|C<3>,2|N<3>}	H(C[6]C[6]2)	116.9675	3.525	2	116.9675	12.425	2	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(O)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]O)(H){1|H<1>,1|O<1>,3|C<3>}	C[6](C[6]C[6]H)2(O){1|H<1>,2|C<3>}	H(C[6]C[6]2)	118.4640	0.000	1	118.4640	0.000	1	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6,6]C)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[6,6]C)(C[6]C[6]H)(O){1|H<1>,3|C<4>}	H(C[6]C[6]2)	118.8877	0.210	4	119.1401	0.111	14	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6,6]C)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|C<3>,3|C<4>}	C[6](C[6]C[6,6]C)(C[6]C[6]H)(O){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.1365	0.499	4	119.1401	0.111	14	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6,6]C)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|C<3>,3|C<4>}	C[6](C[6]C[6,6]C)(C[6]C[6]H)(O){1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.3690	0.084	5	119.1401	0.111	14	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6,6]C)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|C<3>,3|C<4>}	C[6](C[6]C[6,6]C)(C[6]C[6]H)(O){2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.0200	0.000	1	119.1401	0.111	14	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|F<1>,1|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(O){1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.6105	0.170	4	119.3516	0.125	60	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|H<1>,1|O<2>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(O){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	118.9750	0.000	1	119.3516	0.125	60	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|H<1>,1|O<2>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(O){1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.4080	0.000	1	119.3516	0.125	60	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(O){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.6293	0.658	3	119.3516	0.125	60	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(O){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.5560	0.007	2	119.3516	0.125	60	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(O){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.0665	0.162	4	119.3516	0.125	60	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(O){1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.3379	0.354	43	119.3516	0.125	60	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|C<4>,1|H<1>,2|C<3>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(O){1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.3100	0.000	1	119.3516	0.125	60	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(O){1|C<3>,1|H<1>,1|P<4>}	H(C[6]C[6]2)	119.1670	0.000	1	119.3516	0.125	60	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|C<4>,1|O<2>,2|C<3>}	C[6](C[6]C[6]H)(C[6]C[6]O)(O){1|C<4>,2|H<1>}	H(C[6]C[6]2)	118.9480	0.000	1	118.9480	0.000	1	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(O){1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.0712	0.216	6	118.8644	0.337	15	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|H<1>,1|N<2>,2|C<3>}	C[6](C[6]C[6]H)2(O){1|C<4>,2|H<1>}	H(C[6]C[6]2)	117.5290	0.093	2	118.8644	0.337	15	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(O){1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.0497	0.152	3	118.8644	0.337	15	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|H<1>,1|O<2>,2|C<3>}	C[6](C[6]C[6]H)2(O){1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.0830	0.320	4	118.8644	0.337	15	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]O)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]O)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(O){1|C<3>,2|O<2>}	H(C[6]C[6]2)	119.9550	0.000	1	119.9550	0.000	1	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]O)(H)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|O<1>}	C[6](C[6]C[6,6]O)(C[6]C[6]H)(O){1|C<3>,1|C<4>,1|O<2>}	H(C[6]C[6]2)	120.0360	0.000	1	119.9515	0.014	2	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]O)(H)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]O)(H){1|C<3>,1|O<1>,1|O<2>}	C[6](C[6]C[6,6]O)(C[6]C[6]H)(O){1|C<3>,1|C<4>,1|O<2>}	H(C[6]C[6]2)	119.8670	0.000	1	119.9515	0.014	2	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]O)(H){1|C<3>,1|O<2>,2|C<4>}	C[6](C[6]C[6]H)(C[6]C[6]O)(O){1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	118.8285	0.180	2	118.8285	0.033	2	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6a]C[6])(C[6]C[6]O)(H)	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C[6])(C[6]C[6]O)(H){1|C<4>,1|H<1>,1|O<1>,3|C<3>}	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(O){1|C<4>,2|C<3>}	H(C[6]C[6]2)	118.4310	0.000	1	118.4310	0.000	1	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(H)	C[6](C[6]C[6,6a]C)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(H){3|C<3>}	C[6](C[6]C[6,6a]C)(C[6]C[6]H)(O){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.5830	0.000	1	119.1028	0.818	67	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(H)	C[6](C[6]C[6,6a]C)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(H){3|C<3>}	C[6](C[6]C[6,6a]C)(C[6]C[6]H)(O){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.0955	0.909	66	119.1028	0.818	67	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(H)	C[6](C[6]C[6,6a]C[6,6])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(H){3|C<3>}	C[6](C[6]C[6,6a]C[6,6])(C[6]C[6]H)(O){1|H<1>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	118.9440	0.000	1	118.9440	0.000	1	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(H)	C[6](C[6]C[6,6a]C[6])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6,6a]C[6])(C[6]C[6]H)(O){1|N<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.1250	0.000	1	120.0172	0.829	6	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(H)	C[6](C[6]C[6,6a]C[6])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(H){3|C<3>}	C[6](C[6]C[6,6a]C[6])(C[6]C[6]H)(O){1|H<1>,4|C<3>}	H(C[6]C[6]2)	119.9956	1.016	5	120.0172	0.829	6	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(H)	C[6](C[6]C[6,6a]C[6a])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(H){3|C<3>}	C[6](C[6]C[6,6a]C[6a])(C[6]C[6]H)(O){1|H<1>,4|C<3>}	H(C[6]C[6]2)	118.9262	0.266	4	118.9262	0.071	4	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(O){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.4530	0.309	4	119.4530	0.096	4	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(H)	C[6](C[6]C[6,6a]N)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(H){1|N<2>,2|C<3>}	C[6](C[6]C[6,6a]N)(C[6]C[6]H)(O){1|H<1>,2|C<3>}	H(C[6]C[6]2)	118.0726	1.884	53	118.0726	3.549	53	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(H)	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(H){1|O<1>,2|C<3>}	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(O){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.6603	0.393	3	119.6603	0.155	3	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6a]N)(C[6]C[6]O)(H)	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]N)(C[6]C[6]O)(H){1|O<1>,2|C<3>}	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(O){1|N<3>,2|C<3>}	H(C[6]C[6]2)	118.2950	0.000	1	118.2950	0.000	1	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6a]N[5a])(C[6]C[6]O)(H)	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]N[5a])(C[6]C[6]O)(H){1|O<1>,4|C<3>}	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(O){1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.1200	0.000	1	119.1200	0.000	1	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]O)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]O)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(O){1|C<3>,2|O<2>}	H(C[6]C[6]2)	119.5560	0.000	1	119.5560	0.000	1	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]O)(H)	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]O)(H){1|O<1>,2|C<3>}	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(O){1|C<3>,1|N<2>,1|O<2>}	H(C[6]C[6]2)	119.4770	0.000	1	118.5237	0.711	3	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]O)(H)	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]O)(H){1|O<1>,2|C<3>}	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(O){1|O<1>,2|C<3>}	H(C[6]C[6]2)	118.0470	0.242	2	118.5237	0.711	3	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6a]S)(C[6]C[6]O)(H)	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]S)(C[6]C[6]O)(H){1|O<1>,2|C<3>}	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(O){1|S<2>,2|C<3>}	H(C[6]C[6]2)	118.8550	0.204	3	118.8550	0.041	3	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6]O)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6]O)(H){1|C<4>,1|O<1>,3|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(O){1|H<1>,2|C<3>}	H(C[6]C[6]2)	111.5970	0.000	1	111.5970	0.000	1	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(O)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6]O)(H){1|C<4>,1|H<1>,1|O<1>,3|C<3>}	C[6](C[6]C[6]H)2(O){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	118.7215	0.029	2	118.7215	0.001	2	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(O)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)2(O){1|Br<1>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	114.7540	0.000	1	116.2630	4.554	2	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(O)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(O){1|Br<1>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	117.7720	0.000	1	116.2630	4.554	2	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]O)(H)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]O)(H){1|O<1>,2|C<3>}	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(O){1|Br<1>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.3880	0.000	1	119.3880	0.000	1	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]2)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|O<1>,2|C<3>}	C[6](C[6]C[6]2)(C[6]C[6]H)(O){1|C<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	118.9610	0.000	1	118.9610	0.000	1	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|N<2>}	C[6](C[6]C[6]C)(C[6]C[6]H)(O){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	118.2770	0.000	1	118.2446	0.963	54	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|O<1>}	C[6](C[6]C[6]C)(C[6]C[6]H)(O){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	118.3164	0.854	50	118.2446	0.963	54	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|O<1>}	C[6](C[6]C[6]C)(C[6]C[6]H)(O){1|C<3>,2|C<4>}	H(C[6]C[6]2)	119.1740	0.000	1	118.2446	0.963	54	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|Cl<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(O){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	115.9695	1.948	2	118.2446	0.963	54	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|C<3>,1|N<3>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]N)(O){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	118.2577	0.114	3	118.2577	0.013	3	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(O){1|C<3>,2|C<4>}	H(C[6]C[6]2)	119.2220	1.304	3	118.9266	0.684	7	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|C<3>,1|O<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(O){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	118.7050	0.288	4	118.9266	0.684	7	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(O)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)2(O){1|H<1>,2|C<3>}	H(C[6]C[6]2)	117.9490	0.000	1	119.0200	0.813	22	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(O)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(O){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	118.6850	0.000	1	119.0200	0.813	22	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(O)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(O){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	118.7780	0.000	1	119.0200	0.813	22	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(O)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(O){1|C<3>,2|C<4>}	H(C[6]C[6]2)	119.0260	0.953	17	119.0200	0.813	22	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(O)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(O){3|C<3>}	H(C[6]C[6]2)	119.7935	0.177	2	119.0200	0.813	22	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|O<1>,2|C<3>}	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(O){2|C<4>,3|C<3>}	H(C[6]C[6]2)	118.9345	0.660	2	118.9345	0.435	2	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]O)(H)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]O)(H){1|Cl<1>,1|C<3>,1|H<1>}	C[6](C[6]C[6]Cl)(C[6]C[6]H)(O){1|Cl<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9050	0.000	1	119.9050	0.000	1	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(O)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(O){1|Cl<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.5400	0.000	1	119.7029	0.047	7	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(O)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]O)(H){1|Cl<1>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(O){1|Cl<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.6550	0.170	2	119.7029	0.047	7	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(O)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]O)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(O){2|Cl<1>,1|C<3>}	H(C[6]C[6]2)	119.7675	0.262	4	119.7029	0.047	7	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[4]C[6])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|H<1>,2|C<3>}	C[6](C[6]C[4]C[6])(C[6]C[6]H)(O){1|C<4>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9295	0.172	2	119.9295	0.030	2	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[5]C[6])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|O<1>}	C[6](C[6]C[5]C[6])(C[6]C[6]H)(O){1|C<3>,1|O<2>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	120.0400	0.000	1	118.2712	4.902	5	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[5]C[6])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|H<1>,2|C<3>}	C[6](C[6]C[5]C[6])(C[6]C[6]H)(O){1|C<3>,2|H<1>,2|N<3>}	H(C[6]C[6]2)	117.2960	2.479	3	118.2712	4.902	5	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[5]C[6])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|O<2>,2|C<3>}	C[6](C[6]C[5]C[6])(C[6]C[6]H)(O){1|C<3>,2|H<1>,2|S<2>}	H(C[6]C[6]2)	119.4280	0.000	1	118.2712	4.902	5	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|H<1>,2|C<3>}	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(O){1|C<3>,1|C<4>,1|H<1>,1|N<2>,1|S<2>}	H(C[6]C[6]2)	120.9570	0.000	1	120.0455	1.662	2	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|O<1>,2|C<3>}	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(O){2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.1340	0.000	1	120.0455	1.662	2	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|N<2>,2|C<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(O){1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.4060	0.000	1	120.4060	0.000	1	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]2)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]2)(C[6]C[6]H)(O){1|N<3>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	118.9310	0.000	1	119.1437	1.320	6	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]2)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|O<1>}	C[6](C[6]C[6]2)(C[6]C[6]H)(O){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.4400	0.174	2	119.1437	1.320	6	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]2)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]2)(C[6]C[6]H)(O){1|C<3>,2|H<1>,2|N<3>}	H(C[6]C[6]2)	116.9680	0.000	1	119.1437	1.320	6	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]2)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]2)(C[6]C[6]H)(O){1|H<1>,4|C<3>}	H(C[6]C[6]2)	120.0415	0.032	2	119.1437	1.320	6	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]Br)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Br<1>,1|C<3>,1|H<1>}	C[6](C[6]C[6]Br)(C[6]C[6]H)(O){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.2250	0.000	1	119.2835	0.007	2	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]Br)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Br<1>,1|Cl<1>,1|C<3>}	C[6](C[6]C[6]Br)(C[6]C[6]H)(O){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.3420	0.000	1	119.2835	0.007	2	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Br<1>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(O){1|C<3>,2|H<1>}	H(C[6]C[6]2)	118.5300	0.000	1	118.7161	1.780	88	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Br<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(O){1|C<3>,2|H<1>}	H(C[6]C[6]2)	118.0053	2.207	7	118.7161	1.780	88	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(O){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.1665	0.385	2	118.7161	1.780	88	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|O<1>}	C[6](C[6]C[6]C)(C[6]C[6]H)(O){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.0390	0.000	1	118.7161	1.780	88	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|O<1>}	C[6](C[6]C[6]C)(C[6]C[6]H)(O){1|C<3>,2|H<1>}	H(C[6]C[6]2)	118.9330	0.000	1	118.7161	1.780	88	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|O<2>,2|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(O){1|C<4>,2|H<1>}	H(C[6]C[6]2)	117.2110	0.000	1	118.7161	1.780	88	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(O){1|C<3>,2|H<1>}	H(C[6]C[6]2)	118.7445	1.045	6	118.7161	1.780	88	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Cl<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(O){1|C<3>,2|H<1>}	H(C[6]C[6]2)	118.4166	1.507	7	118.7161	1.780	88	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(O){1|C<3>,1|F<1>,1|H<1>}	H(C[6]C[6]2)	120.2960	0.000	1	118.7161	1.780	88	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(O){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.8780	0.000	1	118.7161	1.780	88	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(O){1|C<3>,2|H<1>}	H(C[6]C[6]2)	118.8571	1.532	27	118.7161	1.780	88	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|I<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(O){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.4870	0.000	1	118.7161	1.780	88	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|N<2>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(O){1|C<3>,2|H<1>}	H(C[6]C[6]2)	118.1693	0.920	3	118.7161	1.780	88	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(O){1|C<3>,2|H<1>}	H(C[6]C[6]2)	118.7664	0.856	26	118.7161	1.780	88	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|O<2>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(O){1|C<3>,2|H<1>}	H(C[6]C[6]2)	117.6740	2.294	2	118.7161	1.780	88	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){3|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(O){1|C<3>,2|H<1>}	H(C[6]C[6]2)	118.9630	0.000	1	118.7161	1.780	88	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Cl<1>,1|C<3>,1|F<1>}	C[6](C[6]C[6]Cl)(C[6]C[6]H)(O){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.1407	0.219	4	119.0999	0.171	9	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Cl<1>,1|C<3>,1|O<1>}	C[6](C[6]C[6]Cl)(C[6]C[6]H)(O){1|C<3>,2|H<1>}	H(C[6]C[6]2)	118.5280	0.000	1	119.0999	0.171	9	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Cl<1>,1|C<3>,1|O<1>}	C[6](C[6]C[6]Cl)(C[6]C[6]H)(O){1|Cl<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.1145	0.211	2	119.0999	0.171	9	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){2|Cl<1>,1|C<3>}	C[6](C[6]C[6]Cl)(C[6]C[6]H)(O){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.2895	0.879	2	119.0999	0.171	9	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]I)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|I<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]I)(O){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.3170	0.000	1	119.0902	0.046	5	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]I)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|I<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]I)(O){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.1650	0.229	2	119.0902	0.046	5	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]I)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|I<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]C[6]I)(O){1|C<3>,2|H<1>}	H(C[6]C[6]2)	118.9020	0.000	2	119.0902	0.046	5	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(O){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.3835	0.457	2	118.7343	3.900	36	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(O){1|C<3>,2|H<1>}	H(C[6]C[6]2)	122.0990	3.108	3	118.7343	3.900	36	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(O){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.4578	0.280	4	118.7343	3.900	36	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|N<3>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]N)(O){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.5200	0.000	1	118.7343	3.900	36	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,2|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(O){1|C<3>,2|H<1>}	H(C[6]C[6]2)	117.7446	1.653	17	118.7343	3.900	36	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Cl<1>,1|C<3>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(O){1|C<3>,2|H<1>}	H(C[6]C[6]2)	114.9330	0.000	1	118.7343	3.900	36	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(O){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.4282	0.282	8	118.7343	3.900	36	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(O){1|C<3>,2|H<1>}	H(C[6]C[6]2)	121.1300	0.853	2	118.0030	14.857	7	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(O){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.9650	0.000	1	118.0030	14.857	7	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(O){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7370	0.000	1	118.0030	14.857	7	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|O<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(O){1|C<3>,1|H<1>,1|I<1>}	H(C[6]C[6]2)	119.0370	0.000	1	118.0030	14.857	7	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|O<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(O){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	112.5110	0.781	2	118.0030	14.857	7	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]P)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|P<4>}	C[6](C[6]C[6]H)(C[6]C[6]P)(O){1|C<3>,2|H<1>}	H(C[6]C[6]2)	118.8700	0.000	1	120.6955	6.665	2	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]P)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|P<4>}	C[6](C[6]C[6]H)(C[6]C[6]P)(O){1|C<3>,2|H<1>}	H(C[6]C[6]2)	122.5210	0.000	1	120.6955	6.665	2	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]S)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|S<4>}	C[6](C[6]C[6]H)(C[6]C[6]S)(O){1|C<3>,1|H<1>,1|P<4>}	H(C[6]C[6]2)	118.9800	0.000	1	113.5620	9.521	5	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]S)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|O<1>,1|S<3>}	C[6](C[6]C[6]H)(C[6]C[6]S)(O){1|C<3>,1|H<1>,1|S<3>}	H(C[6]C[6]2)	112.2075	0.681	4	113.5620	9.521	5	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<2>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(O){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.4285	0.033	2	119.2282	1.595	334	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)2(O){1|Br<1>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	115.5410	0.000	1	119.2282	1.595	334	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(O){1|Br<1>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	118.7730	0.000	1	119.2282	1.595	334	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(O){1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.1300	0.274	2	119.2282	1.595	334	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(O){1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.3825	0.097	2	119.2282	1.595	334	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(O){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.5503	0.331	26	119.2282	1.595	334	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|F<1>,1|H<1>}	C[6](C[6]C[6]H)2(O){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.1710	1.529	2	119.2282	1.595	334	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|I<1>}	C[6](C[6]C[6]H)2(O){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.6383	0.640	12	119.2282	1.595	334	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|I<2>}	C[6](C[6]C[6]H)2(O){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.5930	0.421	2	119.2282	1.595	334	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)2(O){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	124.7660	0.000	1	119.2282	1.595	334	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)2(O){1|C<3>,1|H<1>,1|S<2>}	H(C[6]C[6]2)	117.0470	0.000	1	119.2282	1.595	334	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)2(O){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.0950	0.000	1	119.2282	1.595	334	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)2(O){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.6110	0.000	1	119.2282	1.595	334	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(O){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.2101	0.395	63	119.2282	1.595	334	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(O){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.6530	0.061	3	119.2282	1.595	334	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(O){1|C<3>,1|H<1>,1|I<1>}	H(C[6]C[6]2)	119.5730	0.288	2	119.2282	1.595	334	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(O){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7660	0.000	1	119.2282	1.595	334	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(O){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.1301	1.154	117	119.2282	1.595	334	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(O){1|Cl<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9930	0.000	1	119.2282	1.595	334	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(O){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.7450	0.153	3	119.2282	1.595	334	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(O){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.3600	0.998	2	119.2282	1.595	334	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|S<2>}	C[6](C[6]C[6]H)2(O){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.2500	0.127	4	119.2282	1.595	334	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|S<4>}	C[6](C[6]C[6]H)2(O){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.2451	0.175	20	119.2282	1.595	334	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(O){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2520	0.290	4	119.2282	1.595	334	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(O){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.6069	0.488	8	119.2282	1.595	334	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<4>,1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(O){1|C<4>,2|H<1>}	H(C[6]C[6]2)	120.6500	0.716	2	119.2282	1.595	334	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Cl<1>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(O){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.1405	0.276	2	119.2282	1.595	334	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Cl<1>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(O){1|Cl<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6260	2.000	2	119.2282	1.595	334	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(O){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.7660	0.000	1	119.2282	1.595	334	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(O){1|C<3>,2|H<1>}	H(C[6]C[6]2)	118.7856	2.469	45	119.2282	1.595	334	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]N[5])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]N[5])(C[6]C[6]H)(O){2|H<1>,3|C<3>}	H(C[6]C[6]2)	118.7710	0.000	1	118.7710	0.000	1	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]Se)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Se<2>,3|C<3>}	C[6](C[6]C[6]Se)(C[6]C[6]H)(O){1|C<4>,2|H<1>}	H(C[6]C[6]2)	118.8090	0.000	1	118.8090	0.000	1	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(O){2|H<1>,3|C<3>}	H(C[6]C[6]2)	118.4560	0.000	1	118.9463	0.087	6	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(O){2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.1073	0.201	3	118.9463	0.087	6	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|O<1>,2|C<3>}	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(O){2|H<1>,3|C<3>}	H(C[6]C[6]2)	118.9500	0.188	2	118.9463	0.087	6	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]N[5a]C[6])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[5a]C[6])(C[6]C[6]H)(O){1|N<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	118.7440	0.000	1	118.7440	0.000	1	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]N[6]Br)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Br<1>,1|H<1>,1|N<2>}	C[6](C[6]N[6]Br)(C[6]C[6]H)(O){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.7420	0.000	1	119.7420	0.000	1	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]I)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(O)	H(C[6]C[6]2)	C[6](C[6]C[6]I)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(O){1|C<3>,1|H<1>,1|I<1>}	H(C[6]C[6]2)	119.5275	0.216	2	119.5275	0.047	2	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]C[6]O)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|N<2>}	C[6](C[6]C[6]C)(C[6]C[6]H)(O){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	118.7370	0.000	1	118.3784	0.977	9	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]C[6]O)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|O<1>}	C[6](C[6]C[6]C)(C[6]C[6]H)(O){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	118.8690	0.104	3	118.3784	0.977	9	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]C[6]O)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]C[6]O)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(O){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	118.4990	0.000	1	118.3784	0.977	9	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]C[6]O)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]C[6]O)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(O){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	117.8907	1.412	4	118.3784	0.977	9	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]C[6]N)(O){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.0290	0.000	1	118.7927	0.365	11	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(O){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	118.9310	0.000	1	118.7927	0.365	11	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]C[6]O)(H){1|C<3>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(O){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	118.9590	0.000	1	118.7927	0.365	11	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]C[6]O)(H){1|C<3>,1|N<3>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]N)(O){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	118.7251	0.708	8	118.7927	0.365	11	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(O)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)2(O){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.2710	0.000	1	119.7561	1.147	7	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(O)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(O){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	119.2090	0.000	1	119.7561	1.147	7	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(O)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(O){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.4110	0.000	1	119.7561	1.147	7	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(O)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]C[6]O)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(O){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.6005	1.165	4	119.7561	1.147	7	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]N[5])(C[6]C[6]O)(H)	C[6](C[6]C[6]N[5])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]C[6]O)(H){1|C<3>,1|N<3>,1|O<1>,2|C<4>}	C[6](C[6]C[6]N[5])(C[6]C[6]H)(O){1|C<3>,1|H<1>,1|N<3>,2|C<4>}	H(C[6]C[6]2)	118.5030	0.000	1	118.5030	0.000	1	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]O)(C[6]C[6]S)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]C[6]S)(H){1|C<3>,1|O<1>,1|S<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(O){1|C<3>,1|H<1>,1|S<2>}	H(C[6]C[6]2)	118.9385	0.293	4	118.9385	0.086	4	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]O)(C[6]C[6]S)(H)	C[6](C[6]C[6]H)(C[6]C[6]S)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]C[6]S)(H){1|C<3>,1|O<1>,1|S<2>}	C[6](C[6]C[6]H)(C[6]C[6]S)(O){1|C<3>,1|H<1>,1|S<2>}	H(C[6]C[6]2)	119.2630	0.000	1	119.2630	0.000	1	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]O)(C[6]C[6]S)(H)	C[6](C[6]C[6]H)2(O)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]C[6]S)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)2(O){1|C<3>,1|H<1>,1|S<2>}	H(C[6]C[6]2)	112.8180	0.000	1	112.8180	0.000	1	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(O)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]C)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(O){1|N<2>,2|C<3>}	H(C[6]C[6]2)	119.8555	0.104	2	119.8555	0.011	2	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](C[6]C[5]C[6])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){3|C<3>}	C[6](C[6]C[5]C[6])(C[6]C[6]H)(O){1|H<1>,1|N<3>,1|O<1>,2|S<2>}	H(C[6]C[6]2)	119.2770	0.000	1	119.2770	0.000	1	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]O)(C[6]O[6]C)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]O[6]C)(H){2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(O){1|C<4>,1|O<1>,1|O<2>}	H(C[6]C[6]2)	119.0319	0.473	12	119.0319	0.223	12	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]O)(C[6]O[6]C)(H)	C[6](C[6]C[6]H)2(O)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]O[6]C)(H){1|Ca<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(O){1|O<3>,2|C<3>}	H(C[6]C[6]2)	119.9735	0.039	2	119.9735	0.002	2	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]O)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]O)2(H){1|C<2>,2|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(O){1|C<3>,1|O<2>}	H(C[6]C[6]2)	117.5010	0.000	1	119.2915	5.789	34	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]O)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]O)2(H){1|C<3>,1|C<4>,1|O<1>}	C[6](C[6]C[6]C)(C[6]C[6]H)(O){1|C<3>,1|C<4>,1|O<2>}	H(C[6]C[6]2)	119.6505	0.060	2	119.2915	5.789	34	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]O)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]O)2(H){1|C<3>,1|C<4>,1|O<1>}	C[6](C[6]C[6]C)(C[6]C[6]H)(O){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.2350	0.000	1	119.2915	5.789	34	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]O)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]O)2(H){1|C<3>,2|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(O){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	119.9235	1.340	2	119.2915	5.789	34	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]O)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]O)2(H){1|C<3>,2|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(O){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	118.0825	5.258	6	119.2915	5.789	34	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]O)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]O)2(H){1|C<4>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(O){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	124.9540	0.000	1	119.2915	5.789	34	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]O)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]O)2(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(O){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.4684	0.224	20	119.2915	5.789	34	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]O)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]O)2(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(O){1|C<3>,2|O<2>}	H(C[6]C[6]2)	117.2090	0.000	1	119.2915	5.789	34	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]O)2(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]O)2(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]C[6]N)(O){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	116.7486	6.499	5	118.3848	4.558	43	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]O)2(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]O)2(H){1|C<3>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(O){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	118.6158	0.087	4	118.3848	4.558	43	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]O)2(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]O)2(H){1|C<3>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(O){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.0230	0.000	1	118.3848	4.558	43	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]O)2(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]O)2(H){1|C<3>,2|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(O){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	118.5842	0.140	24	118.3848	4.558	43	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]O)2(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]O)2(H){1|C<3>,2|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(O){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	118.5886	0.915	9	118.3848	4.558	43	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]O)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]O)2(H){1|C<3>,1|C<4>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(O){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.4420	0.570	3	119.3929	0.360	15	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]O)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]O)2(H){1|C<3>,1|O<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(O){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.3806	0.631	12	119.3929	0.360	15	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]O)2(H)	C[6](C[6]C[6]H)2(O)	H(C[6]C[6]2)	C[6](C[6]C[6]O)2(H){1|C<3>,1|C<4>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(O){1|C<4>,2|O<2>}	H(C[6]C[6]2)	119.0240	0.229	2	119.4613	1.563	9	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]O)2(H)	C[6](C[6]C[6]H)2(O)	H(C[6]C[6]2)	C[6](C[6]C[6]O)2(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(O){1|C<3>,2|O<2>}	H(C[6]C[6]2)	120.6723	0.426	3	119.4613	1.563	9	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]O)2(H)	C[6](C[6]C[6]H)2(O)	H(C[6]C[6]2)	C[6](C[6]C[6]O)2(H){1|C<4>,3|H<1>}	C[6](C[6]C[6]H)2(O){1|C<4>,1|O<2>,2|H<1>}	H(C[6]C[6]2)	116.7960	0.000	1	119.4613	1.563	9	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]O)2(H)	C[6](C[6]C[6]H)2(O)	H(C[6]C[6]2)	C[6](C[6]C[6]O)2(H){1|H<1>,1|O<2>,2|C<3>}	C[6](C[6]C[6]H)2(O){1|C<4>,2|O<2>}	H(C[6]C[6]2)	119.2660	0.197	2	119.4613	1.563	9	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]O)2(H)	C[6](C[6]C[6]H)2(O)	H(C[6]C[6]2)	C[6](C[6]C[6]O)2(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(O){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.7590	0.000	1	119.4613	1.563	9	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]O)2(H)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]O)2(H){1|O<1>,2|C<3>}	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(O){1|H<1>,1|O<2>,3|C<3>}	H(C[6]C[6]2)	114.7620	0.000	1	114.7620	0.000	1	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]Si)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(O)	H(C[6]C[6]2)	C[6](C[6]C[6]Si)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(O){2|Si<4>,1|C<3>}	H(C[6]C[6]2)	118.6585	0.275	8	118.6585	0.076	8	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]O)(H)	C[6](C[6]C[6]Br)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]O)(H){1|Br<1>,1|O<1>,3|C<3>}	C[6](C[6]C[6]Br)(C[6]C[6]H)(O){1|H<1>,2|C<3>}	H(C[6]C[6]2)	118.4870	0.000	1	118.4870	0.000	1	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]O)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]O)(H){1|C<2>,1|O<1>,3|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(O){1|C<2>,2|C<3>}	H(C[6]C[6]2)	118.4540	0.000	1	118.8057	0.093	3	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]O)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]O)(H){1|C<4>,2|H<1>,3|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(O){1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	118.9815	0.032	2	118.8057	0.093	3	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(O)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]O)(H){1|O<1>,1|O<2>,3|C<3>}	C[6](C[6]C[6]H)(C[6]C[6]O)(O){1|H<1>,2|C<3>}	H(C[6]C[6]2)	116.1400	0.000	1	116.1400	0.000	1	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(O)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]O)(H){1|H<1>,1|O<1>,3|C<3>}	C[6](C[6]C[6]H)2(O){1|H<1>,2|C<3>}	H(C[6]C[6]2)	118.6720	0.214	2	118.6720	0.046	2	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]N[5a]C[6])(C[6]C[6]O)(H)	C[6](C[6]C[6]N[5])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]N[5a]C[6])(C[6]C[6]O)(H){1|N<2>,1|N<3>,1|O<1>,2|C<3>}	C[6](C[6]C[6]N[5])(C[6]C[6]H)(O){1|Ru<6>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	119.0790	0.136	2	119.0790	0.018	2	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]N[5a]C[6])(C[6]C[6]O)(H)	C[6](C[6]N[5a]C[6])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]N[5a]C[6])(C[6]C[6]O)(H){1|N<2>,1|N<3>,1|O<1>,2|C<3>}	C[6](C[6]N[5a]C[6])(C[6]C[6]H)(O){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	118.3860	0.000	1	118.3860	0.000	1	118.9386	1.974	1159	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-1:	C[6]-3:	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(S)	H(C[6]C[6]2)	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(S){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.6740	0.000	1	119.6740	0.000	1	119.4295	0.992	23	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-1:	C[6]-3:	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(S)	H(C[6]C[6]2)	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(S){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.0420	0.183	4	119.3048	1.684	13	119.4295	0.992	23	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-1:	C[6]-3:	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(S)	H(C[6]C[6]2)	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(S){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.4620	0.000	1	119.3048	1.684	13	119.4295	0.992	23	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-1:	C[6]-3:	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(S)	H(C[6]C[6]2)	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(S){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.4166	1.678	8	119.3048	1.684	13	119.4295	0.992	23	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-1:	C[6]-3:	C[6](C[6]C[6]S)(C[6]O[6]C)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(S)	H(C[6]C[6]2)	C[6](C[6]C[6]S)(C[6]O[6]C)(H){1|C<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(S){1|C<3>,1|C<4>,1|O<2>}	H(C[6]C[6]2)	119.8170	0.000	1	119.8170	0.000	1	119.4295	0.992	23	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-1:	C[6]-3:	C[6](C[6]C[6]S)(C[6]O[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(S)	H(C[6]C[6]2)	C[6](C[6]C[6]S)(C[6]O[6]H)(H){1|C<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(S){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.4435	0.103	2	119.6780	0.043	6	119.4295	0.992	23	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-1:	C[6]-3:	C[6](C[6]C[6]S)(C[6]O[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(S)	H(C[6]C[6]2)	C[6](C[6]C[6]S)(C[6]O[6]H)(H){1|C<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(S){1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.7952	0.115	4	119.6780	0.043	6	119.4295	0.992	23	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]S)(H)	C[6](C[6]C[6]H)2(S)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]S)(H){1|N<2>,2|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(S){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	118.6820	0.000	1	119.1785	0.493	2	119.4295	0.992	23	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]S)(H)	C[6](C[6]C[6]H)2(S)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]S)(H){1|N<2>,2|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(S){1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.6750	0.000	1	119.1785	0.493	2	119.4295	0.992	23	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:Br-1:	C[6]-3:	C[6](C[6]N[6]Br)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(Br)	H(C[6]C[6]2)	C[6](C[6]N[6]Br)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(Br){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.4953	0.807	3	120.4953	0.652	3	120.6316	1.254	30	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:Br-1:	C[6]-3:	C[6](C[6]N[6]Br)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(Br)	H(C[6]C[6]2)	C[6](C[6]N[6]Br)(C[6]C[6]H)(H){1|Br<1>,1|C<3>,1|C<4>}	C[6](C[6]C[6]H)(N[6]C[6]C)(Br){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.6277	0.548	3	119.9872	0.396	5	120.6316	1.254	30	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:Br-1:	C[6]-3:	C[6](C[6]N[6]Br)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(Br)	H(C[6]C[6]2)	C[6](C[6]N[6]Br)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]C)(Br){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4490	0.000	1	119.9872	0.396	5	120.6316	1.254	30	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:Br-1:	C[6]-3:	C[6](C[6]N[6]Br)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(Br)	H(C[6]C[6]2)	C[6](C[6]N[6]Br)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|I<1>}	C[6](C[6]C[6]H)(N[6]C[6]C)(Br){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6040	0.000	1	119.9872	0.396	5	120.6316	1.254	30	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:Br-1:	C[6]-3:	C[6](C[6]N[6]Br)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(Br)	H(C[6]C[6]2)	C[6](C[6]N[6]Br)(C[6]C[6]H)(H){1|Br<1>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(Br){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2840	0.000	1	120.7967	1.464	22	120.6316	1.254	30	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:Br-1:	C[6]-3:	C[6](C[6]N[6]Br)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(Br)	H(C[6]C[6]2)	C[6](C[6]N[6]Br)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(Br){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5000	0.000	1	120.7967	1.464	22	120.6316	1.254	30	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:Br-1:	C[6]-3:	C[6](C[6]N[6]Br)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(Br)	H(C[6]C[6]2)	C[6](C[6]N[6]Br)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(Br){1|Br<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1695	0.708	2	120.7967	1.464	22	120.6316	1.254	30	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:Br-1:	C[6]-3:	C[6](C[6]N[6]Br)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(Br)	H(C[6]C[6]2)	C[6](C[6]N[6]Br)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(Br){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.1180	0.586	6	120.7967	1.464	22	120.6316	1.254	30	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:Br-1:	C[6]-3:	C[6](C[6]N[6]Br)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(Br)	H(C[6]C[6]2)	C[6](C[6]N[6]Br)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(Br){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.8067	1.636	11	120.7967	1.464	22	120.6316	1.254	30	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:Br-1:	C[6]-3:	C[6](C[6]N[6]Br)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(Br)	H(C[6]C[6]2)	C[6](C[6]N[6]Br)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(Br){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.8220	0.000	1	120.7967	1.464	22	120.6316	1.254	30	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Ni)(C[6]N[6]Cl)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Ni)(C[6]N[6]Cl)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]C)(Cl){1|Ni<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1710	0.000	1	120.1710	0.000	1	120.6447	0.162	21	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Pd)(C[6]N[6]Cl)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Pd)(C[6]N[6]Cl)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]C)(Cl){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.4330	0.000	1	119.4330	0.000	1	120.6447	0.162	21	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:Cl-1:	C[6]-3:	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]B)(Cl)	H(C[6]C[6]2)	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H){1|B<3>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]B)(Cl){1|Cl<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5490	0.177	2	120.5490	0.031	2	120.6447	0.162	21	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:Cl-1:	C[6]-3:	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(Cl)	H(C[6]C[6]2)	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]C)(Cl){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6018	0.140	4	120.6018	0.020	4	120.6447	0.162	21	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:Cl-1:	C[6]-3:	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(Cl)	H(C[6]C[6]2)	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(Cl){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.4090	0.000	1	120.7815	0.109	10	120.6447	0.162	21	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:Cl-1:	C[6]-3:	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(Cl)	H(C[6]C[6]2)	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(Cl){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	121.2310	0.000	1	120.7815	0.109	10	120.6447	0.162	21	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:Cl-1:	C[6]-3:	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(Cl)	H(C[6]C[6]2)	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(Cl){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6469	0.187	8	120.7815	0.109	10	120.6447	0.162	21	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:Cl-1:	C[6]-3:	C[6](C[6]N[6]Cl)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(Cl)	H(C[6]C[6]2)	C[6](C[6]N[6]Cl)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(N[6]C[6]O)(Cl){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6410	0.000	1	120.8717	0.051	3	120.6447	0.162	21	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:Cl-1:	C[6]-3:	C[6](C[6]N[6]Cl)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(Cl)	H(C[6]C[6]2)	C[6](C[6]N[6]Cl)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(N[6]C[6]O)(Cl){1|Cl<1>,1|C<3>,1|N<3>}	H(C[6]C[6]2)	120.9870	0.147	2	120.8717	0.051	3	120.6447	0.162	21	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:F-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]F)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(F)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]F)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]C)(F){1|C<3>,2|H<1>}	H(C[6]C[6]2)	121.5115	0.101	2	121.5115	0.010	2	121.5115	0.010	2	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]B[6,6]C[6])(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]B[6,6]C[6])(C[6]N[6]H)(H){1|C<3>,1|O<2>,2|H<1>,2|N<3>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.3380	0.544	2	119.3380	0.296	2	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[3,5]C[6])(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[3,5]C[6])(C[6]N[6]H)(H){1|H<1>,1|O<1>,2|C<3>,2|C<4>}	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.6980	0.190	2	119.6980	0.036	2	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[4]C[6])(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[4]C[6])(C[6]N[6]H)(H){1|C<3>,2|H<1>,3|C<4>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	118.1025	1.705	2	118.1025	2.906	2	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[4]C[6])(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[4]C[6])(C[6]N[6]H)(H){1|C<3>,2|C<4>,3|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.9601	0.379	20	119.9601	0.144	20	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>,2|N<2>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.0627	0.192	30	120.0313	0.122	39	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.1500	0.586	6	120.0313	0.122	39	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H){1|H<1>,1|O<2>,3|C<3>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.1085	0.009	2	120.0313	0.122	39	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|C<4>,2|N<3>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.2230	0.000	1	120.0313	0.122	39	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H){1|C<3>,1|N<2>,1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.2275	0.091	2	120.1115	0.128	36	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H){1|C<3>,2|H<1>,2|N<2>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.9410	0.301	2	120.1115	0.128	36	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H){1|C<3>,2|H<1>,2|N<3>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3233	0.337	13	120.1115	0.128	36	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H){1|Fe<10>,1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.8502	0.067	6	120.1115	0.128	36	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H){1|S<2>,2|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.0152	0.475	6	120.1115	0.128	36	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H){2|H<1>,3|C<3>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.0401	0.339	7	120.1115	0.128	36	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<1>,2|N<3>}	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	117.7940	0.721	2	117.7940	0.520	2	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]S)(H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|S<4>,3|C<4>}	C[6](C[6]C[6]H)(N[6]C[6]S)(H){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	117.4570	0.245	2	117.4570	0.060	2	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.0362	0.302	4	119.6458	0.459	6	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|N<2>,1|S<2>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	118.8650	0.438	2	119.6458	0.459	6	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H){1|C<3>,1|N<2>,1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.2293	0.277	30	120.3080	0.134	97	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H){1|C<3>,1|N<2>,1|O<2>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.6011	0.457	23	120.3080	0.134	97	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H){1|C<3>,1|N<2>,1|S<2>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3265	0.186	6	120.3080	0.134	97	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H){1|C<3>,2|H<1>,2|N<2>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3948	0.226	12	120.3080	0.134	97	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H){1|N<2>,2|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.1304	0.248	10	120.3080	0.134	97	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.1257	0.288	12	120.3080	0.134	97	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H){1|S<2>,2|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.9155	0.322	4	120.3080	0.134	97	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|N<2>,1|O<1>,1|O<2>}	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.8956	0.347	32	119.8643	0.115	41	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<1>,2|N<2>}	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.8757	0.173	7	119.8643	0.115	41	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H){1|H<1>,1|N<3>,1|O<1>,2|C<3>}	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.3240	0.253	2	119.8643	0.115	41	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]2)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|H<1>,4|C<3>}	C[6](C[6]C[6]H)(N[6]C[6]2)(H){1|H<1>,4|C<3>}	H(C[6]C[6]2)	119.8170	0.072	4	119.8170	0.005	4	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]B)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|B<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)(N[6]C[6]B)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.7075	0.227	2	119.7075	0.052	2	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|C<2>,1|C<4>,2|C<3>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<2>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	117.8120	0.000	1	119.6883	0.600	699	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|C<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.6859	0.771	694	119.6883	0.600	699	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|Ir<6>,1|C<4>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5830	0.135	4	119.6883	0.600	699	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|C<2>,1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<2>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.6970	0.164	2	119.9118	0.787	528	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|C<2>,2|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.9185	0.598	2	119.9118	0.787	528	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|H<1>,3|C<3>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<2>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	118.5260	0.000	1	119.9118	0.787	528	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|H<1>,4|C<3>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.0515	0.281	2	119.9118	0.787	528	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3098	0.209	4	119.9118	0.787	528	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){2|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.4960	0.000	1	119.9118	0.787	528	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){2|H<1>,3|C<3>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.9125	0.894	516	119.9118	0.787	528	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|H<1>,1|O<1>,3|C<3>}	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	118.8705	1.313	171	118.9383	1.557	212	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|H<1>,1|O<2>,3|C<3>}	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.1764	0.889	37	118.9383	1.557	212	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|O<1>,2|H<1>,3|C<3>}	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.6362	0.789	4	118.9383	1.557	212	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]W)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|H<1>,1|W<6>,3|C<3>}	C[6](C[6]C[6]H)(N[6]C[6]W)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.1210	0.170	4	120.1210	0.029	4	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]B)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]B)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]B)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]B)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	118.8084	0.148	8	118.8084	0.022	8	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]B)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]B)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|B<3>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8222	0.532	35	119.8232	0.275	36	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]B)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]B)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|B<4>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	119.8570	0.000	1	119.8232	0.275	36	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|Br<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7233	0.419	46	120.7233	0.175	46	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]U)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|U<9>}	C[6](C[6]C[6]H)(N[6]C[6]U)(H){1|Br<1>,2|C<3>}	H(C[6]C[6]2)	121.1615	0.043	2	121.1615	0.002	2	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]B)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|B<3>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]B)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.6580	0.321	2	119.7933	0.135	42	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]B)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]B)(H){1|C<2>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2288	0.382	6	119.7933	0.135	42	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]B)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]B)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.6900	0.296	32	119.7933	0.135	42	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]B)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]B)(H){1|C<3>,1|C<5>,1|H<1>}	H(C[6]C[6]2)	120.2735	0.067	2	119.7933	0.135	42	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<2>,1|C<3>,1|C<4>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,1|C<4>,1|N<2>}	H(C[6]C[6]2)	120.2480	0.000	1	119.7453	0.784	576	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<2>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4524	0.939	72	119.7453	0.784	576	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.5991	0.835	128	119.7453	0.784	576	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.0580	0.000	1	119.7453	0.784	576	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,2|C<4>}	H(C[6]C[6]2)	119.2905	1.315	2	119.7453	0.784	576	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<4>,2|C<3>}	H(C[6]C[6]2)	119.9092	0.172	10	119.7453	0.784	576	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.6199	0.813	313	119.7453	0.784	576	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){3|C<3>}	H(C[6]C[6]2)	119.4250	0.000	1	119.7453	0.784	576	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|I<1>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<2>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9655	0.202	11	119.7453	0.784	576	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|O<2>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	118.9770	0.048	2	119.7453	0.784	576	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,2|C<4>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.4525	0.054	2	119.7453	0.784	576	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.9457	4.224	3	119.7453	0.784	576	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<2>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2665	0.693	6	119.7453	0.784	576	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.8330	0.102	10	119.7453	0.784	576	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3588	0.153	6	119.7453	0.784	576	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|U<12>,1|O<2>,2|C<4>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|U<12>,1|C<3>,1|C<4>,1|O<2>}	H(C[6]C[6]2)	119.2407	0.469	4	119.7453	0.784	576	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|U<14>,1|O<2>,2|C<4>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|U<14>,1|C<3>,1|C<4>,1|O<2>}	H(C[6]C[6]2)	119.6410	0.000	1	119.7453	0.784	576	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Yb<14>,1|O<2>,2|C<4>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|Yb<14>,1|C<3>,1|C<4>,1|O<2>}	H(C[6]C[6]2)	119.5303	0.062	3	119.7453	0.784	576	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]D)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|D<1>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]D)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.9790	0.037	2	118.5798	1.255	6	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]D)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|D<1>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]D)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	117.8803	0.366	4	118.5798	1.255	6	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Br<1>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.8800	0.000	1	119.9964	0.747	1150	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<2>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<2>,1|C<3>}	H(C[6]C[6]2)	118.7940	0.000	1	119.9964	0.747	1150	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<2>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|C<4>}	H(C[6]C[6]2)	111.4110	0.000	1	119.9964	0.747	1150	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.3693	1.252	23	119.9964	0.747	1150	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	119.9243	0.291	3	119.9964	0.747	1150	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|S<4>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.6235	0.070	2	119.9964	0.747	1150	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|Br<1>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	120.1767	1.509	3	119.9964	0.747	1150	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<2>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.9245	0.786	31	119.9964	0.747	1150	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.8583	0.871	420	119.9964	0.747	1150	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<2>}	H(C[6]C[6]2)	119.9370	2.322	3	119.9964	0.747	1150	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.3927	0.971	45	119.9964	0.747	1150	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<2>}	H(C[6]C[6]2)	119.3420	1.080	3	119.9964	0.747	1150	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|C<4>,1|P<4>}	H(C[6]C[6]2)	120.3140	0.170	2	119.9964	0.747	1150	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,2|C<4>}	H(C[6]C[6]2)	119.3092	1.411	15	119.9964	0.747	1150	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<4>,2|C<3>}	H(C[6]C[6]2)	119.7661	0.759	15	119.9964	0.747	1150	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.0905	0.648	576	119.9964	0.747	1150	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|P<4>,2|C<3>}	H(C[6]C[6]2)	120.7470	0.000	1	119.9964	0.747	1150	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){3|C<3>}	H(C[6]C[6]2)	120.9800	0.000	1	119.9964	0.747	1150	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	118.8495	0.943	4	119.9964	0.747	1150	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]I)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|I<1>}	C[6](C[6]C[6]H)(N[6]C[6]I)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.9125	0.209	2	119.9125	0.044	2	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(N[6]C[6]N)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.3665	0.132	2	119.4903	0.030	4	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(N[6]C[6]N)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.6140	0.110	2	119.4903	0.030	4	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|C<2>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.5863	2.209	4	119.3337	0.769	160	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.2819	0.749	45	119.3337	0.769	160	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|C<4>,2|C<3>}	H(C[6]C[6]2)	119.4200	0.815	2	119.3337	0.769	160	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.3188	0.940	92	119.3337	0.769	160	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(N[6]C[6]O)(H){3|C<3>}	H(C[6]C[6]2)	120.1490	0.000	1	119.3337	0.769	160	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.3930	0.222	11	119.3337	0.769	160	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<3>}	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.4265	0.248	2	119.3337	0.769	160	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<3>}	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.6230	0.100	3	119.3337	0.769	160	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]S)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|S<4>}	C[6](C[6]C[6]H)(N[6]C[6]S)(H){1|C<3>,1|C<4>,1|N<2>}	H(C[6]C[6]2)	118.3330	0.000	1	118.3330	0.000	1	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]V)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|V<11>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]V)(H){1|C<2>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5335	0.025	2	120.5335	0.001	2	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]W)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|W<6>}	C[6](C[6]C[6]H)(N[6]C[6]W)(H){1|C<2>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1383	0.278	6	119.9207	0.273	21	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]W)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|W<6>}	C[6](C[6]C[6]H)(N[6]C[6]W)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.0182	0.936	4	119.9207	0.273	21	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]W)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|W<6>}	C[6](C[6]C[6]H)(N[6]C[6]W)(H){1|C<4>,2|C<3>}	H(C[6]C[6]2)	119.7918	0.392	4	119.9207	0.273	21	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]W)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|W<6>}	C[6](C[6]C[6]H)(N[6]C[6]W)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.7520	0.483	7	119.9207	0.273	21	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]Y)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Y<15>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]Y)(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.3990	0.000	1	120.3990	0.000	1	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|N<2>,2|H<1>}	C[6](C[6]C[6]H)(N[6]N[6]H)(H){2|C<3>}	H(C[6]C[6]2)	121.4150	0.000	1	121.4150	0.000	1	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|S<4>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|Cl<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6890	0.000	1	120.9281	0.076	131	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|Cl<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.9300	0.276	130	120.9281	0.076	131	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]2)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]2)(H){1|B<6>,1|C<3>,1|C<4>,3|H<1>}	H(C[6]C[6]2)	120.3870	0.327	2	120.1313	0.127	10	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]2)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]2)(H){1|C<4>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	119.7355	0.592	2	120.1313	0.127	10	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]2)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6]H)(N[6]C[6]2)(H){2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.9470	0.000	1	120.1313	0.127	10	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]2)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(N[6]C[6]2)(H){1|H<1>,1|N<3>,1|O<2>,2|C<3>}	H(C[6]C[6]2)	120.2910	0.228	3	120.1313	0.127	10	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]2)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(N[6]C[6]2)(H){2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.1240	0.177	2	120.1313	0.127	10	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]B)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<3>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]B)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6705	0.032	2	120.2672	1.393	163	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]B)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<3>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]B)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3802	0.661	12	120.2672	1.393	163	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]B)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<3>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]B)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.0070	0.000	1	120.2672	1.393	163	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]B)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]B)(H){2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0000	0.000	1	120.2672	1.393	163	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]B)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<4>,1|C<2>,1|C<3>}	C[6](C[6]C[6]H)(N[6]C[6]B)(H){1|C<2>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5535	0.129	2	120.2672	1.393	163	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]B)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]B)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.6647	0.083	6	120.2672	1.393	163	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]B)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]B)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7245	0.114	2	120.2672	1.393	163	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]B)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]B)(H){1|C<3>,1|H<1>,1|S<2>}	H(C[6]C[6]2)	120.5531	0.188	8	120.2672	1.393	163	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]B)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]B)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1220	1.427	94	120.2672	1.393	163	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]B)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]B)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.6485	0.221	6	120.2672	1.393	163	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]B)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]B)(H){1|Ru<9>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6150	0.000	1	120.2672	1.393	163	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]B)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|N<3>}	C[6](C[6]C[6]H)(N[6]C[6]B)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2012	0.126	18	120.2672	1.393	163	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]B)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]B)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.6830	0.279	3	120.2672	1.393	163	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]B)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]B)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.6330	1.628	4	120.2672	1.393	163	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]B)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,2|B<4>}	C[6](C[6]C[6]H)(N[6]C[6]B)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.2705	2.582	2	120.2672	1.393	163	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]B)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cl<1>,1|B<3>,1|C<3>}	C[6](C[6]C[6]H)(N[6]C[6]B)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9460	0.000	1	120.2672	1.393	163	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<3>,1|C<3>,1|C<4>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4360	0.000	1	120.0852	1.838	993	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Br<1>,1|C<3>,1|C<4>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9355	0.302	15	120.0852	1.838	993	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<2>,1|C<3>,1|C<4>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0875	0.191	8	120.0852	1.838	993	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<2>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	114.1210	0.000	1	120.0852	1.838	993	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|F<1>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8260	0.000	1	120.0852	1.838	993	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|Br<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2280	0.000	1	120.0852	1.838	993	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<2>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1539	0.205	8	120.0852	1.838	993	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.6537	0.691	29	120.0852	1.838	993	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.9550	0.000	1	120.0852	1.838	993	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,1|F<1>,1|H<1>}	H(C[6]C[6]2)	120.2150	0.013	2	120.0852	1.838	993	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.8739	0.684	12	120.0852	1.838	993	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5060	0.578	25	120.0852	1.838	993	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.6107	0.144	4	120.0852	1.838	993	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,1|H<1>,1|P<4>}	H(C[6]C[6]2)	120.3800	0.113	2	120.0852	1.838	993	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,1|H<1>,1|P<5>}	H(C[6]C[6]2)	120.4960	0.000	1	120.0852	1.838	993	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,1|H<1>,1|S<2>}	H(C[6]C[6]2)	120.5387	0.175	4	120.0852	1.838	993	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0492	1.315	639	120.0852	1.838	993	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|Cl<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1330	0.277	4	120.0852	1.838	993	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.4387	2.009	46	120.0852	1.838	993	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|Ir<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.8710	0.000	1	120.0852	1.838	993	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|Ru<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.0545	0.042	2	120.0852	1.838	993	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0390	0.000	1	120.0852	1.838	993	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|I<1>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9392	0.318	24	120.0852	1.838	993	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|N<2>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.5973	0.258	3	120.0852	1.838	993	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9015	0.279	28	120.0852	1.838	993	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|O<2>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.7975	0.346	2	120.0852	1.838	993	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|O<2>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,1|H<1>,1|S<2>}	H(C[6]C[6]2)	119.6130	0.641	4	120.0852	1.838	993	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|O<2>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.6628	0.587	11	120.0852	1.838	993	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<2>,2|H<1>}	H(C[6]C[6]2)	122.1063	4.269	4	120.0852	1.838	993	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<5>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5170	0.713	4	120.0852	1.838	993	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,2|C<4>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.2980	0.000	1	120.0852	1.838	993	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,2|C<4>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0166	0.910	20	120.0852	1.838	993	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,2|C<4>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|Ir<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.8530	0.000	1	120.0852	1.838	993	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9795	1.160	42	120.0852	1.838	993	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0110	0.000	1	120.0852	1.838	993	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|Pd<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7480	0.025	2	120.0852	1.838	993	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cl<1>,1|C<3>,1|C<4>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8397	0.428	3	120.0852	1.838	993	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|C<4>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.8790	0.000	1	120.0852	1.838	993	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|C<4>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	121.5440	0.000	1	120.0852	1.838	993	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.8410	0.618	2	120.0852	1.838	993	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,1|H<1>,1|S<1>}	H(C[6]C[6]2)	120.6960	0.000	1	120.0852	1.838	993	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,1|H<1>,1|S<2>}	H(C[6]C[6]2)	120.5140	0.000	1	120.0852	1.838	993	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	117.1727	4.250	10	120.0852	1.838	993	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.1080	0.000	1	120.0852	1.838	993	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|Ru<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	123.9320	0.000	1	120.0852	1.838	993	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|C<4>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3247	0.261	4	120.0852	1.838	993	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|C<4>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.0938	0.228	4	120.0852	1.838	993	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<4>,1|C<3>,1|C<4>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1710	0.000	1	120.0852	1.838	993	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|O<2>,2|C<3>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8560	0.000	1	120.0852	1.838	993	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|C<4>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8160	0.000	1	120.0852	1.838	993	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zr<16>,1|O<2>,2|C<4>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|Zr<16>,1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.5772	0.044	4	120.0852	1.838	993	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){2|C<3>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<2>,2|H<1>}	H(C[6]C[6]2)	123.3650	0.000	1	120.0852	1.838	993	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){3|C<3>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1640	0.000	1	120.0852	1.838	993	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]D)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|D<1>}	C[6](C[6]C[6]H)(N[6]C[6]D)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5560	0.000	1	120.4475	0.139	4	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]D)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|D<1>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]D)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.7540	0.000	1	120.4475	0.139	4	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]D)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|D<1>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]D)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2400	0.474	2	120.4475	0.139	4	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]F)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|F<1>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]F)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9055	0.950	2	119.9055	0.902	2	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|As<3>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6760	0.000	1	120.3831	1.056	1691	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<3>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5709	0.221	13	120.3831	1.056	1691	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5940	0.190	3	120.3831	1.056	1691	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Br<1>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6890	0.000	1	120.3831	1.056	1691	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Br<1>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2025	0.400	24	120.3831	1.056	1691	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.6263	0.751	13	120.3831	1.056	1691	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	119.6413	1.178	3	120.3831	1.056	1691	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8405	0.231	23	120.3831	1.056	1691	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2549	0.771	79	120.3831	1.056	1691	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.8470	0.066	2	120.3831	1.056	1691	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|I<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2922	0.225	18	120.3831	1.056	1691	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|N<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2845	0.697	4	120.3831	1.056	1691	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	121.0490	0.000	1	120.3831	1.056	1691	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7710	0.661	35	120.3831	1.056	1691	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7883	0.826	56	120.3831	1.056	1691	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|Cl<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8700	0.260	4	120.3831	1.056	1691	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|N<4>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5560	0.892	4	120.3831	1.056	1691	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|N<4>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0643	0.398	4	120.3831	1.056	1691	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.1600	0.000	1	120.3831	1.056	1691	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1064	0.460	5	120.3831	1.056	1691	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.8020	0.083	2	120.3831	1.056	1691	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8983	0.762	20	120.3831	1.056	1691	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.0447	0.342	3	120.3831	1.056	1691	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|P<4>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2450	0.000	1	120.3831	1.056	1691	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|P<4>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.6590	0.000	1	120.3831	1.056	1691	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	H(C[6]C[6]2)	119.3157	1.915	6	120.3831	1.056	1691	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3040	0.000	1	120.3831	1.056	1691	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|S<4>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3480	0.000	1	120.3831	1.056	1691	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<2>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	107.5440	0.000	1	120.3831	1.056	1691	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7130	0.177	5	120.3831	1.056	1691	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|Br<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4465	0.635	11	120.3831	1.056	1691	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<2>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5465	0.136	2	120.3831	1.056	1691	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.5517	0.715	146	120.3831	1.056	1691	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|C<5>,1|H<1>}	H(C[6]C[6]2)	122.4660	0.000	1	120.3831	1.056	1691	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|I<1>}	H(C[6]C[6]2)	120.7436	0.260	7	120.3831	1.056	1691	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.3716	1.594	20	120.3831	1.056	1691	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5293	0.877	208	120.3831	1.056	1691	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.6113	0.473	18	120.3831	1.056	1691	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<4>}	H(C[6]C[6]2)	120.6496	0.214	7	120.3831	1.056	1691	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<1>}	H(C[6]C[6]2)	121.7170	0.000	1	120.3831	1.056	1691	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	H(C[6]C[6]2)	120.8085	0.529	26	120.3831	1.056	1691	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<3>}	H(C[6]C[6]2)	120.0002	0.767	4	120.3831	1.056	1691	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3445	1.198	482	120.3831	1.056	1691	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|Cl<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3956	0.348	8	120.3831	1.056	1691	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3950	1.126	254	120.3831	1.056	1691	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.1480	0.000	1	120.3831	1.056	1691	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|Se<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6850	0.000	1	120.3831	1.056	1691	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cl<1>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0611	0.414	16	120.3831	1.056	1691	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7428	0.761	16	120.3831	1.056	1691	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	121.0338	0.141	5	120.3831	1.056	1691	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<4>}	H(C[6]C[6]2)	120.7435	0.187	2	120.3831	1.056	1691	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<1>}	H(C[6]C[6]2)	120.4040	0.000	1	120.3831	1.056	1691	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	H(C[6]C[6]2)	120.7103	0.470	3	120.3831	1.056	1691	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<4>}	H(C[6]C[6]2)	120.7120	0.000	2	120.3831	1.056	1691	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2296	0.745	111	120.3831	1.056	1691	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|Se<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.1820	0.000	1	120.3831	1.056	1691	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3480	0.000	1	120.3831	1.056	1691	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Si<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6930	0.000	1	120.3831	1.056	1691	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]I)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|I<1>}	C[6](C[6]C[6]H)(N[6]C[6]I)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2645	0.288	2	120.2774	0.281	42	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]I)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|I<2>}	C[6](C[6]C[6]H)(N[6]C[6]I)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2624	0.560	36	120.2774	0.281	42	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]I)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|I<3>}	C[6](C[6]C[6]H)(N[6]C[6]I)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.7110	0.157	2	120.2774	0.281	42	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]I)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|I<3>}	C[6](C[6]C[6]H)(N[6]C[6]I)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1260	0.020	2	120.2774	0.281	42	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|N<2>}	C[6](C[6]C[6]H)(N[6]C[6]N)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.4010	0.000	1	119.9059	0.705	53	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(N[6]C[6]N)(H){1|C<3>,1|H<1>,1|S<2>}	H(C[6]C[6]2)	120.1970	0.000	1	119.9059	0.705	53	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(N[6]C[6]N)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8933	0.859	49	119.9059	0.705	53	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(N[6]C[6]N)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.8590	0.000	1	119.9059	0.705	53	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(N[6]C[6]N)(H){1|C<3>,1|H<1>,1|S<2>}	H(C[6]C[6]2)	119.7830	0.000	1	119.9059	0.705	53	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Br<1>,1|C<3>,1|O<1>}	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	118.5955	1.026	4	119.9169	1.810	281	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|O<1>}	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8418	0.320	8	119.9169	1.810	281	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|O<1>}	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.1510	0.000	1	119.9169	1.810	281	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|O<2>}	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.6270	0.000	1	119.9169	1.810	281	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|O<3>}	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0610	0.198	2	119.9169	1.810	281	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.0285	0.878	38	119.9169	1.810	281	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|C<3>,1|H<1>,1|I<1>}	H(C[6]C[6]2)	119.9877	0.575	3	119.9169	1.810	281	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.1730	0.000	1	119.9169	1.810	281	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2149	0.320	16	119.9169	1.810	281	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|C<3>,1|H<1>,1|S<2>}	H(C[6]C[6]2)	120.1264	0.494	21	119.9169	1.810	281	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.5416	1.681	39	119.9169	1.810	281	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.0444	1.552	23	119.9169	1.810	281	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|Se<2>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.4980	0.000	1	119.9169	1.810	281	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5294	0.215	8	119.9169	1.810	281	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|C<3>,1|H<1>,1|P<4>}	H(C[6]C[6]2)	120.2560	0.000	1	119.9169	1.810	281	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|C<3>,1|H<1>,1|S<1>}	H(C[6]C[6]2)	120.5190	0.000	1	119.9169	1.810	281	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|C<3>,1|H<1>,1|S<2>}	H(C[6]C[6]2)	121.2501	3.957	15	119.9169	1.810	281	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8769	0.582	42	119.9169	1.810	281	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.0771	0.328	24	119.9169	1.810	281	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|Rh<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5775	0.146	2	119.9169	1.810	281	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<3>}	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.4590	0.000	1	119.9169	1.810	281	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<3>}	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3345	0.354	2	119.9169	1.810	281	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|N<3>,1|O<1>}	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.5300	0.059	2	119.9169	1.810	281	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|N<3>,1|O<1>}	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.6567	0.843	3	119.9169	1.810	281	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|O<1>,1|O<2>}	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|Br<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.5860	0.000	1	119.9169	1.810	281	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|O<1>,1|O<2>}	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.9880	0.000	1	119.9169	1.810	281	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|O<1>,1|O<2>}	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|Cl<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8640	0.000	1	119.9169	1.810	281	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,2|O<2>}	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7040	0.000	1	119.9169	1.810	281	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|O<1>,2|C<3>}	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7855	0.291	4	119.9169	1.810	281	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|O<2>,2|C<3>}	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7950	0.632	2	119.9169	1.810	281	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|O<1>}	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.9615	0.154	11	119.9169	1.810	281	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<6>,1|C<3>,1|O<1>}	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	118.4710	0.000	1	119.9169	1.810	281	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]P)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|P<4>}	C[6](C[6]C[6]H)(N[6]C[6]P)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4159	0.357	17	120.4159	0.128	17	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]U)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|U<8>}	C[6](C[6]C[6]H)(N[6]C[6]U)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3350	0.289	8	120.6575	0.502	14	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]U)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|U<11>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]U)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7320	0.000	1	120.6575	0.502	14	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]U)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|U<13>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]U)(H){1|C<3>,1|H<1>,1|S<2>}	H(C[6]C[6]2)	120.7378	0.322	4	120.6575	0.502	14	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]U)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|U<16>,1|C<3>,1|C<4>}	C[6](C[6]C[6]H)(N[6]C[6]U)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	122.8420	0.000	1	120.6575	0.502	14	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]V)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|V<5>}	C[6](C[6]C[6]H)(N[6]C[6]V)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	117.7105	4.101	2	120.3735	1.008	85	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]V)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|V<5>}	C[6](C[6]C[6]H)(N[6]C[6]V)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5184	0.161	10	120.3735	1.008	85	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]V)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|V<5>}	C[6](C[6]C[6]H)(N[6]C[6]V)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.2665	2.198	4	120.3735	1.008	85	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]V)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|V<6>}	C[6](C[6]C[6]H)(N[6]C[6]V)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.0576	1.569	14	120.3735	1.008	85	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]V)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|V<6>}	C[6](C[6]C[6]H)(N[6]C[6]V)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4907	0.175	15	120.3735	1.008	85	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]V)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|V<6>}	C[6](C[6]C[6]H)(N[6]C[6]V)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5060	0.317	22	120.3735	1.008	85	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]V)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|V<7>}	C[6](C[6]C[6]H)(N[6]C[6]V)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.6387	0.113	6	120.3735	1.008	85	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]V)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|V<7>}	C[6](C[6]C[6]H)(N[6]C[6]V)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.6208	0.284	4	120.3735	1.008	85	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]V)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|V<8>}	C[6](C[6]C[6]H)(N[6]C[6]V)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.6792	0.365	4	120.3735	1.008	85	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]V)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|V<11>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]V)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4373	0.365	4	120.3735	1.008	85	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]W)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|W<6>}	C[6](C[6]C[6]H)(N[6]C[6]W)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1090	0.000	1	120.5334	0.372	62	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]W)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|W<6>}	C[6](C[6]C[6]H)(N[6]C[6]W)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8130	0.000	1	120.5334	0.372	62	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]W)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|W<6>}	C[6](C[6]C[6]H)(N[6]C[6]W)(H){1|C<3>,1|H<1>,1|P<3>}	H(C[6]C[6]2)	120.7945	0.011	2	120.5334	0.372	62	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]W)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|W<6>}	C[6](C[6]C[6]H)(N[6]C[6]W)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5976	0.571	19	120.5334	0.372	62	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]W)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|W<6>}	C[6](C[6]C[6]H)(N[6]C[6]W)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5296	0.248	11	120.5334	0.372	62	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]W)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|W<7>}	C[6](C[6]C[6]H)(N[6]C[6]W)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2692	1.487	6	120.5334	0.372	62	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]W)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|W<8>}	C[6](C[6]C[6]H)(N[6]C[6]W)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3868	0.151	6	120.5334	0.372	62	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]W)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|W<8>}	C[6](C[6]C[6]H)(N[6]C[6]W)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5525	0.255	2	120.5334	0.372	62	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]W)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|W<9>}	C[6](C[6]C[6]H)(N[6]C[6]W)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.4720	0.000	1	120.5334	0.372	62	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]W)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|W<9>}	C[6](C[6]C[6]H)(N[6]C[6]W)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	121.3010	0.354	2	120.5334	0.372	62	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]W)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<4>,1|H<1>,1|W<7>}	C[6](C[6]C[6]H)(N[6]C[6]W)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8013	0.619	3	120.5334	0.372	62	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]W)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<4>,1|H<1>,1|W<8>}	C[6](C[6]C[6]H)(N[6]C[6]W)(H){1|C<3>,1|H<1>,1|S<2>}	H(C[6]C[6]2)	120.5000	0.327	4	120.5334	0.372	62	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]W)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<4>,1|H<1>,1|W<9>}	C[6](C[6]C[6]H)(N[6]C[6]W)(H){1|C<3>,1|H<1>,1|S<2>}	H(C[6]C[6]2)	120.6555	0.166	2	120.5334	0.372	62	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]W)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<4>,1|H<1>,1|W<9>}	C[6](C[6]C[6]H)(N[6]C[6]W)(H){1|Se<2>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.7735	0.377	2	120.5334	0.372	62	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]N[6]B)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(N[6]N[6]B)(H){1|B<3>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1810	0.000	1	120.1810	0.000	1	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|N<2>}	C[6](C[6]C[6]H)(N[6]N[6]C)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.0330	0.000	1	119.0330	0.000	1	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|N<2>,2|H<1>}	C[6](C[6]C[6]H)(N[6]N[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.4440	0.159	6	121.4440	0.025	6	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]N[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,1|N<3>,1|O<1>}	C[6](C[6]C[6]H)(N[6]N[6]O)(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	120.4065	0.026	2	120.4065	0.001	2	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]I)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]I)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|I<1>}	H(C[6]C[6]2)	120.6444	0.377	29	120.6444	0.142	29	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Ir)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Ir)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|Ir<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.0800	1.090	2	118.8490	8.198	6	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Ir)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Ir)(C[6]N[6]H)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|Ir<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	118.7335	3.635	4	118.8490	8.198	6	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]2)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]2)(H){1|C<3>,1|N<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.7220	0.066	2	119.7220	0.004	2	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]B)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|B<3>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]B)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7618	0.275	6	119.8421	0.027	40	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]B)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]B)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8562	0.138	34	119.8421	0.027	40	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	119.2686	0.566	12	119.7900	0.260	179	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8768	0.521	134	119.7900	0.260	179	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8840	0.000	1	119.7900	0.260	179	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|S<4>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.5650	0.133	2	119.7900	0.260	179	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,2|C<4>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.5277	0.210	3	119.7900	0.260	179	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.6338	0.223	27	119.7900	0.260	179	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]D)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|D<1>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]D)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8530	0.247	4	119.8530	0.061	4	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Br<1>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.1100	0.000	1	119.9870	0.440	598	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9280	0.000	1	119.9870	0.440	598	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9360	1.150	8	119.9870	0.440	598	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|N<4>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7402	0.170	5	119.9870	0.440	598	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	118.4270	0.000	1	119.9870	0.440	598	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|S<4>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.6532	0.089	4	119.9870	0.440	598	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<1>}	H(C[6]C[6]2)	120.0060	0.000	1	119.9870	0.440	598	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	119.9360	0.651	31	119.9870	0.440	598	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0028	0.660	541	119.9870	0.440	598	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Cl<1>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.0300	0.000	1	119.9870	0.440	598	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8450	0.103	4	119.9870	0.440	598	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]I)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|I<1>}	C[6](C[6]C[6]H)(N[6]C[6]I)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8443	0.168	4	119.8665	0.029	6	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]I)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|I<3>}	C[6](C[6]C[6]H)(N[6]C[6]I)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9110	0.231	2	119.8665	0.029	6	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|O<1>}	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9510	0.553	30	120.2168	2.054	89	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	121.3270	0.000	1	120.2168	2.054	89	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.7357	3.251	12	120.2168	2.054	89	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0875	1.300	25	120.2168	2.054	89	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|C<3>,1|I<1>,1|N<3>}	H(C[6]C[6]2)	120.4850	0.000	2	120.2168	2.054	89	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|C<3>,2|N<3>}	H(C[6]C[6]2)	121.3490	0.000	1	120.2168	2.054	89	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|Cl<1>,1|C<3>,1|N<3>}	H(C[6]C[6]2)	120.6250	0.000	1	120.2168	2.054	89	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.8520	0.059	2	120.2168	2.054	89	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2049	0.632	14	120.2168	2.054	89	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.9100	0.000	1	120.2168	2.054	89	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]P)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|P<3>}	C[6](C[6]C[6]H)(N[6]C[6]P)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.4700	0.750	11	119.6094	0.208	35	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]P)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|P<4>}	C[6](C[6]C[6]H)(N[6]C[6]P)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.6732	0.221	24	119.6094	0.208	35	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]S)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	C[6](C[6]C[6]H)(N[6]C[6]S)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.4890	0.088	2	119.5987	0.027	4	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]S)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|S<4>}	C[6](C[6]C[6]H)(N[6]C[6]S)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7085	0.155	2	119.5987	0.027	4	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]V)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|V<11>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]V)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	119.5570	0.313	2	119.5570	0.098	2	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]W)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|W<5>}	C[6](C[6]C[6]H)(N[6]C[6]W)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8187	0.384	6	119.8871	0.088	14	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]W)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|W<9>}	C[6](C[6]C[6]H)(N[6]C[6]W)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9385	0.224	8	119.8871	0.088	14	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[5])(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]N[6]H)(H){1|Rh<6>,1|C<4>,3|C<3>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.7480	0.000	1	120.5250	2.991	2	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[5])(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]N[6]H)(H){2|C<3>,3|C<4>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.3020	0.000	1	120.5250	2.991	2	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[5])(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]N[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7275	0.359	2	119.7275	0.129	2	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H){1|C<3>,1|H<1>,3|C<4>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7675	0.116	4	119.7675	0.013	4	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	118.7730	1.191	8	119.0028	1.715	9	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H){1|C<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8410	0.000	1	119.0028	1.715	9	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Ni)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Ni)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|Cl<1>,1|Ni<4>,1|C<3>}	H(C[6]C[6]2)	119.4110	0.000	1	119.4110	0.000	1	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.8530	0.483	4	119.7101	0.610	13	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|O<2>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,1|C<4>,1|O<2>}	H(C[6]C[6]2)	119.8955	1.366	4	119.7101	0.610	13	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|C<3>,1|C<4>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<2>,1|C<4>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	119.2400	0.188	2	119.7101	0.610	13	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.1740	0.000	1	119.7101	0.610	13	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){2|C<4>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,1|O<1>,2|C<4>}	H(C[6]C[6]2)	119.6770	0.000	1	119.7101	0.610	13	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){2|C<4>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|H<1>,1|O<1>,2|C<4>}	H(C[6]C[6]2)	119.9060	0.000	1	119.7101	0.610	13	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.4200	0.214	2	120.6312	0.411	52	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|S<4>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	118.9760	0.000	1	120.6312	0.411	52	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.6628	0.630	46	120.6312	0.411	52	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|O<2>,2|C<3>}	H(C[6]C[6]2)	120.8393	0.154	3	120.6312	0.411	52	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(N[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.9395	0.818	4	120.0753	0.495	6	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(N[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.3470	0.498	2	120.0753	0.495	6	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.0869	0.577	8	120.0389	0.258	12	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.9430	0.389	4	120.0389	0.258	12	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]S)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|C<4>,1|S<4>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]S)(H){1|C<3>,1|C<4>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	119.8740	0.000	1	119.8740	0.000	1	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]P)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]P)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,1|H<1>,1|P<4>}	H(C[6]C[6]2)	120.5180	0.116	2	120.5180	0.013	2	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]P)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]P)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,2|P<4>}	H(C[6]C[6]2)	120.3000	0.000	1	120.3000	0.000	1	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Pd)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Pd)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|Cl<1>,1|Pd<4>,1|C<3>}	H(C[6]C[6]2)	119.5420	0.000	1	119.5420	0.000	1	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,1|H<1>,1|S<1>}	H(C[6]C[6]2)	119.0392	0.155	4	119.6733	0.209	19	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|O<2>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,1|C<4>,1|S<2>}	H(C[6]C[6]2)	119.7473	0.226	13	119.6733	0.209	19	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|O<2>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,1|C<4>,1|S<3>}	H(C[6]C[6]2)	120.4600	0.396	2	119.6733	0.209	19	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<1>}	H(C[6]C[6]2)	119.5152	1.631	8	120.0152	1.083	61	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	H(C[6]C[6]2)	120.1606	0.994	44	120.0152	1.083	61	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<3>}	H(C[6]C[6]2)	119.7848	0.179	8	120.0152	1.083	61	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|S<1>,2|C<3>}	H(C[6]C[6]2)	119.4600	0.000	1	120.0152	1.083	61	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|C<3>,1|H<1>,1|S<2>}	H(C[6]C[6]2)	119.9010	0.181	2	119.9010	0.033	2	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>,2|N<2>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.2667	0.401	25	119.6245	0.543	205	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|C<4>,1|H<1>,1|N<2>,2|C<3>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.9445	0.215	15	119.6245	0.543	205	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|C<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.4981	0.748	165	119.6245	0.543	205	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|C<3>,2|H<1>,2|N<2>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.4392	0.408	87	120.0154	0.646	319	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|H<1>,4|C<3>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.9125	0.060	2	120.0154	0.646	319	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|N<2>,2|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.8828	0.775	39	120.0154	0.646	319	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){2|H<1>,3|C<3>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<4>,2|C<3>}	H(C[6]C[6]2)	120.5470	0.000	1	120.0154	0.646	319	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){2|H<1>,3|C<3>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.8468	0.880	190	120.0154	0.646	319	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|H<1>,1|O<1>,3|C<3>}	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.2400	0.396	52	119.2400	0.157	52	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]S)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|H<1>,1|S<2>,3|C<3>}	C[6](C[6]C[6]H)(N[6]C[6]S)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.5245	0.103	2	119.5245	0.011	2	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]W)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|H<1>,1|W<6>,3|C<3>}	C[6](C[6]C[6]H)(N[6]C[6]W)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.0870	0.000	1	119.0870	0.000	1	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]C)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<4>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	121.1832	0.125	5	121.1293	0.030	6	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]C)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<4>,2|N<3>}	H(C[6]C[6]2)	120.8600	0.000	1	121.1293	0.030	6	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)(C[6]N[6]N)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|N<2>,1|N<3>,1|O<1>}	H(C[6]C[6]2)	121.3585	0.544	2	120.7126	1.266	22	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)(C[6]N[6]N)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|O<1>,2|N<3>}	H(C[6]C[6]2)	120.6308	0.267	8	120.7126	1.266	22	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)(C[6]N[6]N)(H){1|C<3>,1|C<4>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|N<2>,2|N<3>}	H(C[6]C[6]2)	120.8495	0.316	2	120.7126	1.266	22	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)(C[6]N[6]N)(H){1|Pd<4>,1|C<3>,1|C<4>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|O<1>,2|N<3>}	H(C[6]C[6]2)	120.3810	0.560	2	120.7126	1.266	22	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)(C[6]N[6]N)(H){1|Pt<4>,1|C<3>,1|C<4>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|N<2>,1|N<3>,1|O<1>}	H(C[6]C[6]2)	120.3070	0.000	1	120.7126	1.266	22	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)(C[6]N[6]N)(H){1|Pt<4>,1|C<3>,1|C<4>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|O<1>,2|N<3>}	H(C[6]C[6]2)	120.6414	2.443	5	120.7126	1.266	22	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)(C[6]N[6]N)(H){1|Re<6>,1|C<3>,1|C<4>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|O<1>,2|N<3>}	H(C[6]C[6]2)	120.8370	0.000	1	120.7126	1.266	22	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)(C[6]N[6]N)(H){1|Zn<4>,1|C<3>,1|C<4>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|O<1>,2|N<3>}	H(C[6]C[6]2)	121.1030	0.000	1	120.7126	1.266	22	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)(C[6]N[6]N)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|N<2>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	121.9270	0.746	3	121.2885	2.682	71	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)(C[6]N[6]N)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|N<2>,2|N<3>}	H(C[6]C[6]2)	123.4594	3.775	7	121.2885	2.682	71	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)(C[6]N[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|N<2>,1|N<3>,1|O<1>}	H(C[6]C[6]2)	122.2250	1.861	3	121.2885	2.682	71	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)(C[6]N[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|N<2>,1|N<3>,1|S<1>}	H(C[6]C[6]2)	118.4527	2.368	3	121.2885	2.682	71	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)(C[6]N[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|O<1>,2|N<3>}	H(C[6]C[6]2)	121.0674	0.634	49	121.2885	2.682	71	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)(C[6]N[6]N)(H){1|Ca<10>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|Ca<10>,1|O<3>,2|N<3>}	H(C[6]C[6]2)	120.9500	0.000	1	121.2885	2.682	71	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)(C[6]N[6]N)(H){1|Ca<8>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|Ca<8>,1|O<3>,2|N<3>}	H(C[6]C[6]2)	121.4580	0.000	1	121.2885	2.682	71	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)(C[6]N[6]N)(H){1|Co<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|O<1>,2|N<3>}	H(C[6]C[6]2)	121.3020	0.192	2	121.2885	2.682	71	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)(C[6]N[6]N)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|O<1>,2|N<3>}	H(C[6]C[6]2)	121.0700	0.054	2	121.2885	2.682	71	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)(C[6]N[6]O)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,1|H<1>,1|N<3>,1|O<1>}	H(C[6]C[6]2)	119.5995	1.098	2	119.8420	0.483	4	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)(C[6]N[6]O)(H){1|C<3>,1|C<4>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|N<2>,2|O<1>}	H(C[6]C[6]2)	120.0845	0.087	2	119.8420	0.483	4	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)(C[6]N[6]O)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|N<3>,1|O<1>,1|S<1>}	H(C[6]C[6]2)	121.6915	2.306	4	120.9658	3.079	9	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)(C[6]N[6]O)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|N<3>,1|O<1>,1|S<2>}	H(C[6]C[6]2)	119.9330	0.359	3	120.9658	3.079	9	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)(C[6]N[6]O)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|N<3>,1|O<1>,1|S<3>}	H(C[6]C[6]2)	119.8210	0.000	1	120.9658	3.079	9	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)(C[6]N[6]O)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|O<1>,2|N<3>}	H(C[6]C[6]2)	122.3060	0.000	1	120.9658	3.079	9	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)(C[6]N[6]S)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|N<3>,1|O<1>,1|S<1>}	H(C[6]C[6]2)	123.3120	0.000	1	120.9528	2.586	5	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)(C[6]N[6]S)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|N<3>,2|S<1>}	H(C[6]C[6]2)	120.3630	1.062	4	120.9528	2.586	5	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|C<3>,1|C<4>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<2>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	121.2070	0.000	1	121.3650	0.087	4	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|C<3>,1|C<4>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	121.5730	0.286	2	121.3650	0.087	4	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|C<3>,1|C<4>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|N<2>,2|H<1>}	H(C[6]C[6]2)	121.1070	0.000	1	121.3650	0.087	4	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	121.4032	0.284	6	121.5660	3.074	84	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	121.5149	1.303	32	121.5660	3.074	84	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|H<1>,1|N<2>,1|S<1>}	H(C[6]C[6]2)	122.0943	0.842	3	121.5660	3.074	84	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|H<1>,1|N<2>,1|S<2>}	H(C[6]C[6]2)	121.7707	0.031	3	121.5660	3.074	84	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|H<1>,2|N<2>}	H(C[6]C[6]2)	121.4959	1.059	12	121.5660	3.074	84	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|N<2>,2|H<1>}	H(C[6]C[6]2)	120.8480	0.340	3	121.5660	3.074	84	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>}	H(C[6]C[6]2)	121.4227	0.201	13	121.5660	3.074	84	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|H<1>,1|N<3>,1|S<1>}	H(C[6]C[6]2)	121.6560	4.292	10	121.5660	3.074	84	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>}	H(C[6]C[6]2)	121.6110	0.000	1	121.5660	3.074	84	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>}	H(C[6]C[6]2)	125.8910	0.000	1	121.5660	3.074	84	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|C<3>,1|O<1>}	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.7650	0.000	1	120.7650	0.000	1	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](C[6]C[6]H)(N[6]C[6]U)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|U<16>,1|C<3>}	C[6](C[6]C[6]H)(N[6]C[6]U)(H){1|N<2>,2|H<1>}	H(C[6]C[6]2)	120.8450	0.000	1	120.8450	0.000	1	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](C[6]C[6]H)(N[6]C[6]W)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|C<3>,1|W<7>}	C[6](C[6]C[6]H)(N[6]C[6]W)(H){1|N<2>,2|H<1>}	H(C[6]C[6]2)	120.9160	0.000	1	120.9160	0.000	1	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6a]C[6])(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6a]C[6])(C[6]N[6]H)(H){2|H<1>,3|C<3>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8325	0.407	10	120.8325	0.165	10	120.0401	1.088	9307	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:I-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]I)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(I)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]I)(H){1|Br<1>,1|C<3>,1|C<4>}	C[6](C[6]C[6]H)(N[6]C[6]C)(I){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7360	0.000	1	119.7360	0.000	1	120.3757	0.307	13	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:I-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]I)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(I)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]I)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(I){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6159	0.557	7	120.6159	0.310	7	120.3757	0.307	13	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:I-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]I)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(I)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]I)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(N[6]C[6]O)(I){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9230	0.416	3	119.9230	0.173	3	120.3757	0.307	13	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:I-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]I)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(I)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]I)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(N[6]C[6]O)(I){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5340	0.000	2	120.5340	0.000	2	120.3757	0.307	13	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(N)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,1|H<1>,1|S<4>}	C[6](C[6]C[6]H)(N[6]C[6]H)(N){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.0240	0.000	2	119.0240	0.000	2	120.2160	4.263	3	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-1:	C[6]-3:	C[6](C[6]N[6]Cl)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(N)	H(C[6]C[6]2)	C[6](C[6]N[6]Cl)(C[6]N[6]N)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(N){1|Cl<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	122.6000	0.000	1	122.6000	0.000	1	120.2160	4.263	3	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]O)(H){2|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]C)(O){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	118.3060	0.000	1	118.3060	0.000	1	119.4255	0.797	121	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]O)(H){1|C<2>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(O){1|C<3>,1|C<4>,1|O<1>}	H(C[6]C[6]2)	119.2450	0.000	1	119.2450	0.000	1	119.4255	0.797	121	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)(N[6]C[6]2)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){3|C<3>}	C[6](C[6]C[6]H)(N[6]C[6]2)(O){1|H<1>,1|O<1>,3|C<3>}	H(C[6]C[6]2)	118.7340	0.000	1	118.7340	0.000	1	119.4255	0.797	121	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|C<3>,1|C<4>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]C)(O){2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.4370	0.000	1	119.9123	0.168	4	119.4255	0.797	121	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[6]H)(N[6]C[6]C)(O){1|C<4>,3|H<1>}	H(C[6]C[6]2)	120.0707	0.318	3	119.9123	0.168	4	119.4255	0.797	121	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)(N[6]C[6]S)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|C<4>,1|S<4>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]S)(O){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	118.8520	0.000	1	118.8520	0.000	1	119.4255	0.797	121	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]O)(H){2|C<4>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]C)(O){1|C<4>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.0695	0.176	2	119.0695	0.031	2	119.4255	0.797	121	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]O)(H){1|C<3>,1|C<4>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]C)(O){1|H<1>,1|O<2>,2|C<4>}	H(C[6]C[6]2)	119.0385	0.062	2	119.0385	0.004	2	119.4255	0.797	121	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]O)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(O)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]O)(H){1|C<4>,2|H<1>,3|C<3>}	C[6](C[6]C[6]H)(N[6]C[6]C)(O){1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	117.9360	0.000	1	117.9360	0.000	1	119.4255	0.797	121	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]O)(H)	C[6](C[6]C[6]H)(N[6]C[6]S)(O)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]O)(H){1|C<4>,1|S<4>,2|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]S)(O){1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	118.0760	0.000	1	118.0760	0.000	1	119.4255	0.797	121	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:O-1:	C[6]-3:	C[6](C[6]N[6]C)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]N[6]C)(C[6]N[6]O)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(O){1|C<3>,1|N<2>,1|O<1>}	H(C[6]C[6]2)	120.3980	0.000	1	119.5690	0.245	44	119.4255	0.797	121	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:O-1:	C[6]-3:	C[6](C[6]N[6]C)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]N[6]C)(C[6]N[6]O)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(O){1|C<4>,1|N<3>,1|S<1>}	H(C[6]C[6]2)	119.6734	0.488	21	119.5690	0.245	44	119.4255	0.797	121	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:O-1:	C[6]-3:	C[6](C[6]N[6]C)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]N[6]C)(C[6]N[6]O)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(O){1|C<4>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	119.4622	0.326	4	119.5690	0.245	44	119.4255	0.797	121	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:O-1:	C[6]-3:	C[6](C[6]N[6]C)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]N[6]C)(C[6]N[6]O)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(O){1|C<4>,2|N<3>}	H(C[6]C[6]2)	119.1806	0.677	5	119.5690	0.245	44	119.4255	0.797	121	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:O-1:	C[6]-3:	C[6](C[6]N[6]C)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]N[6]C)(C[6]N[6]O)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(O){1|N<3>,2|C<4>}	H(C[6]C[6]2)	119.0613	0.343	3	119.5690	0.245	44	119.4255	0.797	121	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:O-1:	C[6]-3:	C[6](C[6]N[6]C)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]N[6]C)(C[6]N[6]O)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(O){1|Se<1>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	119.6561	0.305	10	119.5690	0.245	44	119.4255	0.797	121	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:O-1:	C[6]-3:	C[6](C[6]N[6]Cl)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]N[6]Cl)(C[6]N[6]O)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(O){1|Cl<1>,1|N<2>,1|O<1>}	H(C[6]C[6]2)	121.6000	0.140	2	121.6000	0.020	2	119.4255	0.797	121	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:O-1:	C[6]-3:	C[6](C[6]N[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]N[6]H)(C[6]N[6]O)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(O){1|C<3>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	118.6365	0.733	2	119.4771	2.229	9	119.4255	0.797	121	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:O-1:	C[6]-3:	C[6](C[6]N[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]N[6]H)(C[6]N[6]O)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(O){1|H<1>,1|N<3>,1|S<1>}	H(C[6]C[6]2)	119.5708	2.237	4	119.4771	2.229	9	119.4255	0.797	121	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:O-1:	C[6]-3:	C[6](C[6]N[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]N[6]H)(C[6]N[6]O)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(O){1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	119.9127	0.369	3	119.4771	2.229	9	119.4255	0.797	121	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:O-1:	C[6]-3:	C[6](C[6]N[6]N)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]N[6]N)(C[6]N[6]O)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(O){3|N<3>}	H(C[6]C[6]2)	119.9960	0.114	4	120.3850	0.766	5	119.4255	0.797	121	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:O-1:	C[6]-3:	C[6](C[6]N[6]N)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]N[6]N)(C[6]N[6]O)(H){1|Zn<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(O){1|S<2>,2|N<3>}	H(C[6]C[6]2)	121.9410	0.000	1	120.3850	0.766	5	119.4255	0.797	121	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:O-1:	C[6]-3:	C[6](C[6]N[6]O)(C[6]O[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(O)	H(C[6]C[6]2)	C[6](C[6]N[6]O)(C[6]O[6]C)(H){2|C<4>}	C[6](C[6]C[6]H)(N[6]C[6]C)(O){1|C<4>,1|O<2>,2|C<3>}	H(C[6]C[6]2)	119.0000	0.000	1	119.0000	0.000	1	119.4255	0.797	121	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:O-1:	C[6]-3:	C[6](C[6]N[6]O)(C[6]O[6]C)(H)	C[6](C[6]C[6]H)(N[6]S[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]N[6]O)(C[6]O[6]C)(H){1|H<1>,1|S<4>}	C[6](C[6]C[6]H)(N[6]S[6]H)(O){1|C<4>,1|O<2>,2|O<1>}	H(C[6]C[6]2)	118.4023	0.652	3	118.4023	0.425	3	119.4255	0.797	121	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:O-1:	C[6]-3:	C[6](C[6]N[6]O)2(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(O)	H(C[6]C[6]2)	C[6](C[6]N[6]O)2(H){1|C<3>,2|C<4>}	C[6](C[6]C[6]H)(N[6]C[6]C)(O){1|N<3>,1|O<2>,1|S<1>}	H(C[6]C[6]2)	118.9460	0.193	3	118.7514	0.090	5	119.4255	0.797	121	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:O-1:	C[6]-3:	C[6](C[6]N[6]O)2(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(O)	H(C[6]C[6]2)	C[6](C[6]N[6]O)2(H){1|C<3>,2|C<4>}	C[6](C[6]C[6]H)(N[6]C[6]C)(O){1|N<3>,2|O<1>}	H(C[6]C[6]2)	118.4595	0.009	2	118.7514	0.090	5	119.4255	0.797	121	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:O-1:	C[6]-3:	C[6](C[6]N[6]O)2(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]N[6]O)2(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(O){1|N<3>,1|O<2>,1|S<1>}	H(C[6]C[6]2)	119.7290	0.257	4	119.3172	0.911	38	119.4255	0.797	121	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:O-1:	C[6]-3:	C[6](C[6]N[6]O)2(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]N[6]O)2(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(O){1|N<3>,2|O<1>}	H(C[6]C[6]2)	119.2688	0.996	34	119.3172	0.911	38	119.4255	0.797	121	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:S-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(S)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(N[6]C[6]C)(S){1|C<3>,2|H<1>}	H(C[6]C[6]2)	118.8340	0.000	1	118.8340	0.000	1	119.2478	0.727	13	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:S-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(S)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(S){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.6220	0.109	2	119.3088	1.078	6	119.2478	0.727	13	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:S-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(S)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(S){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.6250	0.000	1	119.3088	1.078	6	119.2478	0.727	13	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:S-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(S)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(S){1|H<1>,2|C<3>}	H(C[6]C[6]2)	118.9947	1.547	3	119.3088	1.078	6	119.2478	0.727	13	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:S-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(S)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(N[6]C[6]O)(S){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.1220	0.000	1	119.1220	0.000	1	119.2478	0.727	13	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:S-1:	C[6]-3:	C[6](C[6]N[6]H)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(S)	H(C[6]C[6]2)	C[6](C[6]N[6]H)(C[6]N[6]S)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(S){1|H<1>,1|N<3>,1|O<1>}	H(C[6]C[6]2)	117.8400	0.000	1	119.2826	0.780	5	119.2478	0.727	13	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:S-1:	C[6]-3:	C[6](C[6]N[6]H)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(S)	H(C[6]C[6]2)	C[6](C[6]N[6]H)(C[6]N[6]S)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(S){1|H<1>,1|N<3>,1|S<1>}	H(C[6]C[6]2)	119.6432	0.416	4	119.2826	0.780	5	119.2478	0.727	13	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:Se-1:	C[6]-3:	C[6](C[6]N[6]Se)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(Se)	H(C[6]C[6]2)	C[6](C[6]N[6]Se)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(Se){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1640	0.000	1	120.1640	0.000	1	120.1640	0.000	1	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:O[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]O[6]H)(H)	C[6](C[6]C[6]H)(O[6]C[6]P)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]O[6]H)(H){1|C<3>,1|H<1>,1|P<4>}	C[6](C[6]C[6]H)(O[6]C[6]P)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.3720	0.431	2	119.3720	0.186	2	119.3720	0.186	2	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	Ge[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]Ge[6]H)(C[6]C[6]H)(H)	C[6](Ge[6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]Ge[6]H)(C[6]C[6]H)(H){1|Ru<8>,1|C<3>,1|H<1>}	C[6](Ge[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	117.9390	0.000	1	117.9390	0.000	1	116.6175	5.949	4	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	Ge[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]Ge[6]H)(C[6]C[6]H)(H)	C[6](Ge[6]C[6a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]Ge[6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](Ge[6]C[6a]C[6])(C[6]C[6]H)(H){2|H<1>,3|C<3>}	H(C[6]C[6]2)	116.2505	3.935	2	116.2505	15.485	2	116.6175	5.949	4	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	Ge[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]Ge[6]H)(C[6]C[6]H)(H)	C[6](Ge[6]C[6a]Ge[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]Ge[6]H)(C[6]C[6]H)(H){1|Ge<3>,1|C<3>,1|H<1>}	C[6](Ge[6]C[6a]Ge[6])(C[6]C[6]H)(H){1|H<1>,4|C<3>}	H(C[6]C[6]2)	116.0300	0.000	1	116.0300	0.000	1	116.6175	5.949	4	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[3x6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[3x6]H)(C[6]C[6]H)(H)	C[6](N[3x6]As[3x6]C[3x6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[3x6]H)(C[6]C[6]H)(H){1|As<3>,1|C<3>,1|H<1>}	C[6](N[3x6]As[3x6]C[3x6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<3>,2|N<3>}	H(C[6]C[6]2)	120.3107	0.192	3	120.3107	0.037	3	120.6937	0.107	9	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[3x6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[3x6]H)(C[6]C[6]H)(H)	C[6](N[3x6]Nb[3,3,3x6]C[3x6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[3x6]H)(C[6]C[6]H)(H){1|Nb<7>,1|C<3>,1|H<1>}	C[6](N[3x6]Nb[3,3,3x6]C[3x6])(C[6]C[6]H)(H){1|Cl<1>,1|C<3>,1|H<1>,1|N<2>,2|C<4>,3|N<3>}	H(C[6]C[6]2)	120.9140	0.137	4	120.9140	0.019	4	120.6937	0.107	9	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[3x6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[3x6]H)(C[6]C[6]H)(H)	C[6](N[3x6]Nb[3x6]C[3x6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[3x6]H)(C[6]C[6]H)(H){1|Nb<5>,1|C<3>,1|H<1>}	C[6](N[3x6]Nb[3x6]C[3x6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|N<2>,1|O<2>,2|N<3>}	H(C[6]C[6]2)	120.6560	0.000	1	120.8275	0.059	2	120.6937	0.107	9	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[3x6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[3x6]H)(C[6]C[6]H)(H)	C[6](N[3x6]Nb[3x6]C[3x6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[3x6]H)(C[6]C[6]H)(H){1|Nb<6>,1|C<3>,1|H<1>}	C[6](N[3x6]Nb[3x6]C[3x6])(C[6]C[6]H)(H){1|Cl<1>,1|C<3>,1|C<4>,1|H<1>,1|N<2>,3|N<3>}	H(C[6]C[6]2)	120.9990	0.000	1	120.8275	0.059	2	120.6937	0.107	9	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[4,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[4,6]H)(C[6]C[6]H)(H)	C[6](N[4,6]C[4,6]Si[4])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[4,6]H)(C[6]C[6]H)(H){1|Si<5>,1|C<3>,1|H<1>}	C[6](N[4,6]C[4,6]Si[4])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,1|S<2>,2|C<3>}	H(C[6]C[6]2)	120.2907	0.207	3	120.2907	0.043	3	120.2919	0.034	7	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[4,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[4,6]H)(C[6]C[6]H)(H)	C[6](N[4,6]Si[4,4]C[4,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[4,6]H)(C[6]C[6]H)(H){1|Si<5>,1|C<3>,1|H<1>}	C[6](N[4,6]Si[4,4]C[4,6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>,2|S<2>}	H(C[6]C[6]2)	120.3280	0.000	1	120.3773	0.017	3	120.2919	0.034	7	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[4,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[4,6]H)(C[6]C[6]H)(H)	C[6](N[4,6]Si[4,4]C[4,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[4,6]H)(C[6]C[6]H)(H){1|Si<6>,1|C<3>,1|H<1>}	C[6](N[4,6]Si[4,4]C[4,6])(C[6]C[6]H)(H){2|Cl<1>,1|C<3>,1|H<1>,1|N<3>,2|S<2>}	H(C[6]C[6]2)	120.4020	0.177	2	120.3773	0.017	3	120.2919	0.034	7	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[4,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[4,6]H)(C[6]C[6]N)(H)	C[6](N[4,6]C[4,6]Si[4])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[4,6]H)(C[6]C[6]N)(H){1|Si<4>,1|C<3>,1|H<1>}	C[6](N[4,6]C[4,6]Si[4])(C[6]C[6]H)(H){1|Si<3>,1|Si<4>,1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0390	0.000	1	120.0390	0.000	1	120.2919	0.034	7	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]N[5,6]Cl)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(Cl)	H(C[6]C[6]2)	C[6](C[6]N[5,6]Cl)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(Cl){1|Si<5>,1|C<3>,1|O<2>,3|H<1>}	H(C[6]C[6]2)	120.9152	0.111	6	120.9152	0.012	6	120.9152	0.012	6	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]N[5,6]H)(H)	C[6](N[5,6]C[5,5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]N[5,6]H)(H){1|C<4>,2|C<3>}	C[6](N[5,6]C[5,5,6]C[5])(C[6]C[6]H)(H){1|H<1>,2|C<4>,3|C<3>}	H(C[6]C[6]2)	120.6470	0.000	1	120.6470	0.000	1	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H)	C[6](N[5,6]C[5,6,6a]Ga[3x5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H){1|Ga<6>,2|C<3>}	C[6](N[5,6]C[5,6,6a]Ga[3x5])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>,3|O<2>}	H(C[6]C[6]2)	120.2027	0.084	3	120.2027	0.007	3	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H)	C[6](N[5,6]C[5,6,6a]Ga[5,5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H){1|Ga<5>,2|C<3>}	C[6](N[5,6]C[5,6,6a]Ga[5,5])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>,2|O<2>}	H(C[6]C[6]2)	120.2235	0.080	2	120.2380	0.007	5	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H)	C[6](N[5,6]C[5,6,6a]Ga[5,5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H){1|Ga<6>,2|C<3>}	C[6](N[5,6]C[5,6,6a]Ga[5,5])(C[6]C[6]H)(H){2|Cl<1>,1|H<1>,2|C<3>,3|N<3>}	H(C[6]C[6]2)	120.2477	0.104	3	120.2380	0.007	5	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H)	C[6](N[5,6]C[5,6,6a]Ga[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H){1|Ga<6>,2|C<3>}	C[6](N[5,6]C[5,6,6a]Ga[5,6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<3>,2|C<3>,3|O<2>}	H(C[6]C[6]2)	120.3748	1.056	4	120.3748	1.115	4	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H)	C[6](N[5,6]C[5,6,6a]Ga[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H){1|Ga<4>,2|C<3>}	C[6](N[5,6]C[5,6,6a]Ga[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>,2|O<2>}	H(C[6]C[6]2)	119.9430	0.000	1	119.9625	0.001	2	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H)	C[6](N[5,6]C[5,6,6a]Ga[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H){1|Ga<6>,2|C<3>}	C[6](N[5,6]C[5,6,6a]Ga[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<3>,2|C<3>,3|F<1>}	H(C[6]C[6]2)	119.9820	0.000	1	119.9625	0.001	2	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H)	C[6](N[5,6]C[5,6,6a]Ge[3x5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H){1|Ge<6>,2|C<3>}	C[6](N[5,6]C[5,6,6a]Ge[3x5])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>,3|O<2>}	H(C[6]C[6]2)	120.1155	0.118	2	120.1155	0.014	2	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H)	C[6](N[5,6]C[5,6,6a]Ge[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H){1|Ge<2>,2|C<3>}	C[6](N[5,6]C[5,6,6a]Ge[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.9910	0.000	1	119.9910	0.000	1	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H)	C[6](N[5,6]C[5,6,6a]In[3x5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H){1|In<6>,2|C<3>}	C[6](N[5,6]C[5,6,6a]In[3x5])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>,3|O<2>}	H(C[6]C[6]2)	120.3555	0.338	6	120.3555	0.114	6	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H)	C[6](N[5,6]C[5,6,6a]In[4,5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H){1|In<6>,2|C<3>}	C[6](N[5,6]C[5,6,6a]In[4,5,6])(C[6]C[6]H)(H){1|Cl<1>,1|Se<3>,2|Se<2>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	121.0420	0.000	1	121.0420	0.000	1	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H)	C[6](N[5,6]C[5,6,6a]In[5,5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H){1|In<6>,2|C<3>}	C[6](N[5,6]C[5,6,6a]In[5,5])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|I<1>,3|N<3>}	H(C[6]C[6]2)	120.4220	0.222	3	120.4220	0.049	3	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H)	C[6](N[5,6]C[5,6,6a]In[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H){1|In<5>,2|C<3>}	C[6](N[5,6]C[5,6,6a]In[5,6])(C[6]C[6]H)(H){1|Cl<1>,2|Se<2>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.6320	0.641	2	120.6320	0.410	2	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H)	C[6](N[5,6]C[5,6,6a]In[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H){1|In<6>,2|C<3>}	C[6](N[5,6]C[5,6,6a]In[5])(C[6]C[6]H)(H){1|Cl<1>,1|H<1>,1|N<3>,2|C<3>,3|O<2>}	H(C[6]C[6]2)	120.4730	0.000	1	120.7406	0.751	5	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H)	C[6](N[5,6]C[5,6,6a]In[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H){1|In<6>,2|C<3>}	C[6](N[5,6]C[5,6,6a]In[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<3>,2|C<3>,3|O<2>}	H(C[6]C[6]2)	120.8075	0.986	4	120.7406	0.751	5	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H)	C[6](N[5,6]C[5,6,6a]Nb[3x5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H){1|Nb<7>,2|C<3>}	C[6](N[5,6]C[5,6,6a]Nb[3x5])(C[6]C[6]H)(H){1|H<1>,1|O<1>,2|C<3>,2|N<3>,3|O<2>}	H(C[6]C[6]2)	120.2640	0.601	2	120.2640	0.361	2	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H)	C[6](N[5,6]C[5,6,6a]Si[3x5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H){1|Si<6>,2|C<3>}	C[6](N[5,6]C[5,6,6a]Si[3x5])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|O<2>,3|N<3>}	H(C[6]C[6]2)	119.8235	0.129	2	119.8235	0.017	2	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H)	C[6](N[5,6]C[5,6,6a]Si[4,5,5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H){1|Si<6>,2|C<3>}	C[6](N[5,6]C[5,6,6a]Si[4,5,5])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>,3|O<2>}	H(C[6]C[6]2)	119.8480	0.000	1	119.8480	0.000	1	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H)	C[6](N[5,6]C[5,6,6a]Si[4,5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H){1|Si<6>,2|C<3>}	C[6](N[5,6]C[5,6,6a]Si[4,5])(C[6]C[6]H)(H){1|H<1>,1|O<2>,2|C<3>,2|N<2>,2|N<3>}	H(C[6]C[6]2)	119.9853	0.106	3	119.9888	0.007	5	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H)	C[6](N[5,6]C[5,6,6a]Si[4,5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H){1|Si<6>,2|C<3>}	C[6](N[5,6]C[5,6,6a]Si[4,5])(C[6]C[6]H)(H){2|Br<1>,1|H<1>,1|O<2>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	120.0410	0.000	1	119.9888	0.007	5	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H)	C[6](N[5,6]C[5,6,6a]Si[4,5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H){1|Si<6>,2|C<3>}	C[6](N[5,6]C[5,6,6a]Si[4,5])(C[6]C[6]H)(H){2|Cl<1>,1|H<1>,1|O<2>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	119.9470	0.000	1	119.9888	0.007	5	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H)	C[6](N[5,6]C[5,6,6a]Si[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H){1|Si<6>,2|C<3>}	C[6](N[5,6]C[5,6,6a]Si[5])(C[6]C[6]H)(H){1|C<2>,1|H<1>,1|N<3>,2|C<3>,3|F<1>}	H(C[6]C[6]2)	120.0185	0.094	2	119.7365	0.056	10	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H)	C[6](N[5,6]C[5,6,6a]Si[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H){1|Si<6>,2|C<3>}	C[6](N[5,6]C[5,6,6a]Si[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>,4|N<2>}	H(C[6]C[6]2)	119.6950	0.148	2	119.7365	0.056	10	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H)	C[6](N[5,6]C[5,6,6a]Si[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H){1|Si<6>,2|C<3>}	C[6](N[5,6]C[5,6,6a]Si[5])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<2>,3|N<3>}	H(C[6]C[6]2)	119.6963	0.345	3	119.7365	0.056	10	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H)	C[6](N[5,6]C[5,6,6a]Si[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H){1|Si<6>,2|C<3>}	C[6](N[5,6]C[5,6,6a]Si[5])(C[6]C[6]H)(H){4|Cl<1>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.6163	0.103	3	119.7365	0.056	10	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H)	C[6](N[5,6]In[3x4,5,3x6]C[5,6,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H){1|In<6>,2|C<3>}	C[6](N[5,6]In[3x4,5,3x6]C[5,6,6a])(C[6]C[6]H)(H){1|Cl<1>,1|H<1>,1|N<3>,2|C<3>,3|S<3>}	H(C[6]C[6]2)	120.6198	0.539	14	120.6198	0.291	14	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]C)(H)	C[6](N[5,6]C[5,6]In[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]C)(H){1|In<6>,1|C<3>,1|H<1>}	C[6](N[5,6]C[5,6]In[5])(C[6]C[6]H)(H){3|Cl<1>,1|C<4>,1|N<3>,1|O<2>,2|C<3>}	H(C[6]C[6]2)	119.9370	0.219	4	119.9360	0.109	8	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]C)(H)	C[6](N[5,6]C[5,6]In[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]C)(H){1|In<6>,1|C<3>,1|H<1>}	C[6](N[5,6]C[5,6]In[5])(C[6]C[6]H)(H){3|Cl<1>,1|C<4>,1|N<3>,1|O<3>,2|C<3>}	H(C[6]C[6]2)	119.9350	0.453	4	119.9360	0.109	8	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]C)(H)	C[6](N[5,6]C[5,6]S[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|S<2>}	C[6](N[5,6]C[5,6]S[5])(C[6]C[6]H)(H){1|C<4>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.3840	0.000	1	119.3840	0.000	1	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]C)(H)	C[6](N[5,6]Ga[5,5]C[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]C)(H){1|Ga<5>,1|C<3>,1|H<1>}	C[6](N[5,6]Ga[5,5]C[5,6])(C[6]C[6]H)(H){2|Cl<1>,1|C<4>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	119.8785	0.128	2	119.8785	0.016	2	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]B[4,5]C[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](N[5,6]B[4,5]C[5,6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<2>,3|C<3>}	H(C[6]C[6]2)	121.0380	0.000	1	121.0380	0.000	1	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]B[4x3,4x5,12x6]C[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|B<6>,1|C<3>,1|H<1>}	C[6](N[5,6]B[4x3,4x5,12x6]C[5,6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|C<5>,1|H<1>,1|H<2>,3|B<6>}	H(C[6]C[6]2)	120.6300	0.000	1	120.6300	0.000	1	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]B[5,5]C[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](N[5,6]B[5,5]C[5,6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,3|O<2>}	H(C[6]C[6]2)	120.6578	0.097	4	120.6482	0.007	6	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]B[5,5]C[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](N[5,6]B[5,5]C[5,6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,2|C<4>,2|O<2>}	H(C[6]C[6]2)	120.5690	0.000	1	120.6482	0.007	6	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]B[5,5]C[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](N[5,6]B[5,5]C[5,6])(C[6]C[6]H)(H){1|H<1>,5|C<3>}	H(C[6]C[6]2)	120.6890	0.000	1	120.6482	0.007	6	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]B[5,6,6]C[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](N[5,6]B[5,6,6]C[5,6])(C[6]C[6]H)(H){1|H<1>,2|C<4>,3|C<3>}	H(C[6]C[6]2)	120.3846	0.110	5	120.3846	0.012	5	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]B[5,6a]C[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](N[5,6]B[5,6a]C[5,6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<2>,3|C<3>}	H(C[6]C[6]2)	120.2660	0.000	1	120.3790	0.026	2	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]B[5,6a]C[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](N[5,6]B[5,6a]C[5,6])(C[6]C[6]H)(H){1|H<1>,5|C<3>}	H(C[6]C[6]2)	120.4920	0.000	1	120.3790	0.026	2	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]B[5x3,6x5,20x6]C[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|B<6>,1|C<3>,1|H<1>}	C[6](N[5,6]B[5x3,6x5,20x6]C[5,6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|C<6>,1|H<1>,4|B<6>}	H(C[6]C[6]2)	120.4960	0.000	1	120.4960	0.000	1	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,5]C[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](N[5,6]C[5,5]C[5,6])(C[6]C[6]H)(H){1|Se<2>,1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	120.6640	0.000	1	120.6640	0.000	1	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](N[5,6]C[5,6]2)(C[6]C[6]H)(H){1|C<2>,1|C<4>,1|H<1>,1|N<2>,2|C<3>}	H(C[6]C[6]2)	120.4670	0.000	1	120.1400	0.072	5	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](N[5,6]C[5,6]2)(C[6]C[6]H)(H){1|C<3>,2|H<1>,3|C<4>}	H(C[6]C[6]2)	120.1420	0.000	1	120.1400	0.072	5	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](N[5,6]C[5,6]2)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|P<2>,2|C<3>}	H(C[6]C[6]2)	119.8740	0.000	2	120.1400	0.072	5	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](N[5,6]C[5,6]2)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|P<6>,2|C<3>}	H(C[6]C[6]2)	120.3430	0.000	1	120.1400	0.072	5	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]B[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|B<3>,1|C<3>,1|H<1>}	C[6](N[5,6]C[5,6]B[5])(C[6]C[6]H)(H){1|H<1>,4|C<3>}	H(C[6]C[6]2)	119.9560	0.000	1	120.3270	0.053	11	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]B[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](N[5,6]C[5,6]B[5])(C[6]C[6]H)(H){1|C<4>,1|H<1>,4|C<3>}	H(C[6]C[6]2)	120.6130	0.000	1	120.3270	0.053	11	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]B[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](N[5,6]C[5,6]B[5])(C[6]C[6]H)(H){1|Cl<1>,1|H<1>,4|C<3>}	H(C[6]C[6]2)	120.5880	0.000	1	120.3270	0.053	11	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]B[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](N[5,6]C[5,6]B[5])(C[6]C[6]H)(H){1|H<1>,5|C<3>}	H(C[6]C[6]2)	120.3050	0.184	8	120.3270	0.053	11	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Br<1>,2|C<4>}	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){2|C<3>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	120.5125	0.073	2	119.7457	0.446	64	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|C<3>,2|H<1>,3|C<4>}	H(C[6]C[6]2)	119.9480	0.000	1	119.7457	0.446	64	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<2>,3|C<3>}	H(C[6]C[6]2)	120.2740	0.000	1	119.7457	0.446	64	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|C<4>,1|H<1>,4|C<3>}	H(C[6]C[6]2)	119.5980	0.000	1	119.7457	0.446	64	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	121.0055	1.385	2	119.7457	0.446	64	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.6330	0.000	1	119.7457	0.446	64	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	120.4090	0.000	1	119.7457	0.446	64	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,5|C<3>}	H(C[6]C[6]2)	120.2520	0.000	1	119.7457	0.446	64	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|N<3>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	120.6780	0.000	1	119.7457	0.446	64	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|Os<6>,1|H<1>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	119.9810	0.000	1	119.7457	0.446	64	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|Si<4>,1|C<3>,1|N<3>,1|O<2>,2|H<1>}	H(C[6]C[6]2)	120.6490	0.000	1	119.7457	0.446	64	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|Si<5>,1|C<3>,1|O<2>,3|H<1>}	H(C[6]C[6]2)	120.4537	0.115	3	119.7457	0.446	64	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Cl<1>,1|C<3>,1|C<4>}	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<2>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.1450	0.000	1	119.7457	0.446	64	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>,1|P<2>,1|P<3>}	H(C[6]C[6]2)	119.9507	0.428	3	119.7457	0.446	64	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>,2|P<2>}	H(C[6]C[6]2)	119.8270	0.000	1	119.7457	0.446	64	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.3980	0.277	2	119.7457	0.446	64	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|C<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.9340	0.000	1	119.7457	0.446	64	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|C<4>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8460	0.000	1	119.7457	0.446	64	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	121.0670	0.000	1	119.7457	0.446	64	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	119.2087	0.466	26	119.7457	0.446	64	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,4|C<3>}	H(C[6]C[6]2)	119.9403	0.067	3	119.7457	0.446	64	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7378	0.443	5	119.7457	0.446	64	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|Os<6>,1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.0130	0.037	2	119.7457	0.446	64	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.7380	0.045	2	119.7457	0.446	64	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]Ga[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ga<4>,1|C<3>,1|H<1>}	C[6](N[5,6]C[5,6]Ga[5])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|N<3>,2|I<1>}	H(C[6]C[6]2)	120.6705	0.513	2	120.6980	0.199	11	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]Ga[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ga<4>,1|C<3>,1|H<1>}	C[6](N[5,6]C[5,6]Ga[5])(C[6]C[6]H)(H){1|Si<4>,1|C<3>,1|H<1>,3|C<4>}	H(C[6]C[6]2)	120.4620	0.000	1	120.6980	0.199	11	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]Ga[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ga<4>,1|C<3>,1|H<1>}	C[6](N[5,6]C[5,6]Ga[5])(C[6]C[6]H)(H){1|Si<4>,2|Cl<1>,1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.7170	0.361	2	120.6980	0.199	11	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]Ga[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ga<4>,1|C<3>,1|H<1>}	C[6](N[5,6]C[5,6]Ga[5])(C[6]C[6]H)(H){2|Fe<8>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	121.0660	1.038	2	120.6980	0.199	11	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]Ga[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ga<5>,1|C<3>,1|H<1>}	C[6](N[5,6]C[5,6]Ga[5])(C[6]C[6]H)(H){1|Fe<11>,1|Si<4>,1|C<3>,1|H<1>,3|C<4>}	H(C[6]C[6]2)	120.5075	0.192	2	120.6980	0.199	11	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]Ga[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ga<6>,1|C<3>,1|H<1>}	C[6](N[5,6]C[5,6]Ga[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<3>,2|C<3>,3|F<1>}	H(C[6]C[6]2)	120.6470	0.269	2	120.6980	0.199	11	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]Ge[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ge<2>,1|C<3>,1|H<1>}	C[6](N[5,6]C[5,6]Ge[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.4730	0.023	2	120.4545	0.001	4	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]Ge[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ge<4>,1|C<3>,1|H<1>}	C[6](N[5,6]C[5,6]Ge[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	120.4360	0.020	2	120.4545	0.001	4	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]In[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|In<4>,1|C<3>,1|H<1>}	C[6](N[5,6]C[5,6]In[5])(C[6]C[6]H)(H){1|Si<4>,1|C<3>,1|C<4>,1|H<1>,2|I<1>}	H(C[6]C[6]2)	120.4460	0.000	1	120.4247	0.015	3	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]In[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|In<4>,1|C<3>,1|H<1>}	C[6](N[5,6]C[5,6]In[5])(C[6]C[6]H)(H){1|Si<4>,2|Cl<1>,1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.5340	0.000	1	120.4247	0.015	3	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]In[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|In<6>,1|C<3>,1|H<1>}	C[6](N[5,6]C[5,6]In[5])(C[6]C[6]H)(H){3|Cl<1>,1|H<1>,1|N<3>,1|O<3>,2|C<3>}	H(C[6]C[6]2)	120.2940	0.000	1	120.4247	0.015	3	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.5235	0.141	4	119.6693	0.080	6	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|N<2>,2|C<3>}	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	119.9610	0.290	2	119.6693	0.080	6	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]Nb[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Nb<6>,1|C<3>,1|H<1>}	C[6](N[5,6]C[5,6]Nb[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>,2|C<3>,3|N<2>}	H(C[6]C[6]2)	120.5285	0.168	2	120.5285	0.028	2	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]O[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](N[5,6]C[5,6]O[5])(C[6]C[6]H)(H){1|Ge<2>,1|C<3>,1|H<1>,1|S<2>}	H(C[6]C[6]2)	120.6470	0.000	1	120.1360	0.292	4	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]O[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](N[5,6]C[5,6]O[5])(C[6]C[6]H)(H){1|In<6>,1|C<3>,1|H<1>,1|S<2>}	H(C[6]C[6]2)	120.2550	0.000	1	120.1360	0.292	4	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]O[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](N[5,6]C[5,6]O[5])(C[6]C[6]H)(H){1|Si<5>,1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.8210	0.634	2	120.1360	0.292	4	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]P[3x5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<6>}	C[6](N[5,6]C[5,6]P[3x5])(C[6]C[6]H)(H){1|H<1>,2|N<3>,2|O<2>,3|C<3>}	H(C[6]C[6]2)	120.0595	0.095	2	120.0595	0.009	2	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]P[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<2>}	C[6](N[5,6]C[5,6]P[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.7400	0.310	3	119.8941	0.101	7	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]P[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<3>}	C[6](N[5,6]C[5,6]P[5])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	120.0500	0.000	1	119.8941	0.101	7	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]P[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<4>}	C[6](N[5,6]C[5,6]P[5])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<2>,1|W<6>,2|C<3>}	H(C[6]C[6]2)	119.8305	0.347	2	119.8941	0.101	7	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]P[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<6>}	C[6](N[5,6]C[5,6]P[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>,4|F<1>}	H(C[6]C[6]2)	120.3280	0.000	1	119.8941	0.101	7	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]Se[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Se<2>,1|C<3>,1|H<1>}	C[6](N[5,6]C[5,6]Se[5])(C[6]C[6]H)(H){1|H<1>,1|N<2>,2|C<3>}	H(C[6]C[6]2)	120.3700	0.000	1	120.3700	0.000	1	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]Si[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Si<4>,1|C<3>,1|H<1>}	C[6](N[5,6]C[5,6]Si[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,4|C<3>}	H(C[6]C[6]2)	120.4607	0.136	3	120.3726	0.033	19	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]Si[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Si<5>,1|C<3>,1|H<1>}	C[6](N[5,6]C[5,6]Si[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<2>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	120.3880	0.078	2	120.3726	0.033	19	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]Si[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Si<5>,1|C<3>,1|H<1>}	C[6](N[5,6]C[5,6]Si[5])(C[6]C[6]H)(H){3|Cl<1>,1|C<3>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5937	0.192	3	120.3726	0.033	19	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]Si[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Si<5>,1|C<3>,1|H<1>}	C[6](N[5,6]C[5,6]Si[5])(C[6]C[6]H)(H){3|Cl<1>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.3865	0.091	2	120.3726	0.033	19	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]Si[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Si<6>,1|C<3>,1|H<1>}	C[6](N[5,6]C[5,6]Si[5])(C[6]C[6]H)(H){1|C<2>,1|H<1>,1|N<3>,2|C<3>,3|F<1>}	H(C[6]C[6]2)	120.4040	0.082	2	120.3726	0.033	19	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]Si[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Si<6>,1|C<3>,1|H<1>}	C[6](N[5,6]C[5,6]Si[5])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<2>,3|N<3>}	H(C[6]C[6]2)	120.1534	0.089	5	120.3726	0.033	19	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]Si[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Si<6>,1|C<3>,1|H<1>}	C[6](N[5,6]C[5,6]Si[5])(C[6]C[6]H)(H){2|Cl<1>,1|N<3>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	120.3965	0.117	2	120.3726	0.033	19	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6a]C[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](N[5,6]C[5,6a]C[5,6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	119.3940	0.000	1	119.7013	0.116	3	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6a]C[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](N[5,6]C[5,6a]C[5,6])(C[6]C[6]H)(H){1|H<1>,4|C<3>}	H(C[6]C[6]2)	119.8550	0.300	2	119.7013	0.116	3	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]Ga[3x5,6,6]C[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ga<6>,1|C<3>,1|H<1>}	C[6](N[5,6]Ga[3x5,6,6]C[5,6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,2|O<2>,3|N<4>}	H(C[6]C[6]2)	120.6330	0.000	1	120.6330	0.000	1	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]Ga[3x5]C[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ga<6>,1|C<3>,1|H<1>}	C[6](N[5,6]Ga[3x5]C[5,6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,5|N<3>}	H(C[6]C[6]2)	120.4770	0.439	4	120.4760	0.116	6	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]Ga[3x5]C[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ga<6>,1|C<3>,1|H<1>}	C[6](N[5,6]Ga[3x5]C[5,6])(C[6]C[6]H)(H){2|Cl<1>,1|C<3>,1|C<4>,1|H<1>,1|N<3>,2|N<4>}	H(C[6]C[6]2)	120.4740	0.052	2	120.4760	0.116	6	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]Ga[4,5,5]C[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ga<6>,1|C<3>,1|H<1>}	C[6](N[5,6]Ga[4,5,5]C[5,6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|O<2>,3|N<3>}	H(C[6]C[6]2)	120.5256	0.460	16	120.5256	0.211	16	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]Ga[4x5]C[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ga<6>,1|C<3>,1|H<1>}	C[6](N[5,6]Ga[4x5]C[5,6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|S<2>,3|N<3>}	H(C[6]C[6]2)	120.4310	0.286	4	120.4310	0.082	4	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]Ga[5,5,6,6]C[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ga<6>,1|C<3>,1|H<1>}	C[6](N[5,6]Ga[5,5,6,6]C[5,6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,2|O<2>,3|N<3>}	H(C[6]C[6]2)	120.3650	0.057	2	120.3650	0.003	2	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]Ga[5,5,6]C[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ga<6>,1|C<3>,1|H<1>}	C[6](N[5,6]Ga[5,5,6]C[5,6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|O<2>,3|N<3>}	H(C[6]C[6]2)	120.4828	0.333	4	120.4828	0.111	4	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]Ga[5,5]C[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ga<4>,1|C<3>,1|H<1>}	C[6](N[5,6]Ga[5,5]C[5,6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,3|N<3>}	H(C[6]C[6]2)	120.2520	0.000	1	120.4707	0.033	16	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]Ga[5,5]C[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ga<5>,1|C<3>,1|H<1>}	C[6](N[5,6]Ga[5,5]C[5,6])(C[6]C[6]H)(H){1|Cl<1>,1|H<1>,2|C<3>,3|N<3>}	H(C[6]C[6]2)	120.3840	0.000	1	120.4707	0.033	16	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]Ga[5,5]C[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ga<5>,1|C<3>,1|H<1>}	C[6](N[5,6]Ga[5,5]C[5,6])(C[6]C[6]H)(H){1|H<1>,1|O<3>,2|C<3>,3|N<3>}	H(C[6]C[6]2)	120.4850	0.000	1	120.4707	0.033	16	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]Ga[5,5]C[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ga<5>,1|C<3>,1|H<1>}	C[6](N[5,6]Ga[5,5]C[5,6])(C[6]C[6]H)(H){1|H<1>,1|S<2>,2|C<3>,3|N<3>}	H(C[6]C[6]2)	120.5575	0.045	2	120.4707	0.033	16	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]Ga[5,5]C[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ga<5>,1|C<3>,1|H<1>}	C[6](N[5,6]Ga[5,5]C[5,6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|F<1>,2|N<3>}	H(C[6]C[6]2)	120.3670	0.000	1	120.4707	0.033	16	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]Ga[5,5]C[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ga<5>,1|C<3>,1|H<1>}	C[6](N[5,6]Ga[5,5]C[5,6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|I<1>,2|N<3>}	H(C[6]C[6]2)	120.1630	0.006	2	120.4707	0.033	16	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]Ga[5,5]C[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ga<5>,1|C<3>,1|H<1>}	C[6](N[5,6]Ga[5,5]C[5,6])(C[6]C[6]H)(H){2|Cl<1>,1|H<1>,1|N<3>,1|S<2>,2|C<3>}	H(C[6]C[6]2)	120.4705	0.104	2	120.4707	0.033	16	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]Ga[5,5]C[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ga<6>,1|C<3>,1|H<1>}	C[6](N[5,6]Ga[5,5]C[5,6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>,3|F<1>}	H(C[6]C[6]2)	120.6490	0.209	2	120.4707	0.033	16	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]Ga[5,5]C[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ga<6>,1|C<3>,1|H<1>}	C[6](N[5,6]Ga[5,5]C[5,6])(C[6]C[6]H)(H){3|Br<1>,1|H<1>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	120.5035	0.090	2	120.4707	0.033	16	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]Ga[5,5]C[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ga<6>,1|C<3>,1|H<1>}	C[6](N[5,6]Ga[5,5]C[5,6])(C[6]C[6]H)(H){3|Cl<1>,1|H<1>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	120.6780	0.023	2	120.4707	0.033	16	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]Ga[5x5]C[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ga<6>,1|C<3>,1|H<1>}	C[6](N[5,6]Ga[5x5]C[5,6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|N<3>,2|N<4>,2|O<2>}	H(C[6]C[6]2)	120.4450	0.000	1	120.4450	0.000	1	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]Ge[5,6]C[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ge<3>,1|C<3>,1|H<1>}	C[6](N[5,6]Ge[5,6]C[5,6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|N<3>,1|N<4>}	H(C[6]C[6]2)	120.3020	0.000	1	120.3905	0.016	2	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]Ge[5,6]C[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ge<3>,1|C<3>,1|H<1>}	C[6](N[5,6]Ge[5,6]C[5,6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.4790	0.000	1	120.3905	0.016	2	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]In[3x5]C[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|In<6>,1|C<3>,1|H<1>}	C[6](N[5,6]In[3x5]C[5,6])(C[6]C[6]H)(H){1|Cl<1>,1|C<3>,1|C<4>,1|H<1>,1|N<4>,3|N<3>}	H(C[6]C[6]2)	120.5050	0.000	1	120.7242	0.034	4	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]In[3x5]C[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|In<6>,1|C<3>,1|H<1>}	C[6](N[5,6]In[3x5]C[5,6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>,4|O<2>}	H(C[6]C[6]2)	120.8670	0.092	2	120.7242	0.034	4	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]In[3x5]C[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|In<7>,1|C<3>,1|H<1>}	C[6](N[5,6]In[3x5]C[5,6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>,2|O<3>,3|O<2>}	H(C[6]C[6]2)	120.6580	0.000	1	120.7242	0.034	4	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]In[4x5]C[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|In<6>,1|C<3>,1|H<1>}	C[6](N[5,6]In[4x5]C[5,6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|S<2>,3|N<3>}	H(C[6]C[6]2)	120.7520	0.211	4	120.7520	0.045	4	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]In[5,5,6,6]C[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|In<6>,1|C<3>,1|H<1>}	C[6](N[5,6]In[5,5,6,6]C[5,6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,2|N<3>,3|O<2>}	H(C[6]C[6]2)	120.7425	0.071	2	120.7425	0.005	2	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]In[5,5]C[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|In<5>,1|C<3>,1|H<1>}	C[6](N[5,6]In[5,5]C[5,6])(C[6]C[6]H)(H){1|Se<2>,2|Br<1>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.6200	0.000	1	120.6894	0.056	11	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]In[5,5]C[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|In<6>,1|C<3>,1|H<1>}	C[6](N[5,6]In[5,5]C[5,6])(C[6]C[6]H)(H){2|Br<1>,1|H<1>,1|N<3>,1|O<3>,1|S<2>,2|C<3>}	H(C[6]C[6]2)	120.3400	0.000	1	120.6894	0.056	11	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]In[5,5]C[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|In<6>,1|C<3>,1|H<1>}	C[6](N[5,6]In[5,5]C[5,6])(C[6]C[6]H)(H){2|Cl<1>,1|H<1>,1|N<3>,1|O<2>,1|S<2>,2|C<3>}	H(C[6]C[6]2)	120.8300	0.000	1	120.6894	0.056	11	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]In[5,5]C[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|In<6>,1|C<3>,1|H<1>}	C[6](N[5,6]In[5,5]C[5,6])(C[6]C[6]H)(H){2|Cl<1>,1|H<1>,1|N<3>,1|O<3>,1|S<2>,2|C<3>}	H(C[6]C[6]2)	120.8520	0.000	1	120.6894	0.056	11	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]In[5,5]C[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|In<6>,1|C<3>,1|H<1>}	C[6](N[5,6]In[5,5]C[5,6])(C[6]C[6]H)(H){3|Br<1>,1|C<3>,1|C<4>,1|H<1>,1|N<3>,1|N<4>}	H(C[6]C[6]2)	121.0380	0.000	1	120.6894	0.056	11	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]In[5,5]C[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|In<6>,1|C<3>,1|H<1>}	C[6](N[5,6]In[5,5]C[5,6])(C[6]C[6]H)(H){3|Cl<1>,1|C<3>,1|H<1>,1|N<2>,2|N<3>}	H(C[6]C[6]2)	120.7340	0.000	1	120.6894	0.056	11	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]In[5,5]C[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|In<6>,1|C<3>,1|H<1>}	C[6](N[5,6]In[5,5]C[5,6])(C[6]C[6]H)(H){3|Cl<1>,1|H<1>,1|N<3>,1|S<2>,2|C<3>}	H(C[6]C[6]2)	120.3000	0.000	1	120.6894	0.056	11	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]In[5,5]C[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|In<6>,1|C<3>,1|H<1>}	C[6](N[5,6]In[5,5]C[5,6])(C[6]C[6]H)(H){3|Cl<1>,1|H<1>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	120.8470	0.030	2	120.6894	0.056	11	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]In[5,5]C[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|In<6>,2|C<3>}	C[6](N[5,6]In[5,5]C[5,6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<3>,2|C<3>,3|O<2>}	H(C[6]C[6]2)	120.5875	0.200	2	120.6894	0.056	11	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]In[5,6]C[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|In<6>,1|C<3>,1|H<1>}	C[6](N[5,6]In[5,6]C[5,6])(C[6]C[6]H)(H){2|Cl<1>,1|H<1>,1|O<2>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	120.6340	0.000	1	120.6340	0.000	1	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]Si[5,5]C[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Si<4>,1|C<3>,1|H<1>}	C[6](N[5,6]Si[5,5]C[5,6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,3|N<3>}	H(C[6]C[6]2)	120.2965	0.060	2	120.3152	0.049	14	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]Si[5,5]C[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Si<5>,1|C<3>,1|H<1>}	C[6](N[5,6]Si[5,5]C[5,6])(C[6]C[6]H)(H){1|Br<1>,1|C<4>,1|H<1>,1|N<3>,1|S<2>,2|C<3>}	H(C[6]C[6]2)	120.5340	0.000	1	120.3152	0.049	14	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]Si[5,5]C[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Si<5>,1|C<3>,1|H<1>}	C[6](N[5,6]Si[5,5]C[5,6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>,1|O<2>,1|S<2>,2|C<4>}	H(C[6]C[6]2)	120.4090	0.000	1	120.3152	0.049	14	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]Si[5,5]C[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Si<5>,1|C<3>,1|H<1>}	C[6](N[5,6]Si[5,5]C[5,6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<2>,1|N<3>,1|S<2>,2|C<3>}	H(C[6]C[6]2)	120.2947	0.438	3	120.3152	0.049	14	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]Si[5,5]C[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Si<5>,1|C<3>,1|H<1>}	C[6](N[5,6]Si[5,5]C[5,6])(C[6]C[6]H)(H){1|Cl<1>,1|C<4>,1|H<1>,1|N<3>,1|S<2>,2|C<3>}	H(C[6]C[6]2)	120.5270	0.068	2	120.3152	0.049	14	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]Si[5,5]C[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Si<6>,1|C<3>,1|H<1>}	C[6](N[5,6]Si[5,5]C[5,6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<2>,3|N<3>}	H(C[6]C[6]2)	120.2260	0.000	1	120.3152	0.049	14	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]Si[5,5]C[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Si<6>,1|C<3>,1|H<1>}	C[6](N[5,6]Si[5,5]C[5,6])(C[6]C[6]H)(H){2|Cl<1>,1|H<1>,2|C<3>,3|N<3>}	H(C[6]C[6]2)	120.1782	0.076	4	120.3152	0.049	14	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	C[6](N[5,6]Si[5,6]C[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Si<4>,1|C<3>,1|H<1>}	C[6](N[5,6]Si[5,6]C[5,6])(C[6]C[6]H)(H){1|H<1>,1|O<2>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	120.7440	0.000	1	120.7440	0.000	1	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]O)(H)	C[6](N[5,6]C[5,6,6]C[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](N[5,6]C[5,6,6]C[5,6])(C[6]C[6]H)(H){1|C<3>,2|O<2>,3|C<4>}	H(C[6]C[6]2)	119.0470	0.000	1	119.0470	0.000	1	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]N[6]H)(H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>}	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,1|O<2>,2|C<3>}	H(C[6]C[6]2)	120.9720	0.000	1	120.9720	0.000	1	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]N[6]H)(H)	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]N[6]H)(H){1|Ag<5>,1|C<3>,1|N<2>}	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(H){1|C<3>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.3460	0.140	2	120.3115	0.031	11	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]N[6]H)(H)	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]N[6]H)(H){1|C<3>,1|N<2>}	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.3039	0.189	9	120.3115	0.031	11	120.2379	0.290	341	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[5,6]O)(H)	C[6](N[5,6]C[5,6,6]C[5,6a])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[5,6]O)(H){1|C<4>,2|C<3>}	C[6](N[5,6]C[5,6,6]C[5,6a])(C[6]C[6]H)(O){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	118.7930	0.000	1	118.7930	0.000	1	118.2023	0.148	7	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[5,6]O)(H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[5,6]O)(H){2|C<3>,2|C<4>,2|H<1>}	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(O){1|C<3>,3|C<4>,3|H<1>}	H(C[6]C[6]2)	118.4560	0.061	2	118.4560	0.004	2	118.2023	0.148	7	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]N[5,6]O)(C[6]N[6]C)(H)	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]N[5,6]O)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(O){1|C<3>,1|C<4>,2|N<3>}	H(C[6]C[6]2)	117.9000	0.242	2	117.9278	0.035	4	118.2023	0.148	7	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]N[5,6]O)(C[6]N[6]C)(H)	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]N[5,6]O)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|N<2>}	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(O){1|C<3>,1|C<4>,2|N<3>}	H(C[6]C[6]2)	117.9555	0.210	2	117.9278	0.035	4	118.2023	0.148	7	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]N[5a,6]H)(H)	C[6](N[5a,6]C[5a,6,6a]B[5a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]N[5a,6]H)(H){1|B<4>,2|C<3>}	C[6](N[5a,6]C[5a,6,6a]B[5a])(C[6]C[6]H)(H){1|C<4>,1|O<2>,4|C<3>}	H(C[6]C[6]2)	119.2495	0.148	2	119.2495	0.022	2	119.5237	1.263	93	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[5a,6]H)(H)	C[6](N[5a,6]C[5a,6,6a]B[5,5a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[5a,6]H)(H){1|B<4>,2|C<3>}	C[6](N[5a,6]C[5a,6,6a]B[5,5a])(C[6]C[6]H)(H){1|H<1>,1|O<2>,4|C<3>}	H(C[6]C[6]2)	119.5540	0.159	3	118.9963	1.261	4	119.5237	1.263	93	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[5a,6]H)(H)	C[6](N[5a,6]C[5a,6,6a]B[5,5a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[5a,6]H)(H){1|B<4>,2|C<3>}	C[6](N[5a,6]C[5a,6,6a]B[5,5a])(C[6]C[6]H)(H){1|H<1>,2|O<2>,3|C<3>}	H(C[6]C[6]2)	117.3230	0.000	1	118.9963	1.261	4	119.5237	1.263	93	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[5a,6]H)(H)	C[6](N[5a,6]C[5a,6,6a]B[5a,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[5a,6]H)(H){1|B<4>,2|C<3>}	C[6](N[5a,6]C[5a,6,6a]B[5a,6])(C[6]C[6]H)(H){1|H<1>,1|O<2>,4|C<3>}	H(C[6]C[6]2)	119.4796	0.082	7	119.4796	0.007	7	119.5237	1.263	93	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[5a,6]H)(H)	C[6](N[5a,6]C[5a,6,6a]B[5a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[5a,6]H)(H){1|B<4>,2|C<3>}	C[6](N[5a,6]C[5a,6,6a]B[5a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,4|C<3>}	H(C[6]C[6]2)	119.7745	0.172	6	119.7224	1.007	36	119.5237	1.263	93	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[5a,6]H)(H)	C[6](N[5a,6]C[5a,6,6a]B[5a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[5a,6]H)(H){1|B<4>,2|C<3>}	C[6](N[5a,6]C[5a,6,6a]B[5a])(C[6]C[6]H)(H){1|H<1>,1|O<2>,4|C<3>}	H(C[6]C[6]2)	119.7101	1.140	28	119.7224	1.007	36	119.5237	1.263	93	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[5a,6]H)(H)	C[6](N[5a,6]C[5a,6,6a]B[5a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[5a,6]H)(H){1|B<4>,2|C<3>}	C[6](N[5a,6]C[5a,6,6a]B[5a])(C[6]C[6]H)(H){1|H<1>,2|O<2>,3|C<3>}	H(C[6]C[6]2)	119.7390	0.091	2	119.7224	1.007	36	119.5237	1.263	93	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[5a,6]H)(H)	C[6](N[5a,6]C[5a,6]2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[5a,6]H)(H){5|C<3>}	C[6](N[5a,6]C[5a,6]2)(C[6]C[6]H)(H){1|N<3>,4|C<3>}	H(C[6]C[6]2)	118.4600	0.000	1	118.4600	0.000	1	119.5237	1.263	93	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5a,6]H)(C[6]C[6]C)(H)	C[6](N[5a,6]C[5a,6]2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5a,6]H)(C[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](N[5a,6]C[5a,6]2)(C[6]C[6]H)(H){1|C<4>,4|C<3>}	H(C[6]C[6]2)	119.0405	0.070	2	119.0405	0.005	2	119.5237	1.263	93	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H)	C[6](N[5a,6]B[5,5a]C[5a,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](N[5a,6]B[5,5a]C[5a,6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>,2|O<2>}	H(C[6]C[6]2)	120.9095	0.330	2	120.9095	0.109	2	119.5237	1.263	93	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H)	C[6](N[5a,6]C[5a,5a]C[5a,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](N[5a,6]C[5a,5a]C[5a,6])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.4140	0.000	1	119.4140	0.000	1	119.5237	1.263	93	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H)	C[6](N[5a,6]C[5a,6]2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](N[5a,6]C[5a,6]2)(C[6]C[6]H)(H){1|H<1>,4|C<3>}	H(C[6]C[6]2)	119.7200	0.000	1	119.7200	0.000	1	119.5237	1.263	93	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H)	C[6](N[5a,6]C[5a,6]B[5a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](N[5a,6]C[5a,6]B[5a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	115.2260	0.000	1	119.6212	2.673	13	119.5237	1.263	93	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H)	C[6](N[5a,6]C[5a,6]B[5a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](N[5a,6]C[5a,6]B[5a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	120.3090	0.000	1	119.6212	2.673	13	119.5237	1.263	93	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H)	C[6](N[5a,6]C[5a,6]B[5a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](N[5a,6]C[5a,6]B[5a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>,2|F<1>}	H(C[6]C[6]2)	120.5460	0.165	3	119.6212	2.673	13	119.5237	1.263	93	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H)	C[6](N[5a,6]C[5a,6]B[5a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](N[5a,6]C[5a,6]B[5a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,4|C<3>}	H(C[6]C[6]2)	119.6163	1.206	7	119.6212	2.673	13	119.5237	1.263	93	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H)	C[6](N[5a,6]C[5a,6]B[5a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](N[5a,6]C[5a,6]B[5a])(C[6]C[6]H)(H){2|Cl<1>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.5890	0.000	1	119.6212	2.673	13	119.5237	1.263	93	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H)	C[6](N[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	C[6](N[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.7940	0.000	1	119.3652	1.329	20	119.5237	1.263	93	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H)	C[6](N[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](N[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<2>,2|N<2>}	H(C[6]C[6]2)	119.8510	0.000	1	119.3652	1.329	20	119.5237	1.263	93	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H)	C[6](N[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](N[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H){1|C<3>,1|N<2>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.2420	0.000	1	119.3652	1.329	20	119.5237	1.263	93	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H)	C[6](N[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](N[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.9780	0.628	2	119.3652	1.329	20	119.5237	1.263	93	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H)	C[6](N[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](N[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	119.4630	0.000	1	119.3652	1.329	20	119.5237	1.263	93	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H)	C[6](N[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](N[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	119.4520	0.000	1	119.3652	1.329	20	119.5237	1.263	93	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H)	C[6](N[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](N[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H){1|Ir<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.5288	0.352	5	119.3652	1.329	20	119.5237	1.263	93	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H)	C[6](N[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](N[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	118.4480	2.548	4	119.3652	1.329	20	119.5237	1.263	93	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H)	C[6](N[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](N[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.6685	0.091	2	119.3652	1.329	20	119.5237	1.263	93	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H)	C[6](N[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](N[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H){1|Re<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.3865	0.045	2	119.3652	1.329	20	119.5237	1.263	93	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H)	C[6](N[5a,6]C[5a,6]N[5a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](N[5a,6]C[5a,6]N[5a])(C[6]C[6]H)(H){1|H<1>,3|C<3>}	H(C[6]C[6]2)	116.2310	0.000	1	116.2310	0.000	1	119.5237	1.263	93	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H)	C[6](N[5a,6]C[5a,6]S[5a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	C[6](N[5a,6]C[5a,6]S[5a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,2|C<3>}	H(C[6]C[6]2)	119.6800	0.000	1	119.6800	0.000	1	119.5237	1.263	93	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H)	C[6](N[5a,6]C[5a,6a]C[5a,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	C[6](N[5a,6]C[5a,6a]C[5a,6])(C[6]C[6]H)(H){1|H<1>,1|N<2>,3|C<3>}	H(C[6]C[6]2)	119.4540	0.000	1	119.5350	0.013	2	119.5237	1.263	93	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H)	C[6](N[5a,6]C[5a,6a]C[5a,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](N[5a,6]C[5a,6a]C[5a,6])(C[6]C[6]H)(H){1|H<1>,4|C<3>}	H(C[6]C[6]2)	119.6160	0.000	1	119.5350	0.013	2	119.5237	1.263	93	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]N[6,6]Cl)(C[6]C[6]H)(H)	C[6](N[6,6]C[6,6]B[6])(C[6]C[6]H)(Cl)	H(C[6]C[6]2)	C[6](C[6]N[6,6]Cl)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](N[6,6]C[6,6]B[6])(C[6]C[6]H)(Cl){1|C<3>,1|H<1>,1|N<2>,1|N<3>,2|F<1>}	H(C[6]C[6]2)	120.7270	0.000	1	120.7270	0.000	1	120.7270	0.000	1	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6,6]H)(H)	C[6](N[6,6]C[6,6,6a]B[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6,6]H)(H){1|B<4>,2|C<3>}	C[6](N[6,6]C[6,6,6a]B[6])(C[6]C[6]H)(H){1|F<1>,1|H<1>,1|O<2>,3|C<3>}	H(C[6]C[6]2)	120.3740	0.000	1	116.8520	24.809	2	120.3665	0.749	194	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6,6]H)(H)	C[6](N[6,6]C[6,6,6a]B[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6,6]H)(H){1|B<4>,2|C<3>}	C[6](N[6,6]C[6,6,6a]B[6])(C[6]C[6]H)(H){1|H<1>,1|O<2>,4|C<3>}	H(C[6]C[6]2)	113.3300	0.000	1	116.8520	24.809	2	120.3665	0.749	194	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6,6]H)(H)	C[6](N[6,6]C[6,6,6a]C[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6,6]H)(H){1|C<4>,2|C<3>}	C[6](N[6,6]C[6,6,6a]C[5,6])(C[6]C[6]H)(H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.2950	0.000	1	120.2950	0.000	1	120.3665	0.749	194	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6,6]H)(H)	C[6](N[6,6]C[6,6,6a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6,6]H)(H){1|C<4>,2|C<3>}	C[6](N[6,6]C[6,6,6a]C[6])(C[6]C[6]H)(H){1|C<4>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	120.2496	0.979	7	120.2216	0.828	8	120.3665	0.749	194	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6,6]H)(H)	C[6](N[6,6]C[6,6,6a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6,6]H)(H){3|C<3>}	C[6](N[6,6]C[6,6,6a]C[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.0260	0.000	1	120.2216	0.828	8	120.3665	0.749	194	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6,6]H)(H)	C[6](N[6,6]C[6,6,6a]Ga[6,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6,6]H)(H){1|Ga<4>,2|C<3>}	C[6](N[6,6]C[6,6,6a]Ga[6,6])(C[6]C[6]H)(H){1|Cl<1>,1|Cl<2>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.9630	0.163	2	120.9630	0.026	2	120.3665	0.749	194	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6,6]H)(H)	C[6](N[6,6]C[6,6,6a]O[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6,6]H)(H){1|O<2>,2|C<3>}	C[6](N[6,6]C[6,6,6a]O[6])(C[6]C[6]H)(H){1|B<4>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.7500	0.000	1	119.7500	0.000	1	120.3665	0.749	194	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]C[6]C)(H)	C[6](N[6,6]C[6,6]B[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]C[6]C)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](N[6,6]C[6,6]B[6])(C[6]C[6]H)(H){1|C<4>,1|F<1>,1|O<2>,3|C<3>}	H(C[6]C[6]2)	120.1360	0.000	1	120.1360	0.000	1	120.3665	0.749	194	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]C[6]C)(H)	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]C[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.9891	0.135	8	120.0423	0.039	15	120.3665	0.749	194	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]C[6]C)(H)	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]C[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(H){2|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	120.1030	0.248	7	120.0423	0.039	15	120.3665	0.749	194	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]C[6]C)(H)	C[6](N[6,6]C[6,6]S[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|S<4>}	C[6](N[6,6]C[6,6]S[6])(C[6]C[6]H)(H){1|C<4>,1|N<2>,2|C<3>,2|O<1>}	H(C[6]C[6]2)	119.7950	0.000	1	119.7950	0.000	1	120.3665	0.749	194	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	C[6](N[6,6]B[3x6]C[6,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](N[6,6]B[3x6]C[6,6])(C[6]C[6]H)(H){1|H<1>,1|O<2>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	120.6290	0.000	1	120.6290	0.000	1	120.3665	0.749	194	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	C[6](N[6,6]B[5,6]C[6,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](N[6,6]B[5,6]C[6,6])(C[6]C[6]H)(H){1|H<1>,1|O<2>,4|C<3>}	H(C[6]C[6]2)	120.9710	0.000	1	120.8836	0.029	5	120.3665	0.749	194	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	C[6](N[6,6]B[5,6]C[6,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](N[6,6]B[5,6]C[6,6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,3|O<2>}	H(C[6]C[6]2)	120.7350	0.000	1	120.8836	0.029	5	120.3665	0.749	194	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	C[6](N[6,6]B[5,6]C[6,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](N[6,6]B[5,6]C[6,6])(C[6]C[6]H)(H){1|H<1>,2|C<4>,3|C<3>}	H(C[6]C[6]2)	120.9040	0.206	3	120.8836	0.029	5	120.3665	0.749	194	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	C[6](N[6,6]B[5a,6]C[6,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](N[6,6]B[5a,6]C[6,6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,3|O<2>}	H(C[6]C[6]2)	120.8730	0.307	3	120.8730	0.094	3	120.3665	0.749	194	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	C[6](N[6,6]B[6,6]C[6,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](N[6,6]B[6,6]C[6,6])(C[6]C[6]H)(H){1|H<1>,1|O<2>,4|C<3>}	H(C[6]C[6]2)	118.1760	0.775	2	118.1760	0.601	2	120.3665	0.749	194	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	C[6](N[6,6]B[6,6a]C[6,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](N[6,6]B[6,6a]C[6,6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,3|O<2>}	H(C[6]C[6]2)	120.8127	0.118	3	120.8127	0.014	3	120.3665	0.749	194	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	C[6](N[6,6]C[5,6]C[6,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](N[6,6]C[5,6]C[6,6])(C[6]C[6]H)(H){1|C<3>,1|N<2>,2|H<1>,2|N<3>}	H(C[6]C[6]2)	120.2010	0.000	1	120.2010	0.000	1	120.3665	0.749	194	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	C[6](N[6,6]C[5a,6]C[6,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](N[6,6]C[5a,6]C[6,6])(C[6]C[6]H)(H){1|H<1>,1|S<2>,3|C<3>}	H(C[6]C[6]2)	120.0220	0.000	1	120.0220	0.000	1	120.3665	0.749	194	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	C[6](N[6,6]C[6,6]2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](N[6,6]C[6,6]2)(C[6]C[6]H)(H){1|H<1>,5|C<3>}	H(C[6]C[6]2)	120.4860	0.000	1	120.0130	0.447	2	120.3665	0.749	194	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	C[6](N[6,6]C[6,6]2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](N[6,6]C[6,6]2)(C[6]C[6]H)(H){1|C<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.5400	0.000	1	120.0130	0.447	2	120.3665	0.749	194	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	C[6](N[6,6]C[6,6]B[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|C<4>}	C[6](N[6,6]C[6,6]B[6])(C[6]C[6]H)(H){1|F<1>,1|H<1>,1|O<2>,3|C<3>}	H(C[6]C[6]2)	120.8290	0.000	1	120.6560	0.086	78	120.3665	0.749	194	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	C[6](N[6,6]C[6,6]B[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](N[6,6]C[6,6]B[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|O<2>,2|F<1>}	H(C[6]C[6]2)	120.4470	0.000	1	120.6560	0.086	78	120.3665	0.749	194	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	C[6](N[6,6]C[6,6]B[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](N[6,6]C[6,6]B[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>,1|N<3>,2|F<1>}	H(C[6]C[6]2)	120.5846	0.124	7	120.6560	0.086	78	120.3665	0.749	194	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	C[6](N[6,6]C[6,6]B[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](N[6,6]C[6,6]B[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>,1|O<2>,2|F<1>}	H(C[6]C[6]2)	120.7296	0.229	5	120.6560	0.086	78	120.3665	0.749	194	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	C[6](N[6,6]C[6,6]B[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](N[6,6]C[6,6]B[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>,3|C<4>}	H(C[6]C[6]2)	120.5673	0.169	6	120.6560	0.086	78	120.3665	0.749	194	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	C[6](N[6,6]C[6,6]B[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](N[6,6]C[6,6]B[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<2>,3|C<3>}	H(C[6]C[6]2)	120.6320	0.122	3	120.6560	0.086	78	120.3665	0.749	194	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	C[6](N[6,6]C[6,6]B[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](N[6,6]C[6,6]B[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,2|C<3>,2|F<1>}	H(C[6]C[6]2)	120.6710	0.000	1	120.6560	0.086	78	120.3665	0.749	194	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	C[6](N[6,6]C[6,6]B[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](N[6,6]C[6,6]B[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,2|C<3>,2|I<1>}	H(C[6]C[6]2)	120.3960	0.000	1	120.6560	0.086	78	120.3665	0.749	194	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	C[6](N[6,6]C[6,6]B[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](N[6,6]C[6,6]B[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,4|C<3>}	H(C[6]C[6]2)	120.7622	0.158	4	120.6560	0.086	78	120.3665	0.749	194	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	C[6](N[6,6]C[6,6]B[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](N[6,6]C[6,6]B[6])(C[6]C[6]H)(H){1|F<1>,1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.8430	0.000	1	120.6560	0.086	78	120.3665	0.749	194	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	C[6](N[6,6]C[6,6]B[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](N[6,6]C[6,6]B[6])(C[6]C[6]H)(H){1|F<1>,1|H<1>,1|O<2>,3|C<3>}	H(C[6]C[6]2)	120.6405	0.250	2	120.6560	0.086	78	120.3665	0.749	194	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	C[6](N[6,6]C[6,6]B[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](N[6,6]C[6,6]B[6])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.6260	0.000	1	120.6560	0.086	78	120.3665	0.749	194	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	C[6](N[6,6]C[6,6]B[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](N[6,6]C[6,6]B[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<2>,3|C<3>}	H(C[6]C[6]2)	120.5820	0.000	1	120.6560	0.086	78	120.3665	0.749	194	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	C[6](N[6,6]C[6,6]B[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](N[6,6]C[6,6]B[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	120.8570	0.000	1	120.6560	0.086	78	120.3665	0.749	194	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	C[6](N[6,6]C[6,6]B[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](N[6,6]C[6,6]B[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>,2|F<1>}	H(C[6]C[6]2)	120.6434	0.404	27	120.6560	0.086	78	120.3665	0.749	194	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	C[6](N[6,6]C[6,6]B[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](N[6,6]C[6,6]B[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,4|C<3>}	H(C[6]C[6]2)	120.7344	0.218	5	120.6560	0.086	78	120.3665	0.749	194	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	C[6](N[6,6]C[6,6]B[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](N[6,6]C[6,6]B[6])(C[6]C[6]H)(H){1|H<1>,1|O<2>,2|C<3>,2|F<1>}	H(C[6]C[6]2)	120.7868	0.113	6	120.6560	0.086	78	120.3665	0.749	194	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	C[6](N[6,6]C[6,6]B[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](N[6,6]C[6,6]B[6])(C[6]C[6]H)(H){1|H<1>,1|O<2>,4|C<3>}	H(C[6]C[6]2)	120.9300	0.232	2	120.6560	0.086	78	120.3665	0.749	194	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	C[6](N[6,6]C[6,6]B[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](N[6,6]C[6,6]B[6])(C[6]C[6]H)(H){2|Br<1>,1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.8040	0.000	1	120.6560	0.086	78	120.3665	0.749	194	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	C[6](N[6,6]C[6,6]B[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|O<2>}	C[6](N[6,6]C[6,6]B[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>,1|N<3>,2|F<1>}	H(C[6]C[6]2)	120.0585	0.128	2	120.6560	0.086	78	120.3665	0.749	194	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>,3|H<1>}	H(C[6]C[6]2)	120.8390	0.000	1	120.1016	1.046	46	120.3665	0.749	194	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<4>,3|H<1>}	H(C[6]C[6]2)	120.3700	0.000	1	120.1016	1.046	46	120.3665	0.749	194	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>,1|O<2>,2|C<4>}	H(C[6]C[6]2)	120.5470	0.000	1	120.1016	1.046	46	120.3665	0.749	194	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>,1|O<2>,2|C<4>}	H(C[6]C[6]2)	116.5600	0.000	1	120.1016	1.046	46	120.3665	0.749	194	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|N<2>,1|N<3>,3|H<1>}	H(C[6]C[6]2)	120.6600	0.171	2	120.1016	1.046	46	120.3665	0.749	194	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<4>,1|O<1>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2260	0.000	1	120.1016	1.046	46	120.3665	0.749	194	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<4>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	120.2945	0.974	25	120.1016	1.046	46	120.3665	0.749	194	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.9680	0.000	1	120.1016	1.046	46	120.3665	0.749	194	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.0100	0.000	1	120.1016	1.046	46	120.3665	0.749	194	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|Rh<9>,1|H<1>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	120.7720	0.000	1	120.1016	1.046	46	120.3665	0.749	194	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>}	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	121.2770	0.000	1	120.1016	1.046	46	120.3665	0.749	194	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|Cl<1>,2|C<3>}	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,2|N<2>}	H(C[6]C[6]2)	120.0410	0.000	1	120.1016	1.046	46	120.3665	0.749	194	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.2845	0.695	2	120.1016	1.046	46	120.3665	0.749	194	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,4|C<3>}	H(C[6]C[6]2)	120.1010	0.000	1	120.1016	1.046	46	120.3665	0.749	194	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|N<3>,2|C<3>}	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	118.3320	0.000	1	120.1016	1.046	46	120.3665	0.749	194	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|O<2>,2|C<3>}	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>,2|C<3>}	H(C[6]C[6]2)	119.2445	0.336	4	120.1016	1.046	46	120.3665	0.749	194	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|O<3>,2|C<3>}	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>,2|C<3>}	H(C[6]C[6]2)	119.3990	0.000	1	120.1016	1.046	46	120.3665	0.749	194	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	C[6](N[6,6]C[6,6]Ga[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|Ga<4>,1|C<3>,1|H<1>}	C[6](N[6,6]C[6,6]Ga[6])(C[6]C[6]H)(H){2|Cl<1>,1|C<3>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3675	0.192	2	120.5335	0.055	4	120.3665	0.749	194	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	C[6](N[6,6]C[6,6]Ga[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|Ga<5>,1|C<3>,1|H<1>}	C[6](N[6,6]C[6,6]Ga[6])(C[6]C[6]H)(H){2|Cl<1>,1|C<3>,1|C<4>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.6995	0.129	2	120.5335	0.055	4	120.3665	0.749	194	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	C[6](N[6,6]C[6,6]Ge[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|Ge<3>,1|C<3>,1|H<1>}	C[6](N[6,6]C[6,6]Ge[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>,2|N<3>}	H(C[6]C[6]2)	121.0110	0.000	1	120.7138	0.212	5	120.3665	0.749	194	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	C[6](N[6,6]C[6,6]Ge[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|Ge<3>,1|C<3>,1|H<1>}	C[6](N[6,6]C[6,6]Ge[6])(C[6]C[6]H)(H){1|Cl<1>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	121.0730	0.000	1	120.7138	0.212	5	120.3665	0.749	194	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	C[6](N[6,6]C[6,6]Ge[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|Ge<4>,1|C<3>,1|H<1>}	C[6](N[6,6]C[6,6]Ge[6])(C[6]C[6]H)(H){1|B<4>,1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.9860	0.000	1	120.7138	0.212	5	120.3665	0.749	194	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	C[6](N[6,6]C[6,6]Ge[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|Ge<4>,1|C<3>,1|H<1>}	C[6](N[6,6]C[6,6]Ge[6])(C[6]C[6]H)(H){1|Cl<1>,1|Cu<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.0010	0.000	1	120.7138	0.212	5	120.3665	0.749	194	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	C[6](N[6,6]C[6,6]Ge[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|Ge<4>,1|C<3>,1|H<1>}	C[6](N[6,6]C[6,6]Ge[6])(C[6]C[6]H)(H){1|Fe<5>,1|Ge<3>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.4980	0.000	1	120.7138	0.212	5	120.3665	0.749	194	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	C[6](N[6,6]C[6,6]In[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|In<6>,1|C<3>,1|H<1>}	C[6](N[6,6]C[6,6]In[6])(C[6]C[6]H)(H){3|Cl<1>,1|C<3>,1|C<4>,1|H<1>,1|N<3>,1|O<3>}	H(C[6]C[6]2)	120.6895	0.052	2	120.7540	0.007	4	120.3665	0.749	194	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	C[6](N[6,6]C[6,6]In[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|In<6>,1|C<3>,1|H<1>}	C[6](N[6,6]C[6,6]In[6])(C[6]C[6]H)(H){3|Cl<1>,1|C<3>,1|H<1>,1|O<2>,2|N<3>}	H(C[6]C[6]2)	120.8185	0.042	2	120.7540	0.007	4	120.3665	0.749	194	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	C[6](N[6,6]C[6,6]Nb[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|Nb<6>,1|C<3>,1|H<1>}	C[6](N[6,6]C[6,6]Nb[6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,5|O<2>}	H(C[6]C[6]2)	120.6540	0.000	1	120.6540	0.000	1	120.3665	0.749	194	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	C[6](N[6,6]C[6,6]O[6,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<3>}	C[6](N[6,6]C[6,6]O[6,6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,3|C<4>}	H(C[6]C[6]2)	118.6410	0.000	1	118.6410	0.000	1	120.3665	0.749	194	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	C[6](N[6,6]C[6,6a]C[6,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](N[6,6]C[6,6a]C[6,6])(C[6]C[6]H)(H){1|H<1>,4|C<3>}	H(C[6]C[6]2)	119.8770	0.532	2	119.8770	0.283	2	120.3665	0.749	194	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	C[6](N[6,6]Ge[5,6]C[6,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|Ge<3>,1|C<3>,1|H<1>}	C[6](N[6,6]Ge[5,6]C[6,6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|N<3>,1|N<4>}	H(C[6]C[6]2)	121.0640	0.000	1	120.9440	0.029	2	120.3665	0.749	194	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	C[6](N[6,6]Ge[5,6]C[6,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|Ge<3>,1|C<3>,1|H<1>}	C[6](N[6,6]Ge[5,6]C[6,6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.8240	0.000	1	120.9440	0.029	2	120.3665	0.749	194	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]N[6]H)(H)	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>}	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<4>,1|N<2>,1|N<4>,3|H<1>}	H(C[6]C[6]2)	121.1440	0.000	1	120.4485	0.967	2	120.3665	0.749	194	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]N[6]H)(H)	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]N[6]H)(H){1|Fe<6>,2|C<3>}	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7530	0.000	1	120.4485	0.967	2	120.3665	0.749	194	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6,6]O)(H)	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6,6]O)(H){1|C<3>,1|H<1>,2|C<4>}	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(O){1|C<4>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	120.8330	0.000	1	120.8330	0.000	1	118.0280	4.321	9	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6,6]O)(H)	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6,6]O)(H){1|C<4>,2|H<1>,3|C<3>}	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(O){1|N<3>,1|O<1>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	118.2010	0.000	1	118.2010	0.000	1	118.0280	4.321	9	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6,6]O)(H)	C[6](N[6,6]C[6,6]S[6])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6,6]O)(H){1|C<4>,1|S<4>,2|C<3>,2|H<1>}	C[6](N[6,6]C[6,6]S[6])(C[6]C[6]H)(O){1|C<4>,1|O<2>,1|P<4>,2|C<3>,2|O<1>}	H(C[6]C[6]2)	118.3820	0.000	1	118.3820	0.000	1	118.0280	4.321	9	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6a]O[6])(C[6]N[6,6]O)(H)	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6a]O[6])(C[6]N[6,6]O)(H){2|C<3>,2|C<4>}	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(O){1|O<2>,2|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	117.2535	1.276	2	117.2535	1.629	2	118.0280	4.321	9	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]N[6,6]O)(C[6]C[6]H)(H)	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]N[6,6]O)(C[6]C[6]H)(H){1|H<1>,1|O<2>,2|C<4>}	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(O){3|C<4>,4|H<1>}	H(C[6]C[6]2)	118.6710	0.000	1	117.1230	10.196	3	118.0280	4.321	9	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]N[6,6]O)(C[6]C[6]H)(H)	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]N[6,6]O)(C[6]C[6]H)(H){2|C<4>,2|H<1>}	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(O){1|C<3>,2|C<4>,4|H<1>}	H(C[6]C[6]2)	113.4510	0.000	1	117.1230	10.196	3	118.0280	4.321	9	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]N[6,6]O)(C[6]C[6]H)(H)	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]N[6,6]O)(C[6]C[6]H)(H){2|C<4>,2|H<1>}	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(O){3|C<4>,4|H<1>}	H(C[6]C[6]2)	119.2470	0.000	1	117.1230	10.196	3	118.0280	4.321	9	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]N[6,6]O)(C[6]N[6]C)(H)	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]N[6,6]O)(C[6]N[6]C)(H){1|Zn<5>,2|C<3>}	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(O){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	118.9600	0.000	1	118.9600	0.000	1	118.0280	4.321	9	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:S-1:	C[6]-3:	C[6](C[6]N[6,6]S)(C[6]C[6]H)(H)	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(S)	H(C[6]C[6]2)	C[6](C[6]N[6,6]S)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(S){1|C<3>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	117.7820	0.000	1	117.7820	0.000	1	117.7820	0.000	1	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6,6a]H)(H)	C[6](N[6,6a]C[6,6a,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6,6a]H)(H){3|C<3>}	C[6](N[6,6a]C[6,6a,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,4|C<3>}	H(C[6]C[6]2)	117.2610	0.000	1	117.2610	0.000	1	119.9878	0.622	21	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6a]H)(C[6]C[6]C)(H)	C[6](N[6,6a]C[6,6a]B[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6a]H)(C[6]C[6]C)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](N[6,6a]C[6,6a]B[6a])(C[6]C[6]H)(H){3|C<3>,3|C<4>}	H(C[6]C[6]2)	120.4465	0.073	2	120.4465	0.005	2	119.9878	0.622	21	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6a]H)(C[6]C[6]H)(H)	C[6](N[6,6a]C[6,6a]2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6a]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](N[6,6a]C[6,6a]2)(C[6]C[6]H)(H){1|H<1>,1|N<2>,3|C<3>}	H(C[6]C[6]2)	119.5650	0.000	1	119.5650	0.000	1	119.9878	0.622	21	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6a]H)(C[6]C[6]H)(H)	C[6](N[6,6a]C[6,6a]B[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6a]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|C<4>}	C[6](N[6,6a]C[6,6a]B[6a])(C[6]C[6]H)(H){1|H<1>,2|C<4>,3|C<3>}	H(C[6]C[6]2)	121.0160	0.000	1	120.8655	0.045	2	119.9878	0.622	21	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6a]H)(C[6]C[6]H)(H)	C[6](N[6,6a]C[6,6a]B[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6a]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](N[6,6a]C[6,6a]B[6a])(C[6]C[6]H)(H){1|H<1>,2|F<1>,3|C<3>}	H(C[6]C[6]2)	120.7150	0.000	1	120.8655	0.045	2	119.9878	0.622	21	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6a]H)(C[6]C[6]H)(H)	C[6](N[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6a]H)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	C[6](N[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|O<2>,2|C<3>}	H(C[6]C[6]2)	120.4350	0.000	1	120.0573	0.076	13	119.9878	0.622	21	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6a]H)(C[6]C[6]H)(H)	C[6](N[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6a]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](N[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,3|C<3>}	H(C[6]C[6]2)	120.1420	0.000	1	120.0573	0.076	13	119.9878	0.622	21	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6a]H)(C[6]C[6]H)(H)	C[6](N[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6a]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](N[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>,2|C<3>}	H(C[6]C[6]2)	119.8940	0.000	1	120.0573	0.076	13	119.9878	0.622	21	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6a]H)(C[6]C[6]H)(H)	C[6](N[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6a]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](N[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|O<1>,3|C<3>}	H(C[6]C[6]2)	120.2120	0.167	2	120.0573	0.076	13	119.9878	0.622	21	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6a]H)(C[6]C[6]H)(H)	C[6](N[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6a]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](N[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,4|C<3>}	H(C[6]C[6]2)	119.7103	0.102	3	120.0573	0.076	13	119.9878	0.622	21	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6a]H)(C[6]C[6]H)(H)	C[6](N[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6a]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](N[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.9687	0.047	3	120.0573	0.076	13	119.9878	0.622	21	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6a]H)(C[6]C[6]H)(H)	C[6](N[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6a]H)(C[6]C[6]H)(H){3|C<3>}	C[6](N[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,4|C<3>}	H(C[6]C[6]2)	120.4065	0.077	2	120.0573	0.076	13	119.9878	0.622	21	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6a]H)(C[6]C[6]H)(H)	C[6](N[6,6a]C[6,6a]Ge[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6a]H)(C[6]C[6]H)(H){1|Ge<3>,1|C<3>,1|H<1>}	C[6](N[6,6a]C[6,6a]Ge[6a])(C[6]C[6]H)(H){1|Mo<9>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.7090	0.000	1	120.7090	0.000	1	119.9878	0.622	21	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6a]H)(C[6]C[6]H)(H)	C[6](N[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6a]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](N[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,3|C<3>}	H(C[6]C[6]2)	118.8400	0.000	1	118.8400	0.000	1	119.9878	0.622	21	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]N[6]Br)(C[6]C[6]H)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(Br)	H(C[6]C[6]2)	C[6](C[6]N[6]Br)(C[6]C[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(Br){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5670	0.348	2	120.5670	0.121	2	121.0431	0.192	27	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]N[6]Br)(C[6]C[6]H)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(Br)	H(C[6]C[6]2)	C[6](C[6]N[6]Br)(C[6]C[6]H)(H){1|Fe<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(Br){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	121.2480	0.000	1	121.2510	0.558	5	121.0431	0.192	27	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]N[6]Br)(C[6]C[6]H)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(Br)	H(C[6]C[6]2)	C[6](C[6]N[6]Br)(C[6]C[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(Br){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	122.3980	0.000	1	121.2510	0.558	5	121.0431	0.192	27	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]N[6]Br)(C[6]C[6]H)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(Br)	H(C[6]C[6]2)	C[6](C[6]N[6]Br)(C[6]C[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(Br){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.8697	0.490	3	121.2510	0.558	5	121.0431	0.192	27	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]N[6]Br)(C[6]C[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(Br)	H(C[6]C[6]2)	C[6](C[6]N[6]Br)(C[6]C[6]H)(H){1|Ir<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(Br){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.8680	0.000	1	120.8305	0.003	2	121.0431	0.192	27	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]N[6]Br)(C[6]C[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(Br)	H(C[6]C[6]2)	C[6](C[6]N[6]Br)(C[6]C[6]H)(H){1|Ir<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(Br){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7930	0.000	1	120.8305	0.003	2	121.0431	0.192	27	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]N[6]Br)(C[6]C[6]H)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(Br)	H(C[6]C[6]2)	C[6](C[6]N[6]Br)(C[6]C[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(Br){1|H<1>,2|C<3>}	H(C[6]C[6]2)	121.1690	0.202	8	121.1690	0.041	8	121.0431	0.192	27	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]N[6]Br)(C[6]C[6]H)(H)	C[6](N[6]C[6]Os)(C[6]C[6]H)(Br)	H(C[6]C[6]2)	C[6](C[6]N[6]Br)(C[6]C[6]H)(H){1|Os<9>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Os)(C[6]C[6]H)(Br){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.2960	0.000	1	120.2960	0.000	1	121.0431	0.192	27	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]N[6]Br)(C[6]C[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(Br)	H(C[6]C[6]2)	C[6](C[6]N[6]Br)(C[6]C[6]H)(H){1|Ru<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(Br){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.9988	0.276	4	121.0517	0.114	9	121.0431	0.192	27	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]N[6]Br)(C[6]C[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(Br)	H(C[6]C[6]2)	C[6](C[6]N[6]Br)(C[6]C[6]H)(H){1|Ru<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(Br){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	121.3617	0.027	3	121.0517	0.114	9	121.0431	0.192	27	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]N[6]Br)(C[6]C[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(Br)	H(C[6]C[6]2)	C[6](C[6]N[6]Br)(C[6]C[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(Br){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.6925	0.347	2	121.0517	0.114	9	121.0431	0.192	27	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]N[6]Cl)(H)	C[6](N[6]C[5,6]Al)(C[6]C[6]H)(Cl)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]N[6]Cl)(H){1|Al<5>,1|C<3>,1|C<4>}	C[6](N[6]C[5,6]Al)(C[6]C[6]H)(Cl){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.4080	0.000	1	120.4080	0.000	1	120.8270	0.414	34	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]Cl)(H)	C[6](N[6]C[6,6a]Co)(C[6]C[6]H)(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]Cl)(H){1|Co<4>,2|C<3>}	C[6](N[6]C[6,6a]Co)(C[6]C[6]H)(Cl){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.7160	0.279	2	120.7160	0.078	2	120.8270	0.414	34	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]Cl)(H)	C[6](N[6]C[6,6a]Re)(C[6]C[6]H)(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]Cl)(H){1|Re<6>,2|C<3>}	C[6](N[6]C[6,6a]Re)(C[6]C[6]H)(Cl){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.9280	0.000	1	120.9280	0.000	1	120.8270	0.414	34	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]Cl)(H)	C[6](N[6]C[6,6a]Zn)(C[6]C[6]H)(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]Cl)(H){1|Zn<5>,2|C<3>}	C[6](N[6]C[6,6a]Zn)(C[6]C[6]H)(Cl){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.9140	0.613	4	120.9140	0.376	4	120.8270	0.414	34	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H)	C[6](N[6]C[6]Al)(C[6]C[6]H)(Cl)	H(C[6]C[6]2)	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H){1|Al<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Al)(C[6]C[6]H)(Cl){1|Cl<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.8230	0.253	4	120.8230	0.064	4	120.8270	0.414	34	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(Cl)	H(C[6]C[6]2)	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(Cl){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.7600	0.246	2	120.7600	0.061	2	120.8270	0.414	34	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(Cl)	H(C[6]C[6]2)	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H){1|Fe<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(Cl){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	121.0240	0.296	2	120.9066	0.839	13	120.8270	0.414	34	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(Cl)	H(C[6]C[6]2)	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(Cl){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	121.2130	0.208	4	120.9066	0.839	13	120.8270	0.414	34	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(Cl)	H(C[6]C[6]2)	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(Cl){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.6980	1.234	7	120.9066	0.839	13	120.8270	0.414	34	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(Cl)	H(C[6]C[6]2)	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(Cl){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.8650	0.000	1	120.9560	0.017	2	120.8270	0.414	34	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(Cl)	H(C[6]C[6]2)	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H){1|Ni<6>,1|C<4>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(Cl){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	121.0470	0.000	1	120.9560	0.017	2	120.8270	0.414	34	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H)	C[6](N[6]C[6]Os)(C[6]C[6]H)(Cl)	H(C[6]C[6]2)	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H){1|Os<9>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Os)(C[6]C[6]H)(Cl){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.3910	0.000	1	120.3910	0.000	1	120.8270	0.414	34	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(Cl)	H(C[6]C[6]2)	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(Cl){1|C<3>,2|H<1>}	H(C[6]C[6]2)	121.1115	0.663	2	121.1115	0.439	2	120.8270	0.414	34	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(Cl)	H(C[6]C[6]2)	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(Cl){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.7120	0.000	1	120.7120	0.000	1	120.8270	0.414	34	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H)	C[6](N[6]N[6]Re)(C[6]C[6]H)(Cl)	H(C[6]C[6]2)	C[6](C[6]N[6]Cl)(C[6]C[6]H)(H){1|Re<6>,1|N<2>,1|O<2>}	C[6](N[6]N[6]Re)(C[6]C[6]H)(Cl){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8590	0.000	1	119.8590	0.000	1	120.8270	0.414	34	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:F-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]F)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(F)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]F)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(F){1|C<3>,1|H<1>,1|P<4>}	H(C[6]C[6]2)	121.6090	0.000	1	121.5927	0.001	3	121.6392	0.046	21	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:F-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]F)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(F)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]F)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(F){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	121.5845	0.047	2	121.5927	0.001	3	121.6392	0.046	21	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:F-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]F)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(F)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]F)(H){1|Fe<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(F){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	122.0770	0.054	2	121.7033	0.057	12	121.6392	0.046	21	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:F-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]F)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(F)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]F)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(F){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	121.7077	0.166	6	121.7033	0.057	12	121.6392	0.046	21	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:F-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]F)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(F)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]F)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(F){1|H<1>,2|C<3>}	H(C[6]C[6]2)	121.5100	0.139	4	121.7033	0.057	12	121.6392	0.046	21	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:F-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]F)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(F)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]F)(H){1|Ir<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(F){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	121.6330	0.098	4	121.6330	0.010	4	121.6392	0.046	21	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:F-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]F)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(F)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]F)(H){1|Ru<9>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(F){1|H<1>,2|C<3>}	H(C[6]C[6]2)	121.3370	0.120	2	121.3370	0.014	2	121.6392	0.046	21	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[3x3,4,3x5,14x6]C[6])(C[6]N[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[3x3,4,3x5,14x6]C[6])(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>,4|B<6>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<5>,2|C<3>}	H(C[6]C[6]2)	120.0683	0.314	3	120.0683	0.099	3	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[5,6]Ag)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Ag<4>,2|C<3>}	C[6](N[6]C[5,6]Ag)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.6915	0.063	2	119.6915	0.004	2	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[5,6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|C<4>,2|C<3>}	C[6](N[6]C[5,6]C)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.9140	0.201	2	119.9140	0.040	2	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[5,6]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Co<6>,2|C<3>}	C[6](N[6]C[5,6]Co)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	121.6649	6.037	8	121.6649	36.441	8	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[5,6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Cu<3>,2|C<3>}	C[6](N[6]C[5,6]Cu)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.1780	0.076	2	119.1654	0.092	12	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[5,6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|C<4>}	C[6](N[6]C[5,6]Cu)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.2640	0.000	1	119.1654	0.092	12	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[5,6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Cu<4>,2|C<3>}	C[6](N[6]C[5,6]Cu)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.1517	0.353	9	119.1654	0.092	12	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](N[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.1780	0.000	1	119.7432	0.119	6	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](N[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.5583	0.363	3	119.7432	0.119	6	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](N[6]C[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.8030	0.187	2	119.7432	0.119	6	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[5,6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|C<4>}	C[6](N[6]C[5,6]Ir)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.3260	0.242	3	119.3260	0.059	3	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[5,6]Ni)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|C<4>}	C[6](N[6]C[5,6]Ni)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.6200	0.123	2	118.9443	0.800	7	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[5,6]Ni)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Ni<6>,2|C<3>}	C[6](N[6]C[5,6]Ni)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	118.6740	0.936	5	118.9443	0.800	7	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[5,6]Pd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|C<4>}	C[6](N[6]C[5,6]Pd)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.8330	0.038	2	120.0279	0.092	10	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[5,6]Pd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|N<2>}	C[6](N[6]C[5,6]Pd)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<4>}	H(C[6]C[6]2)	119.7967	0.097	3	120.0279	0.092	10	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[5,6]Pd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Pd<4>,2|C<3>}	C[6](N[6]C[5,6]Pd)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.2446	0.292	5	120.0279	0.092	10	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[5,6]Pt)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|C<4>}	C[6](N[6]C[5,6]Pt)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.2790	0.078	2	119.0778	0.111	6	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[5,6]Pt)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Ru<10>,1|Pt<4>,2|C<4>}	C[6](N[6]C[5,6]Pt)(C[6]C[6]H)(H){1|Ru<10>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	118.9772	0.377	4	119.0778	0.111	6	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[5,6]Rh)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Rh<4>,1|C<3>,1|C<4>}	C[6](N[6]C[5,6]Rh)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.7580	0.000	1	118.9589	0.111	10	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[5,6]Rh)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Rh<4>,2|C<3>}	C[6](N[6]C[5,6]Rh)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.0525	0.128	2	118.9589	0.111	10	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[5,6]Rh)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Rh<6>,2|C<3>}	C[6](N[6]C[5,6]Rh)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	118.8180	0.178	7	118.9589	0.111	10	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[5,6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|C<4>}	C[6](N[6]C[5,6]Ru)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.2375	0.050	2	118.9262	0.172	18	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[5,6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Ru<6>,2|C<3>}	C[6](N[6]C[5,6]Ru)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	118.9934	0.537	7	118.9262	0.172	18	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[5,6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Ru<8>,1|C<3>,1|C<4>}	C[6](N[6]C[5,6]Ru)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.0315	0.302	4	118.9262	0.172	18	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[5,6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Ru<8>,2|C<3>}	C[6](N[6]C[5,6]Ru)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	118.6234	0.215	5	118.9262	0.172	18	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[5,6]Zn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Zn<4>,2|C<3>}	C[6](N[6]C[5,6]Zn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	118.6700	0.000	1	119.4290	0.562	3	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[5,6]Zn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Zn<6>,2|C<3>}	C[6](N[6]C[5,6]Zn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.8085	0.510	2	119.4290	0.562	3	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]N[5])(C[6]N[6]H)(H)	C[6](N[6]C[5,6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]N[5])(C[6]N[6]H)(H){1|Fe<10>,1|C<3>,4|C<4>}	C[6](N[6]C[5,6]C)(C[6]C[6]H)(H){1|Fe<10>,1|N<3>,2|C<4>}	H(C[6]C[6]2)	118.6290	0.000	1	118.6290	0.000	1	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]O)(C[6]N[6]H)(H)	C[6](N[6]C[5,6]S)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]O)(C[6]N[6]H)(H){1|Fe<10>,1|S<4>,2|C<4>}	C[6](N[6]C[5,6]S)(C[6]C[6]H)(H){1|Fe<10>,1|O<1>,2|C<4>}	H(C[6]C[6]2)	117.8895	0.503	2	117.8895	0.253	2	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H)	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H){1|Cd<6>,1|C<3>,1|H<1>,2|N<2>}	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.0070	0.252	2	120.3098	0.369	5	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H)	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H){1|Cd<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5117	0.744	3	120.3098	0.369	5	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>,2|N<2>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.1478	0.874	4	120.2440	0.348	8	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3402	0.149	4	120.2440	0.348	8	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.6600	0.226	2	120.6600	0.051	2	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.8575	1.920	2	119.8575	3.686	2	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>,2|N<2>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.0380	0.116	2	120.1040	0.077	6	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3250	0.322	2	120.1040	0.077	6	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H){1|Ni<6>,1|H<1>,1|S<2>,2|C<3>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.9490	0.338	2	120.1040	0.077	6	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H){1|Pd<4>,1|H<1>,1|S<2>,2|C<3>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.1334	0.499	21	120.1334	0.249	21	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.4940	0.231	2	120.4940	0.053	2	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H){1|Zn<4>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3765	0.350	2	120.5263	0.114	8	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H){1|Zn<6>,1|C<3>,1|H<1>,2|N<2>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.2255	0.012	2	120.5263	0.114	8	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H){1|Zn<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.7515	0.286	4	120.5263	0.114	8	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[5a,6]B)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H){1|B<4>,2|C<3>}	C[6](N[6]C[5a,6]B)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7710	0.000	1	119.6665	0.022	2	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[5a,6]B)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H){1|B<5>,2|C<3>}	C[6](N[6]C[5a,6]B)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.5620	0.000	1	119.6665	0.022	2	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[5a,6]B[5a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|O<2>}	C[6](N[6]C[5a,6]B[5a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,3|O<2>}	H(C[6]C[6]2)	119.2860	0.000	1	119.2860	0.000	1	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[5a,6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|N<3>}	C[6](N[6]C[5a,6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.1380	0.000	1	119.1380	0.000	1	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[5a,6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H){1|Cu<4>,2|C<3>}	C[6](N[6]C[5a,6]Cu)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.6560	0.183	7	119.6885	0.037	8	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[5a,6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H){1|Cu<5>,2|C<3>}	C[6](N[6]C[5a,6]Cu)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9160	0.000	1	119.6885	0.037	8	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[5a,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](N[6]C[5a,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	119.3430	0.000	1	120.3368	4.332	5	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[5a,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](N[6]C[5a,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5853	2.316	4	120.3368	4.332	5	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[5a,6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H){1|Ir<6>,2|C<3>}	C[6](N[6]C[5a,6]Ir)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.4680	0.144	2	119.7070	0.084	4	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[5a,6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H){1|Ir<7>,2|C<3>}	C[6](N[6]C[5a,6]Ir)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9460	0.041	2	119.7070	0.084	4	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[5a,6]Li)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H){1|Li<4>,2|C<3>}	C[6](N[6]C[5a,6]Li)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9157	0.145	7	119.9284	0.019	8	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[5a,6]Li)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H){1|Li<4>,2|C<3>}	C[6](N[6]C[5a,6]Li)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<4>}	H(C[6]C[6]2)	120.0170	0.000	1	119.9284	0.019	8	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[5a,6]Pd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H){1|Pd<4>,2|C<3>}	C[6](N[6]C[5a,6]Pd)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7196	0.431	13	119.7196	0.186	13	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[5a,6]Pt)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H){1|Pt<4>,2|C<3>}	C[6](N[6]C[5a,6]Pt)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8727	0.346	23	119.8558	0.107	27	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[5a,6]Pt)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H){1|Pt<5>,2|C<3>}	C[6](N[6]C[5a,6]Pt)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.6060	0.034	2	119.8558	0.107	27	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[5a,6]Pt)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H){1|Pt<6>,2|C<3>}	C[6](N[6]C[5a,6]Pt)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9115	0.165	2	119.8558	0.107	27	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[5a,6]Rh)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H){1|Rh<4>,2|C<3>}	C[6](N[6]C[5a,6]Rh)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.6593	0.570	3	119.7577	0.077	22	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[5a,6]Rh)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H){1|Rh<5>,2|C<3>}	C[6](N[6]C[5a,6]Rh)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0138	0.175	5	119.7577	0.077	22	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[5a,6]Rh)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H){1|Rh<7>,2|C<3>}	C[6](N[6]C[5a,6]Rh)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7547	0.117	10	119.7577	0.077	22	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[5a,6]Rh)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H){1|Rh<8>,2|C<3>}	C[6](N[6]C[5a,6]Rh)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.5190	0.218	4	119.7577	0.077	22	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[5a,6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H){1|Ru<7>,2|C<3>}	C[6](N[6]C[5a,6]Ru)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.5493	0.196	15	119.5398	0.051	21	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[5a,6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H){1|Ru<8>,2|C<3>}	C[6](N[6]C[5a,6]Ru)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.3197	0.255	3	119.5398	0.051	21	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[5a,6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H){1|Ru<9>,2|C<3>}	C[6](N[6]C[5a,6]Ru)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7127	0.235	3	119.5398	0.051	21	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]N)(C[6]N[6]H)(H)	C[6](N[6]C[5a,6]O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]N)(C[6]N[6]H)(H){1|C<3>,1|N<2>,1|O<1>}	C[6](N[6]C[5a,6]O)(C[6]C[6]H)(H){1|C<3>,2|N<3>}	H(C[6]C[6]2)	119.7800	0.000	1	119.7800	0.000	1	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]O)(C[6]N[6]H)(H)	C[6](N[6]C[5a,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]O)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](N[6]C[5a,6]H)(C[6]C[6]H)(H){1|C<3>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	119.7740	0.132	2	119.7740	0.017	2	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H)	C[6](N[6]C[5]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H){1|H<1>,1|S<2>,3|C<3>}	C[6](N[6]C[5]C[6])(C[6]C[6]H)(H){1|H<1>,4|C<3>}	H(C[6]C[6]2)	119.3075	0.220	2	119.3075	0.048	2	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H)	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H){1|Cd<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5012	0.124	4	120.5012	0.015	4	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>,1|N<2>,1|O<2>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5738	0.262	12	120.5280	0.061	16	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>,1|N<2>,1|S<2>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.4620	0.188	2	120.5280	0.061	16	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H){1|Co<6>,1|H<1>,1|N<2>,2|C<3>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3190	0.075	2	120.5280	0.061	16	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>,1|N<2>,1|O<2>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.4975	0.210	2	120.5340	0.042	4	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H){1|Cu<6>,1|C<3>,1|H<1>,1|N<2>,1|S<2>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5705	0.275	2	120.5340	0.042	4	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>,1|N<2>,1|O<2>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.7305	0.105	2	120.7305	0.011	2	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|H<1>,1|N<2>,1|O<2>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.8935	0.234	4	119.8935	0.055	4	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>,1|N<2>,1|O<2>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.2010	0.188	2	120.2010	0.035	2	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>,1|N<2>,1|O<2>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.7665	0.105	2	120.4870	0.114	6	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>,1|N<2>,1|S<2>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5940	0.141	2	120.4870	0.114	6	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>,2|N<2>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.1005	0.245	2	120.4870	0.114	6	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H){1|Pd<4>,1|H<1>,1|N<2>,2|C<3>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.0277	1.219	4	120.0277	1.485	4	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|H<1>,2|N<2>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.2810	0.199	2	120.2940	0.047	4	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H){1|Re<6>,1|H<1>,1|N<2>,2|C<3>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){3|C<3>}	H(C[6]C[6]2)	120.3070	0.317	2	120.2940	0.047	4	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H){1|Zn<4>,1|H<1>,1|N<2>,2|C<3>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.9878	0.587	4	119.9878	0.345	4	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6]Al)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Al<4>,1|C<3>,1|C<4>}	C[6](N[6]C[6,6]Al)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.8980	0.000	1	120.7100	0.027	3	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6]Al)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Al<4>,1|C<3>,1|C<4>}	C[6](N[6]C[6,6]Al)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.6190	0.000	1	120.7100	0.027	3	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6]Al)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Al<5>,1|C<3>,1|C<4>}	C[6](N[6]C[6,6]Al)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.6130	0.000	1	120.7100	0.027	3	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|C<3>,2|C<4>}	C[6](N[6]C[6,6]C)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.1942	0.179	4	120.1942	0.032	4	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6]Cd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Cd<6>,1|C<2>,1|C<3>}	C[6](N[6]C[6,6]Cd)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	118.4900	0.000	1	118.4900	0.000	1	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Co<6>,2|C<3>}	C[6](N[6]C[6,6]Co)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.1713	0.134	3	120.2783	0.102	7	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Co<7>,1|C<3>,1|C<4>}	C[6](N[6]C[6,6]Co)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3585	0.416	4	120.2783	0.102	7	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Cu<3>,2|C<3>}	C[6](N[6]C[6,6]Cu)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6330	0.000	1	118.5391	15.817	7	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Cu<4>,2|C<3>}	C[6](N[6]C[6,6]Cu)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5070	0.000	1	118.5391	15.817	7	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Cu<5>,1|C<2>,1|C<3>}	C[6](N[6]C[6,6]Cu)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	116.2775	7.130	2	118.5391	15.817	7	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Cu<5>,2|C<3>}	C[6](N[6]C[6,6]Cu)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.1750	0.000	1	118.5391	15.817	7	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Cu<5>,2|C<3>}	C[6](N[6]C[6,6]Cu)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	117.4520	4.033	2	118.5391	15.817	7	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](N[6]C[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.5800	0.000	1	120.5640	0.048	8	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](N[6]C[6,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.7655	0.305	2	120.5640	0.048	8	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](N[6]C[6,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.4802	0.176	5	120.5640	0.048	8	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6]Hg)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Hg<6>,2|C<3>}	C[6](N[6]C[6,6]Hg)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.6287	0.467	4	120.6287	0.218	4	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|C<4>}	C[6](N[6]C[6,6]Ir)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.6970	0.000	1	120.3984	0.456	13	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|C<4>}	C[6](N[6]C[6,6]Ir)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3173	0.648	9	120.3984	0.456	13	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|O<2>}	C[6](N[6]C[6,6]Ir)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.7530	0.000	1	120.3984	0.456	13	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Ir<8>,2|C<3>}	C[6](N[6]C[6,6]Ir)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.6330	0.000	1	120.3984	0.456	13	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Ir<8>,2|C<3>}	C[6](N[6]C[6,6]Ir)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.2400	0.000	1	120.3984	0.456	13	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6]Mg)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Mg<5>,1|C<3>,1|C<4>}	C[6](N[6]C[6,6]Mg)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.4665	0.308	2	120.8277	0.259	4	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6]Mg)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Mg<5>,1|C<3>,1|C<4>}	C[6](N[6]C[6,6]Mg)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	121.1890	0.400	2	120.8277	0.259	4	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6]Mn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Mn<6>,2|C<3>}	C[6](N[6]C[6,6]Mn)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.7750	0.000	1	120.4327	0.342	6	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6]Mn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Mn<6>,2|C<3>}	C[6](N[6]C[6,6]Mn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5282	0.623	4	120.4327	0.342	6	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6]Mn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Mn<7>,2|C<3>}	C[6](N[6]C[6,6]Mn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.7080	0.000	1	120.4327	0.342	6	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6]Ni)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Ni<4>,2|C<3>}	C[6](N[6]C[6,6]Ni)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.7830	0.000	1	120.5589	0.103	10	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6]Ni)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Ni<5>,1|C<3>,1|C<4>}	C[6](N[6]C[6,6]Ni)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3766	0.275	5	120.5589	0.103	10	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6]Ni)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|C<4>}	C[6](N[6]C[6,6]Ni)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.7308	0.310	4	120.5589	0.103	10	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6]O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|O<1>}	C[6](N[6]C[6,6]O)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.0863	0.120	3	120.0863	0.014	3	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6]Os)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Os<9>,2|C<3>}	C[6](N[6]C[6,6]Os)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.8980	0.000	1	119.8980	0.000	1	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6]Pd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|C<4>}	C[6](N[6]C[6,6]Pd)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.4743	0.161	3	119.9974	1.512	11	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6]Pd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|N<3>}	C[6](N[6]C[6,6]Pd)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.8765	0.606	2	119.9974	1.512	11	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6]Pd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Pd<4>,2|C<3>}	C[6](N[6]C[6,6]Pd)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.6863	2.128	4	119.9974	1.512	11	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6]Pd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Pd<6>,1|C<3>,1|N<3>}	C[6](N[6]C[6,6]Pd)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.0250	0.115	2	119.9974	1.512	11	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6]Pt)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|C<4>}	C[6](N[6]C[6,6]Pt)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.8705	0.192	2	119.9203	0.142	4	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6]Pt)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Pt<4>,2|C<3>}	C[6](N[6]C[6,6]Pt)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.9700	0.617	2	119.9203	0.142	4	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6]Re)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Re<5>,2|C<3>}	C[6](N[6]C[6,6]Re)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5060	0.000	1	121.1750	0.413	3	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6]Re)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Re<6>,2|C<3>}	C[6](N[6]C[6,6]Re)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	121.5095	0.392	2	121.1750	0.413	3	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6]Rh)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Rh<5>,2|C<3>}	C[6](N[6]C[6,6]Rh)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3210	0.227	5	120.3090	0.057	7	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6]Rh)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Rh<6>,2|C<3>}	C[6](N[6]C[6,6]Rh)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0200	0.000	1	120.3090	0.057	7	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6]Rh)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Rh<8>,2|C<3>}	C[6](N[6]C[6,6]Rh)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5380	0.000	1	120.3090	0.057	7	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Ru<5>,2|C<3>}	C[6](N[6]C[6,6]Ru)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5164	0.427	17	120.4293	0.497	27	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|C<4>}	C[6](N[6]C[6,6]Ru)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.4007	0.352	3	120.4293	0.497	27	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|C<4>}	C[6](N[6]C[6,6]Ru)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.4870	0.000	1	120.4293	0.497	27	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Ru<6>,2|C<3>}	C[6](N[6]C[6,6]Ru)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.8910	1.860	3	120.4293	0.497	27	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Ru<7>,1|C<3>,1|C<4>}	C[6](N[6]C[6,6]Ru)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7740	0.000	1	120.4293	0.497	27	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Ru<8>,2|C<3>}	C[6](N[6]C[6,6]Ru)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.6920	0.000	1	120.4293	0.497	27	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Ru<9>,2|C<3>}	C[6](N[6]C[6,6]Ru)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.9840	0.000	1	120.4293	0.497	27	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6]Zn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Zn<6>,2|C<3>}	C[6](N[6]C[6,6]Zn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.1010	1.830	7	120.1010	3.350	7	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]N[6]H)(H)	C[6](N[6]C[6,6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]N[6]H)(H){1|H<1>,3|C<4>}	C[6](N[6]C[6,6]C)(C[6]C[6]H)(H){1|C<3>,1|O<1>,2|C<4>}	H(C[6]C[6]2)	119.8410	0.000	1	119.8410	0.000	1	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]Br)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]Br)(C[6]N[6]H)(H){1|Cu<4>,2|C<3>}	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(H){1|Br<1>,2|C<3>}	H(C[6]C[6]2)	120.6655	0.293	6	120.6655	0.086	6	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Ag)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H){1|Ag<4>,2|C<3>}	C[6](N[6]C[6,6a]Ag)(C[6]C[6]H)(H){1|C<2>,2|C<3>}	H(C[6]C[6]2)	117.7625	2.088	2	117.7625	4.360	2	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H){1|C<4>,2|C<3>}	C[6](N[6]C[6,6a]C)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	H(C[6]C[6]2)	119.9558	1.081	5	119.5191	0.860	13	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H){1|C<4>,2|C<3>}	C[6](N[6]C[6,6a]C)(C[6]C[6]H)(H){3|C<3>}	H(C[6]C[6]2)	119.2461	0.766	8	119.5191	0.860	13	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Cd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H){1|Cd<6>,2|C<3>}	C[6](N[6]C[6,6a]Cd)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	H(C[6]C[6]2)	119.7100	0.427	2	119.7100	0.182	2	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H){1|Co<6>,2|C<3>}	C[6](N[6]C[6,6a]Co)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	H(C[6]C[6]2)	119.3935	0.141	2	119.3935	0.020	2	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Cr)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H){1|Cr<6>,2|C<3>}	C[6](N[6]C[6,6a]Cr)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	H(C[6]C[6]2)	119.8465	0.204	2	119.8465	0.042	2	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H){1|Cu<4>,2|C<3>}	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	H(C[6]C[6]2)	119.5000	0.359	2	119.8478	0.135	5	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H){1|Cu<5>,2|C<3>}	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(H){3|C<3>}	H(C[6]C[6]2)	120.0797	0.055	3	119.8478	0.135	5	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Fe)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H){1|Fe<6>,2|C<3>}	C[6](N[6]C[6,6a]Fe)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	H(C[6]C[6]2)	119.5950	0.000	1	119.5950	0.000	1	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](N[6]C[6,6a]H)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	H(C[6]C[6]2)	119.7100	0.543	10	119.7972	0.160	27	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](N[6]C[6,6a]H)(C[6]C[6]H)(H){3|C<3>}	H(C[6]C[6]2)	119.8485	0.295	17	119.7972	0.160	27	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H){1|Ir<6>,2|C<3>}	C[6](N[6]C[6,6a]Ir)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	H(C[6]C[6]2)	119.6185	0.039	2	119.6185	0.002	2	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H){1|O<1>,2|C<3>}	C[6](N[6]C[6,6a]O)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	H(C[6]C[6]2)	119.0810	0.000	1	119.0190	0.008	2	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H){1|O<1>,2|C<3>}	C[6](N[6]C[6,6a]O)(C[6]C[6]H)(H){3|C<3>}	H(C[6]C[6]2)	118.9570	0.000	1	119.0190	0.008	2	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Os)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H){1|Os<5>,2|C<3>}	C[6](N[6]C[6,6a]Os)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	H(C[6]C[6]2)	119.7690	0.000	1	119.7690	0.000	1	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Pd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H){1|Pd<4>,2|C<3>}	C[6](N[6]C[6,6a]Pd)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	H(C[6]C[6]2)	120.0040	0.000	1	120.0040	0.000	1	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Pt)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H){1|Pt<4>,2|C<3>}	C[6](N[6]C[6,6a]Pt)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	H(C[6]C[6]2)	119.1800	0.098	3	119.1800	0.010	3	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H){1|Ru<6>,2|C<3>}	C[6](N[6]C[6,6a]Ru)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	H(C[6]C[6]2)	119.2187	1.527	3	119.2187	2.333	3	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Zn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H){1|Zn<6>,2|C<3>}	C[6](N[6]C[6,6a]Zn)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	H(C[6]C[6]2)	119.5420	0.055	2	119.5420	0.003	2	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]C[4])(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C[4])(C[6]N[6]H)(H){1|H<1>,2|C<3>,3|C<4>}	C[6](N[6]C[6,6a]C)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	H(C[6]C[6]2)	116.6910	0.000	1	116.6910	0.000	1	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]C[4])(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C[4])(C[6]N[6]H)(H){2|C<3>,2|C<4>,2|H<1>}	C[6](N[6]C[6,6a]H)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	H(C[6]C[6]2)	119.7245	1.051	2	119.7245	1.106	2	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]C[6])(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Pd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C[6])(C[6]N[6]H)(H){1|Pd<4>,4|C<3>}	C[6](N[6]C[6,6a]Pd)(C[6]C[6]H)(H){3|C<3>}	H(C[6]C[6]2)	119.7060	0.000	1	119.7060	0.000	1	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]C[6a])(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C[6a])(C[6]N[6]H)(H){1|Cu<4>,4|C<3>}	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(H){3|C<3>}	H(C[6]C[6]2)	119.7680	0.173	7	119.7680	0.030	7	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]C[6a])(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C[6a])(C[6]N[6]H)(H){1|H<1>,4|C<3>}	C[6](N[6]C[6,6a]H)(C[6]C[6]H)(H){3|C<3>}	H(C[6]C[6]2)	119.8365	0.125	2	119.8365	0.016	2	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]C[6a])(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Hg)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C[6a])(C[6]N[6]H)(H){1|Hg<4>,4|C<3>}	C[6](N[6]C[6,6a]Hg)(C[6]C[6]H)(H){3|C<3>}	H(C[6]C[6]2)	119.6295	0.630	2	119.6295	0.397	2	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]C[6a])(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C[6a])(C[6]N[6]H)(H){1|Ir<6>,4|C<3>}	C[6](N[6]C[6,6a]Ir)(C[6]C[6]H)(H){3|C<3>}	H(C[6]C[6]2)	119.1645	0.323	2	119.1645	0.104	2	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]C[6a])(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Mo)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C[6a])(C[6]N[6]H)(H){1|Mo<6>,4|C<3>}	C[6](N[6]C[6,6a]Mo)(C[6]C[6]H)(H){3|C<3>}	H(C[6]C[6]2)	119.6470	0.006	2	119.6470	0.000	2	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]C[6a])(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Os)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C[6a])(C[6]N[6]H)(H){1|Os<6>,4|C<3>}	C[6](N[6]C[6,6a]Os)(C[6]C[6]H)(H){3|C<3>}	H(C[6]C[6]2)	119.4952	0.165	4	119.4952	0.027	4	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]C[6a])(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Pt)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C[6a])(C[6]N[6]H)(H){1|Pt<4>,4|C<3>}	C[6](N[6]C[6,6a]Pt)(C[6]C[6]H)(H){3|C<3>}	H(C[6]C[6]2)	119.5643	1.178	14	119.5643	1.387	14	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]C[6a])(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C[6a])(C[6]N[6]H)(H){1|Ru<6>,4|C<3>}	C[6](N[6]C[6,6a]Ru)(C[6]C[6]H)(H){3|C<3>}	H(C[6]C[6]2)	119.7195	0.196	2	119.4945	0.081	4	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]C[6a])(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C[6a])(C[6]N[6]H)(H){1|Ru<8>,4|C<3>}	C[6](N[6]C[6,6a]Ru)(C[6]C[6]H)(H){3|C<3>}	H(C[6]C[6]2)	119.2695	0.029	2	119.4945	0.081	4	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]C[6a])(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Sn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C[6a])(C[6]N[6]H)(H){1|Sn<6>,4|C<3>}	C[6](N[6]C[6,6a]Sn)(C[6]C[6]H)(H){3|C<3>}	H(C[6]C[6]2)	119.8565	0.045	2	119.8565	0.002	2	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]Cl)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]Cl)(C[6]N[6]H)(H){1|Ru<6>,2|C<3>}	C[6](N[6]C[6,6a]Ru)(C[6]C[6]H)(H){1|Cl<1>,2|C<3>}	H(C[6]C[6]2)	120.0232	0.324	5	120.0232	0.105	5	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Ag)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ag<3>,2|C<3>}	C[6](N[6]C[6,6a]Ag)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.4802	0.365	5	120.4322	0.140	23	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Ag)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ag<4>,2|C<3>}	C[6](N[6]C[6,6a]Ag)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3824	0.385	16	120.4322	0.140	23	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Ag)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ag<5>,2|C<3>}	C[6](N[6]C[6,6a]Ag)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.7110	0.334	2	120.4322	0.140	23	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Al)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Al<4>,2|C<3>}	C[6](N[6]C[6,6a]Al)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.6903	1.510	4	119.7160	1.319	17	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Al)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Al<5>,2|C<3>}	C[6](N[6]C[6,6a]Al)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.2540	0.230	3	119.7160	1.319	17	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Al)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Al<6>,1|C<3>,1|N<2>}	C[6](N[6]C[6,6a]Al)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.8397	0.085	3	119.7160	1.319	17	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Al)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Al<6>,2|C<3>}	C[6](N[6]C[6,6a]Al)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.4471	1.456	7	119.7160	1.319	17	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Au)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Au<4>,2|C<3>}	C[6](N[6]C[6,6a]Au)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.6620	0.000	1	119.6250	0.003	2	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Au)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Au<5>,2|C<3>}	C[6](N[6]C[6,6a]Au)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.5880	0.000	1	119.6250	0.003	2	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]B)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|B<4>,2|C<3>}	C[6](N[6]C[6,6a]B)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.6223	0.177	4	120.6223	0.031	4	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Ba)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ba<8>,2|C<3>}	C[6](N[6]C[6,6a]Ba)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.6573	0.488	7	120.6573	0.238	7	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Bi)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Bi<6>,2|C<3>}	C[6](N[6]C[6,6a]Bi)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5556	0.335	9	120.5556	0.112	9	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|C<4>,2|C<3>}	C[6](N[6]C[6,6a]C)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.2897	0.537	61	120.2897	0.288	61	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Ca)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ca<7>,2|C<3>}	C[6](N[6]C[6,6a]Ca)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.6322	0.173	4	120.5880	0.060	8	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Ca)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ca<8>,2|C<3>}	C[6](N[6]C[6,6a]Ca)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5438	0.323	4	120.5880	0.060	8	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Cd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Cd<5>,2|C<3>}	C[6](N[6]C[6,6a]Cd)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.4630	0.220	5	120.4787	0.119	122	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Cd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Cd<6>,2|C<3>}	C[6](N[6]C[6,6a]Cd)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5004	0.368	96	120.4787	0.119	122	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Cd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Cd<7>,2|C<3>}	C[6](N[6]C[6,6a]Cd)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3838	0.251	18	120.4787	0.119	122	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Cd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Cd<8>,2|C<3>}	C[6](N[6]C[6,6a]Cd)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3813	0.114	3	120.4787	0.119	122	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Cm)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Cm<8>,2|C<3>}	C[6](N[6]C[6,6a]Cm)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.6100	0.420	2	120.6100	0.176	2	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Co<4>,2|C<3>}	C[6](N[6]C[6,6a]Co)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.9385	1.305	13	120.1632	0.600	413	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Co<5>,2|C<3>}	C[6](N[6]C[6,6a]Co)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.2748	0.222	10	120.1632	0.600	413	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Co<6>,2|C<3>}	C[6](N[6]C[6,6a]Co)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.1746	0.786	362	120.1632	0.600	413	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Co<7>,2|C<3>}	C[6](N[6]C[6,6a]Co)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.0622	0.293	26	120.1632	0.600	413	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Co<8>,2|C<3>}	C[6](N[6]C[6,6a]Co)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3185	0.026	2	120.1632	0.600	413	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Cr)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Cr<5>,2|C<3>}	C[6](N[6]C[6,6a]Cr)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.2880	0.000	1	120.1348	0.801	75	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Cr)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Cr<6>,2|C<3>}	C[6](N[6]C[6,6a]Cr)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.2798	0.365	65	120.1348	0.801	75	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Cr)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Cr<8>,1|C<3>,1|N<2>}	C[6](N[6]C[6,6a]Cr)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.9980	0.037	2	120.1348	0.801	75	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Cr)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Cr<8>,2|C<3>}	C[6](N[6]C[6,6a]Cr)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	118.8056	2.481	7	120.1348	0.801	75	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Cu<3>,2|C<3>}	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.2584	0.273	13	120.1125	0.805	635	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Cu<4>,2|C<3>}	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.2686	0.664	218	120.1125	0.805	635	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Cu<5>,2|C<3>}	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.9947	1.036	370	120.1125	0.805	635	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Cu<6>,2|C<3>}	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3383	0.414	34	120.1125	0.805	635	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Eu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Eu<13>,2|C<3>}	C[6](N[6]C[6,6a]Eu)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.4290	0.301	7	120.5148	0.090	17	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Eu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Eu<8>,2|C<3>}	C[6](N[6]C[6,6a]Eu)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5748	0.301	10	120.5148	0.090	17	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Fe)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Fe<4>,2|C<3>}	C[6](N[6]C[6,6a]Fe)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.2330	0.110	2	120.0861	0.479	559	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Fe)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Fe<4>,2|C<3>}	C[6](N[6]C[6,6a]Fe)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.6755	0.016	2	120.0861	0.479	559	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Fe)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Fe<5>,2|C<3>}	C[6](N[6]C[6,6a]Fe)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.5739	1.376	7	120.0861	0.479	559	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Fe)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Fe<6>,2|C<3>}	C[6](N[6]C[6,6a]Fe)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.5720	0.000	1	120.0861	0.479	559	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Fe)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Fe<6>,2|C<3>}	C[6](N[6]C[6,6a]Fe)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.0875	0.677	544	120.0861	0.479	559	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Fe)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Fe<7>,2|C<3>}	C[6](N[6]C[6,6a]Fe)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5120	2.036	2	120.0861	0.479	559	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Fe)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Fe<8>,2|C<3>}	C[6](N[6]C[6,6a]Fe)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.0590	0.000	1	120.0861	0.479	559	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](N[6]C[6,6a]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.5506	0.253	9	120.1341	1.137	233	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](N[6]C[6,6a]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.1173	1.083	224	120.1341	1.137	233	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Hg)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Hg<4>,2|C<3>}	C[6](N[6]C[6,6a]Hg)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.7200	0.153	2	119.7200	0.023	2	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]In[4])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|In<4>,2|C<3>}	C[6](N[6]C[6,6a]In[4])(C[6]C[6]H)(H){1|Cl<1>,1|Se<2>,1|Se<3>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.4200	0.000	1	120.4200	0.000	1	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]In[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|In<4>,2|C<3>}	C[6](N[6]C[6,6a]In[6])(C[6]C[6]H)(H){1|Cl<1>,1|Se<2>,1|Se<3>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.4660	0.000	1	120.4660	0.000	1	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ir<6>,2|C<3>}	C[6](N[6]C[6,6a]Ir)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.2983	0.270	3	120.1239	0.153	91	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ir<6>,2|C<3>}	C[6](N[6]C[6,6a]Ir)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.1160	0.365	65	120.1239	0.153	91	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ir<7>,2|C<3>}	C[6](N[6]C[6,6a]Ir)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.3740	0.000	1	120.1239	0.153	91	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ir<7>,2|C<3>}	C[6](N[6]C[6,6a]Ir)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.0392	0.106	6	120.1239	0.153	91	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ir<8>,2|C<3>}	C[6](N[6]C[6,6a]Ir)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.1396	0.567	16	120.1239	0.153	91	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Li)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Li<4>,2|C<3>}	C[6](N[6]C[6,6a]Li)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3850	0.187	5	120.3850	0.035	5	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Mg)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Mg<6>,2|C<3>}	C[6](N[6]C[6,6a]Mg)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3243	0.169	12	120.3243	0.028	12	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Mn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Mn<5>,2|C<3>}	C[6](N[6]C[6,6a]Mn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.1991	0.345	10	120.2845	0.698	369	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Mn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Mn<6>,2|C<3>}	C[6](N[6]C[6,6a]Mn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.2779	0.867	339	120.2845	0.698	369	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Mn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Mn<7>,2|C<3>}	C[6](N[6]C[6,6a]Mn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.4388	0.211	20	120.2845	0.698	369	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Mo)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Mo<6>,2|C<3>}	C[6](N[6]C[6,6a]Mo)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.1357	0.278	23	120.1465	0.073	25	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Mo)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Mo<8>,2|C<3>}	C[6](N[6]C[6,6a]Mo)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.2700	0.130	2	120.1465	0.073	25	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]N)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|N<2>,2|C<3>}	C[6](N[6]C[6,6a]N)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.7730	0.000	1	120.7730	0.000	1	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Ni)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ni<4>,2|C<3>}	C[6](N[6]C[6,6a]Ni)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.1179	0.697	31	120.2644	0.635	434	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Ni)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ni<5>,2|C<3>}	C[6](N[6]C[6,6a]Ni)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.6278	1.526	9	120.2644	0.635	434	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Ni)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ni<6>,2|C<3>}	C[6](N[6]C[6,6a]Ni)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.2886	0.782	387	120.2644	0.635	434	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Ni)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ni<7>,2|C<3>}	C[6](N[6]C[6,6a]Ni)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3946	0.422	7	120.2644	0.635	434	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|O<1>,2|C<3>}	C[6](N[6]C[6,6a]O)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.5734	0.751	20	119.6669	0.538	24	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|O<2>,2|C<3>}	C[6](N[6]C[6,6a]O)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.1342	0.454	4	119.6669	0.538	24	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Os)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Os<4>,2|C<3>}	C[6](N[6]C[6,6a]Os)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.9070	0.000	1	119.9632	0.254	57	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Os)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Os<6>,2|C<3>}	C[6](N[6]C[6,6a]Os)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.9569	0.531	47	119.9632	0.254	57	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Os)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Os<7>,2|C<3>}	C[6](N[6]C[6,6a]Os)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.1340	0.000	1	119.9632	0.254	57	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Os)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Os<9>,2|C<3>}	C[6](N[6]C[6,6a]Os)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.9862	0.413	8	119.9632	0.254	57	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Pd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|N<2>}	C[6](N[6]C[6,6a]Pd)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.8960	0.041	3	120.1210	0.347	195	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Pd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Pd<4>,2|C<3>}	C[6](N[6]C[6,6a]Pd)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.6352	0.387	5	120.1210	0.347	195	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Pd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Pd<4>,2|C<3>}	C[6](N[6]C[6,6a]Pd)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8315	0.284	2	120.1210	0.347	195	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Pd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Pd<4>,2|C<3>}	C[6](N[6]C[6,6a]Pd)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.1469	0.450	157	120.1210	0.347	195	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Pd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Pd<5>,2|C<3>}	C[6](N[6]C[6,6a]Pd)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.7144	1.294	17	120.1210	0.347	195	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Pd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Pd<6>,1|C<3>,1|N<2>}	C[6](N[6]C[6,6a]Pd)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5135	0.489	2	120.1210	0.347	195	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Pd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Pd<6>,2|C<3>}	C[6](N[6]C[6,6a]Pd)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.1379	0.692	7	120.1210	0.347	195	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Pd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Pd<7>,2|C<3>}	C[6](N[6]C[6,6a]Pd)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.4315	0.173	2	120.1210	0.347	195	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Pt)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Pt<4>,2|C<3>}	C[6](N[6]C[6,6a]Pt)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	116.9930	0.000	1	120.0456	0.734	218	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Pt)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Pt<4>,2|C<3>}	C[6](N[6]C[6,6a]Pt)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.9879	0.855	169	120.0456	0.734	218	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Pt)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Pt<5>,2|C<3>}	C[6](N[6]C[6,6a]Pt)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.2541	0.438	22	120.0456	0.734	218	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Pt)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Pt<6>,2|C<3>}	C[6](N[6]C[6,6a]Pt)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3613	0.873	26	120.0456	0.734	218	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Re)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Re<6>,2|C<3>}	C[6](N[6]C[6,6a]Re)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.1190	0.389	138	120.1190	0.151	138	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Rh)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Rh<4>,2|C<3>}	C[6](N[6]C[6,6a]Rh)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3418	0.291	11	120.2173	0.175	43	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Rh)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Rh<5>,1|C<3>,1|N<2>}	C[6](N[6]C[6,6a]Rh)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.0000	0.000	1	120.2173	0.175	43	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Rh)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Rh<5>,2|C<3>}	C[6](N[6]C[6,6a]Rh)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.3560	0.000	1	120.2173	0.175	43	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Rh)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Rh<5>,2|C<3>}	C[6](N[6]C[6,6a]Rh)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.0823	0.476	11	120.2173	0.175	43	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Rh)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Rh<6>,2|C<3>}	C[6](N[6]C[6,6a]Rh)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.0840	0.319	7	120.2173	0.175	43	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Rh)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Rh<7>,2|C<3>}	C[6](N[6]C[6,6a]Rh)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.0460	0.000	1	120.2173	0.175	43	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Rh)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Rh<8>,1|C<3>,1|N<2>}	C[6](N[6]C[6,6a]Rh)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.9800	0.000	1	120.2173	0.175	43	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Rh)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Rh<8>,2|C<3>}	C[6](N[6]C[6,6a]Rh)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3707	0.551	10	120.2173	0.175	43	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ru<5>,2|C<3>}	C[6](N[6]C[6,6a]Ru)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.8430	0.113	4	119.9931	0.472	184	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ru<6>,2|C<3>}	C[6](N[6]C[6,6a]Ru)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.4633	0.481	3	119.9931	0.472	184	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ru<6>,2|C<3>}	C[6](N[6]C[6,6a]Ru)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.9967	0.614	158	119.9931	0.472	184	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ru<7>,2|C<3>}	C[6](N[6]C[6,6a]Ru)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5710	0.000	1	119.9931	0.472	184	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ru<8>,2|C<3>}	C[6](N[6]C[6,6a]Ru)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	117.6067	1.276	3	119.9931	0.472	184	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ru<9>,2|C<3>}	C[6](N[6]C[6,6a]Ru)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.0741	0.423	15	119.9931	0.472	184	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Sb)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Sb<5>,2|C<3>}	C[6](N[6]C[6,6a]Sb)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3235	0.064	2	120.2305	0.075	6	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Sb)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Sb<6>,2|C<3>}	C[6](N[6]C[6,6a]Sb)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.1840	0.340	4	120.2305	0.075	6	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Si)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Si<5>,2|C<3>}	C[6](N[6]C[6,6a]Si)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.9730	0.000	1	119.9730	0.000	1	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Sm)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Sm<11>,2|C<3>}	C[6](N[6]C[6,6a]Sm)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5168	0.154	4	120.5704	0.223	12	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Sm)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Sm<13>,2|C<3>}	C[6](N[6]C[6,6a]Sm)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5040	0.528	4	120.5704	0.223	12	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Sm)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Sm<9>,2|C<3>}	C[6](N[6]C[6,6a]Sm)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.6905	0.697	4	120.5704	0.223	12	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Sn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Sn<4>,2|C<3>}	C[6](N[6]C[6,6a]Sn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.4550	0.000	1	120.2774	0.038	41	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Sn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Sn<5>,2|C<3>}	C[6](N[6]C[6,6a]Sn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3828	0.068	5	120.2774	0.038	41	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Sn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Sn<6>,2|C<3>}	C[6](N[6]C[6,6a]Sn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.2523	0.205	34	120.2774	0.038	41	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Sn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Sn<7>,2|C<3>}	C[6](N[6]C[6,6a]Sn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.4260	0.000	1	120.2774	0.038	41	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Sr)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Sr<7>,2|C<3>}	C[6](N[6]C[6,6a]Sr)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5445	0.250	2	120.5010	0.025	4	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Sr)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Sr<8>,2|C<3>}	C[6](N[6]C[6,6a]Sr)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.4575	0.073	2	120.5010	0.025	4	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]U)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|U<10>,2|C<3>}	C[6](N[6]C[6,6a]U)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3035	0.443	2	120.3035	0.197	2	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]V)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|V<5>,2|C<3>}	C[6](N[6]C[6,6a]V)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.2450	0.247	4	120.0470	0.236	10	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]V)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|V<6>,2|C<3>}	C[6](N[6]C[6,6a]V)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3360	0.010	2	120.0470	0.236	10	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]V)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|V<8>,2|C<3>}	C[6](N[6]C[6,6a]V)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.1980	0.030	2	120.0470	0.236	10	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]V)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|V<9>,2|C<3>}	C[6](N[6]C[6,6a]V)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.2110	0.413	2	120.0470	0.236	10	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]W)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|W<6>,2|C<3>}	C[6](N[6]C[6,6a]W)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.6079	0.257	8	120.6079	0.066	8	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Zn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Zn<3>,2|C<3>}	C[6](N[6]C[6,6a]Zn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.9320	0.068	2	120.3291	0.432	234	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Zn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Zn<4>,2|C<3>}	C[6](N[6]C[6,6a]Zn)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.5835	0.267	2	120.3291	0.432	234	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Zn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Zn<4>,2|C<3>}	C[6](N[6]C[6,6a]Zn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.4103	0.454	22	120.3291	0.432	234	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Zn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Zn<5>,2|C<3>}	C[6](N[6]C[6,6a]Zn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3546	0.320	85	120.3291	0.432	234	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Zn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Zn<6>,2|C<3>}	C[6](N[6]C[6,6a]Zn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.2994	0.844	123	120.3291	0.432	234	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Zr)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Zr<10>,1|C<3>,1|N<2>}	C[6](N[6]C[6,6a]Zr)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.1820	0.000	1	120.1820	0.000	1	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]Ir)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]Ir)(C[6]N[6]H)(H){1|C<4>,2|C<3>}	C[6](N[6]C[6,6a]C)(C[6]C[6]H)(H){1|Ir<8>,2|C<3>}	H(C[6]C[6]2)	119.7780	0.000	1	119.7780	0.000	1	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]N)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]N)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](N[6]C[6,6a]H)(C[6]C[6]H)(H){1|N<2>,2|C<3>}	H(C[6]C[6]2)	119.4565	0.050	2	119.9385	0.097	15	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]N)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]N)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](N[6]C[6,6a]H)(C[6]C[6]H)(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.0126	0.260	13	119.9385	0.097	15	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]N)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]N)(C[6]N[6]H)(H){1|O<1>,2|C<3>}	C[6](N[6]C[6,6a]O)(C[6]C[6]H)(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.7520	0.243	2	120.0640	0.322	3	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]N)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]N)(C[6]N[6]H)(H){1|O<2>,2|C<3>}	C[6](N[6]C[6,6a]O)(C[6]C[6]H)(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.6880	0.000	1	120.0640	0.322	3	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]N)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Pt)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]N)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|N<2>}	C[6](N[6]C[6,6a]Pt)(C[6]C[6]H)(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	118.8380	0.000	1	118.8380	0.000	1	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]N[5a])(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]N[5a])(C[6]N[6]H)(H){1|Ir<8>,1|N<2>,3|C<3>}	C[6](N[6]C[6,6a]Ir)(C[6]C[6]H)(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.3630	0.000	1	120.3630	0.000	1	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]N[5a])(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Pt)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]N[5a])(C[6]N[6]H)(H){1|Pt<4>,1|N<2>,3|C<3>}	C[6](N[6]C[6,6a]Pt)(C[6]C[6]H)(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.6585	0.122	2	119.6585	0.015	2	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]N[6])(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Pt)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]N[6])(C[6]N[6]H)(H){1|Pt<4>,1|N<2>,3|C<3>}	C[6](N[6]C[6,6a]Pt)(C[6]C[6]H)(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.6440	0.000	1	119.6440	0.000	1	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](N[6]C[6,6a]H)(C[6]C[6]H)(H){1|O<2>,2|C<3>}	H(C[6]C[6]2)	120.9065	0.880	2	120.9065	0.775	2	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Pd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]N[6]H)(H){1|Pd<4>,2|C<3>}	C[6](N[6]C[6,6a]Pd)(C[6]C[6]H)(H){1|O<2>,2|C<3>}	H(C[6]C[6]2)	120.7610	0.000	1	120.7610	0.000	1	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Pt)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|N<2>}	C[6](N[6]C[6,6a]Pt)(C[6]C[6]H)(H){1|O<2>,2|C<3>}	H(C[6]C[6]2)	119.9800	0.000	1	119.9800	0.000	1	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]Os)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]Os)(C[6]N[6]H)(H){1|C<4>,2|C<3>}	C[6](N[6]C[6,6a]C)(C[6]C[6]H)(H){1|Os<6>,2|C<3>}	H(C[6]C[6]2)	119.5346	0.544	7	119.5346	0.295	7	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]Pd)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]Pd)(C[6]N[6]H)(H){1|C<4>,2|C<3>}	C[6](N[6]C[6,6a]C)(C[6]C[6]H)(H){1|Pd<4>,2|C<3>}	H(C[6]C[6]2)	119.3720	0.000	1	119.3720	0.000	1	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]S)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]S)(C[6]N[6]H)(H){1|O<1>,2|C<3>}	C[6](N[6]C[6,6a]O)(C[6]C[6]H)(H){1|S<2>,2|C<3>}	H(C[6]C[6]2)	118.1280	0.000	1	118.1280	0.000	1	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](N[6]B[3x3,3x5,12x6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|B<6>,1|H<1>,3|C<3>}	C[6](N[6]B[3x3,3x5,12x6]C[6])(C[6]C[6]H)(H){1|Co<10>,1|H<1>,2|C<3>,4|B<6>}	H(C[6]C[6]2)	119.9575	0.081	2	119.9575	0.007	2	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](N[6]B[5]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|B<3>,1|H<1>,3|C<3>}	C[6](N[6]B[5]C[6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|O<2>}	H(C[6]C[6]2)	118.5015	0.462	2	118.5015	0.213	2	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](N[6]B[6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|B<3>,1|H<1>,3|C<3>}	C[6](N[6]B[6]C[6])(C[6]C[6]H)(H){1|H<1>,4|C<3>}	H(C[6]C[6]2)	119.8065	0.115	4	119.8065	0.013	4	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](N[6]C[6]Al)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|Al<4>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Al)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3852	0.091	4	120.3852	0.008	4	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|Cd<4>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.8535	0.268	2	119.8510	0.056	4	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|Cd<6>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.8485	0.309	2	119.8510	0.056	4	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|Cl<1>,1|Co<6>,3|C<3>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.0430	0.000	1	120.0004	0.150	49	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|Co<5>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.2810	0.130	2	120.0004	0.150	49	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|Co<6>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.0011	0.397	44	120.0004	0.150	49	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|Co<8>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.6825	0.231	2	120.0004	0.150	49	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|Cu<4>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.9663	0.465	18	120.0480	0.356	28	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|Cu<5>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.1950	0.789	10	120.0480	0.356	28	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|Fe<6>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.1952	0.377	23	120.1952	0.142	23	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ga)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|Ga<4>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Ga)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3000	0.067	4	120.3000	0.004	4	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|Ir<6>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){3|C<3>}	H(C[6]C[6]2)	120.4575	0.602	2	120.0632	0.314	6	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|Ir<8>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.8660	0.497	4	120.0632	0.314	6	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|Mn<6>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.0667	0.486	12	120.0667	0.236	12	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|Mo<6>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.9760	0.282	6	119.9760	0.079	6	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|Ni<4>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.4738	1.152	10	119.6870	1.043	14	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|Ni<6>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.2200	0.105	4	119.6870	1.043	14	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](N[6]C[6]Os)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|Os<7>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Os)(C[6]C[6]H)(H){3|C<3>}	H(C[6]C[6]2)	120.0870	0.000	1	120.0870	0.000	1	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|Pd<4>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.0211	0.498	53	120.0211	0.248	53	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|Pt<4>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.2596	0.795	20	120.2533	0.601	21	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|Pt<4>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){3|C<3>}	H(C[6]C[6]2)	120.1280	0.000	1	120.2533	0.601	21	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|Re<6>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.5775	1.224	19	119.5775	1.498	19	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|Rh<8>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.7970	0.592	22	119.8066	0.321	24	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|Rh<9>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.9125	0.029	2	119.8066	0.321	24	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|Ru<6>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.2489	0.458	10	120.1905	0.190	12	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|Ru<6>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){3|C<3>}	H(C[6]C[6]2)	119.8985	0.011	2	120.1905	0.190	12	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](N[6]C[6]Sn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|Sn<5>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Sn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.8285	0.094	2	119.8285	0.009	2	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ti)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|Ti<12>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Ti)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.8448	0.253	4	119.8448	0.064	4	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|Zn<4>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.1586	0.355	16	120.1492	0.120	24	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|Zn<5>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.1235	0.417	6	120.1492	0.120	24	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|Zn<6>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.1515	0.025	2	120.1492	0.120	24	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|H<1>,4|C<3>}	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<2>}	H(C[6]C[6]2)	119.6910	0.613	4	119.6634	1.751	66	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|H<1>,4|C<3>}	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,4|C<3>}	H(C[6]C[6]2)	119.6617	1.359	62	119.6634	1.751	66	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](N[6]Ga[3x6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|Ga<4>,1|H<1>,3|C<3>}	C[6](N[6]Ga[3x6]C[6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,3|S<2>}	H(C[6]C[6]2)	119.7720	0.436	2	119.7720	0.190	2	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]B)(C[6]N[6]H)(H)	C[6](N[6]B[6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]B)(C[6]N[6]H)(H){1|B<3>,1|C<3>,1|H<1>}	C[6](N[6]B[6]C[6])(C[6]C[6]H)(H){1|B<3>,1|C<3>,1|H<1>,2|O<2>}	H(C[6]C[6]2)	118.4870	0.000	1	118.4870	0.000	1	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]B)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]B)(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	118.3545	1.150	4	118.3545	1.322	4	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]B)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]B)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|B<3>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.5820	0.047	2	119.5820	0.002	2	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]B)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]B)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|B<3>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.5938	0.305	8	119.5938	0.093	8	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]N[6]H)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|Br<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.9126	0.323	19	120.9126	0.104	19	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|Br<1>,2|C<3>}	H(C[6]C[6]2)	121.2420	0.116	2	120.9615	0.130	4	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|Br<1>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	120.6810	0.249	2	120.9615	0.130	4	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|Br<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.2540	0.458	2	121.2540	0.210	2	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|Br<1>,2|C<3>}	H(C[6]C[6]2)	120.9724	0.476	5	120.9724	0.227	5	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]B[5]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](N[6]B[5]C[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<2>,3|C<3>}	H(C[6]C[6]2)	119.5590	0.107	2	119.6775	0.023	6	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]B[5]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](N[6]B[5]C[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	119.8135	0.104	2	119.6775	0.023	6	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]B[5]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](N[6]B[5]C[6])(C[6]C[6]H)(H){1|Cl<1>,1|C<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.6600	0.168	2	119.6775	0.023	6	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]B[5a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](N[6]B[5a]C[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,2|C<4>,2|O<2>}	H(C[6]C[6]2)	119.8448	0.126	4	119.7591	0.026	10	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]B[5a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](N[6]B[5a]C[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,2|C<3>,2|O<2>}	H(C[6]C[6]2)	119.7850	0.113	4	119.7591	0.026	10	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]B[5a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](N[6]B[5a]C[6])(C[6]C[6]H)(H){1|H<1>,2|O<2>,3|C<3>}	H(C[6]C[6]2)	119.5360	0.122	2	119.7591	0.026	10	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]B[6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](N[6]B[6]C[6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,3|C<4>}	H(C[6]C[6]2)	119.6970	0.274	4	119.6970	0.075	4	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]B[6a,6a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](N[6]B[6a,6a]C[6])(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|C<4>,1|H<1>,2|O<2>}	H(C[6]C[6]2)	119.5405	0.360	4	119.5405	0.130	4	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ag)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ag<2>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ag)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	118.1710	1.223	2	118.3136	8.542	16	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ag)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ag<3>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ag)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	116.1545	3.495	4	118.3136	8.542	16	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ag)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ag<3>,1|C<3>}	C[6](N[6]C[6]Ag)(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	111.7430	0.000	1	118.3136	8.542	16	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ag)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ag<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ag)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.8290	0.062	2	118.3136	8.542	16	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ag)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ag<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ag)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	H(C[6]C[6]2)	120.0939	0.473	7	118.3136	8.542	16	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Al)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Al<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Al)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.8380	0.099	2	119.9615	0.018	6	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Al)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Al<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Al)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.0233	0.104	4	119.9615	0.018	6	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Au)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Au<3>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Au)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5580	0.305	2	120.5580	0.093	2	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Bi)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Bi<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Bi)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.7290	0.696	2	120.7290	0.484	2	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.0581	0.399	14	120.1948	0.108	46	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cd<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	H(C[6]C[6]2)	120.7850	0.211	2	120.1948	0.108	46	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cd<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.0839	0.243	10	120.1948	0.108	46	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cd<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<2>}	H(C[6]C[6]2)	120.5718	0.110	4	120.1948	0.108	46	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cd<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.2090	0.198	14	120.1948	0.108	46	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cd<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	H(C[6]C[6]2)	120.2620	0.115	2	120.1948	0.108	46	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Co<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.3790	0.332	8	120.1418	1.140	210	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Co<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5925	0.430	12	120.1418	1.140	210	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Co<5>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.7523	0.393	4	120.1418	1.140	210	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Co<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.8918	0.105	4	120.1418	1.140	210	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Co<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	H(C[6]C[6]2)	119.9575	0.016	2	120.1418	1.140	210	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	121.1730	0.000	1	120.1418	1.140	210	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.8395	0.089	4	120.1418	1.140	210	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.4316	2.064	45	120.1418	1.140	210	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	H(C[6]C[6]2)	120.2737	0.391	7	120.1418	1.140	210	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.2688	0.284	81	120.1418	1.140	210	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){3|C<3>}	H(C[6]C[6]2)	120.5269	0.240	34	120.1418	1.140	210	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Co<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	H(C[6]C[6]2)	119.7170	0.590	2	120.1418	1.140	210	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Co<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5335	0.061	4	120.1418	1.140	210	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Co<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.5115	0.100	2	120.1418	1.140	210	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cr)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cr<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cr)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.2377	0.466	6	119.9787	0.240	13	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cr)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cr<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cr)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	H(C[6]C[6]2)	119.8686	0.355	5	119.9787	0.240	13	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cr)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cr<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cr)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.4770	0.564	2	119.9787	0.240	13	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cu<2>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.9950	0.000	1	120.1170	0.313	157	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cu<3>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3610	0.209	2	120.1170	0.313	157	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cu<3>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.5025	0.162	2	120.1170	0.313	157	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cu<3>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,2|C<4>}	H(C[6]C[6]2)	120.1050	0.004	2	120.1170	0.313	157	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cu<3>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	H(C[6]C[6]2)	120.3440	0.349	2	120.1170	0.313	157	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.9203	0.234	23	120.1170	0.313	157	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<2>}	H(C[6]C[6]2)	120.9520	0.000	1	120.1170	0.313	157	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.4500	0.199	2	120.1170	0.313	157	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|P<4>}	H(C[6]C[6]2)	119.8610	0.196	5	120.1170	0.313	157	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,2|C<4>}	H(C[6]C[6]2)	119.4595	1.009	4	120.1170	0.313	157	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	H(C[6]C[6]2)	119.9227	0.328	8	120.1170	0.313	157	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.4571	0.924	16	120.1170	0.313	157	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){3|C<3>}	H(C[6]C[6]2)	120.7663	0.377	3	120.1170	0.313	157	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2737	0.784	15	120.1170	0.313	157	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.9178	0.620	11	120.1170	0.313	157	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<2>}	H(C[6]C[6]2)	120.2045	0.339	2	120.1170	0.313	157	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.6783	0.172	4	120.1170	0.313	157	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<2>}	H(C[6]C[6]2)	120.1705	0.120	2	120.1170	0.313	157	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	H(C[6]C[6]2)	119.9024	0.346	29	120.1170	0.313	157	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.2081	0.333	21	120.1170	0.313	157	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cu<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6945	0.071	2	120.1170	0.313	157	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Fe<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.7324	0.208	9	120.1479	0.257	57	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Fe<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.8520	0.785	2	120.1479	0.257	57	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Fe<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<2>}	H(C[6]C[6]2)	120.1990	0.390	2	120.1479	0.257	57	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.8288	0.203	9	120.1479	0.257	57	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.7955	0.154	6	120.1479	0.257	57	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|C<3>,2|C<4>}	H(C[6]C[6]2)	120.0910	0.000	1	120.1479	0.257	57	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	H(C[6]C[6]2)	120.0802	0.262	12	120.1479	0.257	57	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.2156	0.593	16	120.1479	0.257	57	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ga)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ga<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ga)(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.5985	2.577	2	120.0684	0.825	10	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ga)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ga<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ga)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.3590	0.264	2	120.0684	0.825	10	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ga)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ga<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ga)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.1282	0.129	6	120.0684	0.825	10	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Hg)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Hg<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Hg)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.2496	0.365	18	120.2192	0.131	21	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Hg)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Hg<4>,2|C<3>}	C[6](N[6]C[6]Hg)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.6970	0.000	1	120.2192	0.131	21	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Hg)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Hg<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Hg)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	H(C[6]C[6]2)	120.2065	0.247	2	120.2192	0.131	21	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ir<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.9955	0.108	2	120.0716	0.284	204	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ir<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<2>}	H(C[6]C[6]2)	120.0725	0.080	4	120.0716	0.284	204	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ir<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	H(C[6]C[6]2)	119.5885	0.231	2	120.0716	0.284	204	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<2>,2|C<3>}	H(C[6]C[6]2)	120.5443	0.056	3	120.0716	0.284	204	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<2>}	H(C[6]C[6]2)	120.1760	0.010	2	120.0716	0.284	204	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.3226	0.299	5	120.0716	0.284	204	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<2>}	H(C[6]C[6]2)	119.8506	0.151	5	120.0716	0.284	204	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	H(C[6]C[6]2)	120.0007	0.493	123	120.0716	0.284	204	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){3|C<3>}	H(C[6]C[6]2)	120.2829	0.497	20	120.0716	0.284	204	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ir<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	H(C[6]C[6]2)	119.4195	0.254	2	120.0716	0.284	204	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ir<7>,1|C<4>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.4030	0.020	2	120.0716	0.284	204	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.0250	0.369	2	120.0716	0.284	204	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,2|C<4>}	H(C[6]C[6]2)	119.9100	0.000	1	120.0716	0.284	204	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	H(C[6]C[6]2)	120.3760	0.311	8	120.0716	0.284	204	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.1338	0.929	18	120.0716	0.284	204	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){3|C<3>}	H(C[6]C[6]2)	120.6310	1.066	2	120.0716	0.284	204	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|O<2>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<2>}	H(C[6]C[6]2)	119.6510	0.000	1	120.0716	0.284	204	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ir<9>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3100	0.233	2	120.0716	0.284	204	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Li)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Li<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Li)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.9554	0.416	16	119.9554	0.173	16	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Mg)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Mg<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mg)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.9890	0.402	2	120.2360	0.115	5	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Mg)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Mg<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mg)(C[6]C[6]H)(H){3|C<3>}	H(C[6]C[6]2)	120.4007	0.217	3	120.2360	0.115	5	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Mn<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	H(C[6]C[6]2)	118.6415	1.822	2	120.0996	0.614	120	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.8697	0.195	12	120.0996	0.614	120	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|C<2>,2|C<3>}	H(C[6]C[6]2)	120.6720	0.000	1	120.0996	0.614	120	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.6842	0.296	16	120.0996	0.614	120	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	H(C[6]C[6]2)	120.1104	0.897	41	120.0996	0.614	120	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.0532	0.706	42	120.0996	0.614	120	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){3|C<3>}	H(C[6]C[6]2)	120.3020	0.324	3	120.0996	0.614	120	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Mn<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.8290	0.000	1	120.0996	0.614	120	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Mn<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5570	0.007	2	120.0996	0.614	120	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Mo<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.6855	0.670	24	119.6879	0.320	46	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Mo<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	H(C[6]C[6]2)	119.8492	0.306	12	119.6879	0.320	46	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Mo<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.6757	0.067	3	119.6879	0.320	46	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Mo<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	H(C[6]C[6]2)	119.7462	0.324	5	119.6879	0.320	46	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Mo<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	H(C[6]C[6]2)	118.6220	0.129	2	119.6879	0.320	46	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ni<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.8873	0.212	6	119.9843	0.380	121	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ni<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|C<3>,2|C<4>}	H(C[6]C[6]2)	120.4000	0.303	5	119.9843	0.380	121	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ni<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	H(C[6]C[6]2)	119.5396	0.912	27	119.9843	0.380	121	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ni<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.0370	0.271	4	119.9843	0.380	121	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ni<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	H(C[6]C[6]2)	119.8755	0.375	2	119.9843	0.380	121	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.8103	0.179	6	119.9843	0.380	121	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.7614	0.500	16	119.9843	0.380	121	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	H(C[6]C[6]2)	120.0062	0.431	20	119.9843	0.380	121	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.2326	0.254	35	119.9843	0.380	121	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Os)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Os<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Os)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	118.1553	1.937	6	119.6124	1.572	27	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Os)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Os<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Os)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<2>}	H(C[6]C[6]2)	119.7750	0.151	2	119.6124	1.572	27	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Os)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Os<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Os)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	H(C[6]C[6]2)	119.7993	0.497	10	119.6124	1.572	27	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Os)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Os<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Os)(C[6]C[6]H)(H){3|C<3>}	H(C[6]C[6]2)	120.3400	0.496	9	119.6124	1.572	27	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Pd<4>,1|C<2>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|C<3>,1|C<4>}	H(C[6]C[6]2)	120.6300	0.000	1	119.9825	0.365	198	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.7490	0.000	1	119.9825	0.365	198	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4111	0.466	20	119.9825	0.365	198	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.8345	0.752	81	119.9825	0.365	198	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	119.9280	0.000	1	119.9825	0.365	198	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<2>}	H(C[6]C[6]2)	119.6835	0.238	2	119.9825	0.365	198	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|C<3>,2|C<4>}	H(C[6]C[6]2)	120.3010	0.000	1	119.9825	0.365	198	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	H(C[6]C[6]2)	119.9067	0.394	58	119.9825	0.365	198	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.2745	0.365	21	119.9825	0.365	198	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){3|C<3>}	H(C[6]C[6]2)	120.5302	0.458	4	119.9825	0.365	198	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Pd<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	H(C[6]C[6]2)	119.9077	0.338	8	119.9825	0.365	198	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Pt<3>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.8340	0.194	2	119.9159	0.273	307	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.7470	0.000	1	119.9159	0.273	307	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7425	0.049	2	119.9159	0.273	307	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.7628	0.554	58	119.9159	0.273	307	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<2>}	H(C[6]C[6]2)	120.4600	0.000	1	119.9159	0.273	307	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	H(C[6]C[6]2)	119.6914	0.417	99	119.9159	0.273	307	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3752	0.163	6	119.9159	0.273	307	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){3|C<3>}	H(C[6]C[6]2)	120.4475	0.327	24	119.9159	0.273	307	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Pt<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.1345	0.139	2	119.9159	0.273	307	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Pt<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	H(C[6]C[6]2)	120.0607	0.275	10	119.9159	0.273	307	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Pt<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5440	0.197	2	119.9159	0.273	307	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Pt<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6839	0.220	10	119.9159	0.273	307	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Pt<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.9044	0.252	11	119.9159	0.273	307	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Pt<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	H(C[6]C[6]2)	119.7326	0.407	58	119.9159	0.273	307	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Pt<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.4882	0.241	10	119.9159	0.273	307	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Pt<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){3|C<3>}	H(C[6]C[6]2)	120.6389	0.190	11	119.9159	0.273	307	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Re<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2670	0.478	2	120.0823	0.321	160	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Re<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.5512	0.613	6	120.0823	0.321	160	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Re<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	H(C[6]C[6]2)	119.9805	0.214	2	120.0823	0.321	160	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Re<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.1940	0.192	2	120.0823	0.321	160	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1620	0.524	18	120.0823	0.321	160	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|C<2>,2|C<3>}	H(C[6]C[6]2)	120.9730	0.042	5	120.0823	0.321	160	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.8745	0.213	25	120.0823	0.321	160	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	H(C[6]C[6]2)	119.9655	0.352	48	120.0823	0.321	160	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.1792	0.846	38	120.0823	0.321	160	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){3|C<3>}	H(C[6]C[6]2)	120.3704	0.347	14	120.0823	0.321	160	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Rh<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.9950	0.069	2	120.0598	0.227	101	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Rh<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	H(C[6]C[6]2)	119.6615	0.363	2	120.0598	0.227	101	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Rh<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.9700	0.297	2	120.0598	0.227	101	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Rh<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7135	0.151	2	120.0598	0.227	101	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Rh<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.9090	0.186	4	120.0598	0.227	101	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Rh<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	H(C[6]C[6]2)	119.7021	0.328	17	120.0598	0.227	101	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Rh<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4377	0.493	12	120.0598	0.227	101	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Rh<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.9505	0.915	6	120.0598	0.227	101	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Rh<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	H(C[6]C[6]2)	120.0335	0.308	2	120.0598	0.227	101	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Rh<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.1027	0.408	50	120.0598	0.227	101	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Rh<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){3|C<3>}	H(C[6]C[6]2)	120.3165	0.122	2	120.0598	0.227	101	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ru<10>,1|C<4>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.4165	0.320	2	119.9861	0.851	153	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ru<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.2225	0.045	2	119.9861	0.851	153	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4913	0.466	4	119.9861	0.851	153	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<2>,2|C<3>}	H(C[6]C[6]2)	120.0890	0.000	1	119.9861	0.851	153	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.8306	0.304	20	119.9861	0.851	153	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<2>}	H(C[6]C[6]2)	120.0770	0.083	2	119.9861	0.851	153	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	119.5570	0.000	1	119.9861	0.851	153	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<4>}	H(C[6]C[6]2)	119.8140	0.000	1	119.9861	0.851	153	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	H(C[6]C[6]2)	119.5799	1.058	56	119.9861	0.851	153	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3717	0.056	3	119.9861	0.851	153	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){3|C<3>}	H(C[6]C[6]2)	120.5334	0.914	41	119.9861	0.851	153	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ru<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,2|C<4>}	H(C[6]C[6]2)	118.4860	1.017	2	119.9861	0.851	153	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ru<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	H(C[6]C[6]2)	119.7460	0.042	2	119.9861	0.851	153	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ru<9>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3560	0.241	4	119.9861	0.851	153	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ru<9>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.9303	0.288	4	119.9861	0.851	153	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ru<9>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<2>}	H(C[6]C[6]2)	120.3060	0.000	2	119.9861	0.851	153	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ru<9>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	H(C[6]C[6]2)	119.6710	0.120	2	119.9861	0.851	153	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ru<9>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3460	0.193	4	119.9861	0.851	153	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Si)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Si<4>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Si)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.8100	0.000	1	119.8957	0.058	18	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Si)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Si<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Si)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.5300	0.317	2	119.8957	0.058	18	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Si)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Si<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Si)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.1647	0.179	4	119.8957	0.058	18	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Si)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Si<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Si)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.8721	0.148	11	119.8957	0.058	18	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Sm)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Sm<11>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Sm)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.0880	0.066	4	120.0880	0.004	4	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Sn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Sn<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Sn)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.0350	0.049	2	120.0379	0.013	12	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Sn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Sn<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Sn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.0472	0.138	8	120.0379	0.013	12	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Sn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Sn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Sn)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	H(C[6]C[6]2)	120.0035	0.042	2	120.0379	0.013	12	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Tc)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Tc<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Tc)(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.1340	0.047	2	120.2867	0.445	6	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Tc)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Tc<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Tc)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.8630	0.149	4	120.2867	0.445	6	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ti)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ti<6>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Ti)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.7090	0.000	1	119.7220	0.013	3	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ti)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ti<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ti)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.7285	0.158	2	119.7220	0.013	3	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.9250	0.285	26	120.0770	0.180	121	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	H(C[6]C[6]2)	120.1463	0.188	3	120.0770	0.180	121	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.0232	0.380	24	120.0770	0.180	121	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){3|C<3>}	H(C[6]C[6]2)	121.2260	0.000	1	120.0770	0.180	121	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Zn<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.8193	0.115	3	120.0770	0.180	121	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Zn<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.1077	0.121	6	120.0770	0.180	121	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Zn<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	H(C[6]C[6]2)	120.1375	0.251	4	120.0770	0.180	121	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Zn<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.2343	0.497	28	120.0770	0.180	121	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Zn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.1295	0.245	2	120.0770	0.180	121	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Zn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	H(C[6]C[6]2)	119.8791	0.386	13	120.0770	0.180	121	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Zn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.0135	0.500	11	120.0770	0.180	121	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Zr)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Zr<12>,1|C<4>,1|H<1>}	C[6](N[6]C[6]Zr)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.5375	0.174	8	120.5375	0.030	8	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<2>}	H(C[6]C[6]2)	119.3270	0.085	2	119.6348	0.165	16	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,4|C<3>}	H(C[6]C[6]2)	119.6788	0.417	14	119.6348	0.165	16	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](N[6]C[6a]N[6])(C[6]C[6]H)(H){4|C<3>}	H(C[6]C[6]2)	120.5060	0.000	1	120.5060	0.000	1	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]Ga[3x6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ga<4>,1|C<3>,1|H<1>}	C[6](N[6]Ga[3x6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,3|S<2>}	H(C[6]C[6]2)	119.5327	0.988	4	119.5327	0.976	4	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]Ga[6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ga<4>,1|C<3>,1|H<1>}	C[6](N[6]Ga[6]C[6])(C[6]C[6]H)(H){1|Br<1>,1|C<3>,1|C<4>,1|H<1>,2|S<2>}	H(C[6]C[6]2)	119.3208	0.140	6	119.3208	0.020	6	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]Ge[4x6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ge<6>,1|C<3>,1|H<1>}	C[6](N[6]Ge[4x6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,5|N<3>}	H(C[6]C[6]2)	119.7530	0.153	2	119.7530	0.023	2	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]N[6]H)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|Cl<1>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	121.1170	0.000	1	120.7980	0.064	5	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]N[6]H)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|Cl<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7182	0.207	4	120.7980	0.064	5	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]N[6]H)(H){1|Cu<2>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|Cl<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.0265	0.057	2	121.0805	0.061	6	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|Cl<1>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	121.3280	0.310	2	121.0805	0.061	6	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|Cl<1>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	120.8870	0.054	2	121.0805	0.061	6	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]N[6]H)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|Cl<1>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	121.1400	0.000	1	121.1400	0.000	1	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|Cl<1>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	120.6250	0.000	1	120.6250	0.000	1	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]N[6]H)(H)	C[6](N[6]C[6]Os)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]N[6]H)(H){1|Os<9>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Os)(C[6]C[6]H)(H){1|Cl<1>,1|C<3>,1|N<2>}	H(C[6]C[6]2)	120.6650	0.000	1	120.6650	0.000	1	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|Cl<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.8765	0.049	2	120.8765	0.002	2	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|Cl<1>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	120.6687	0.080	3	120.7218	0.015	5	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|Cl<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.8015	0.162	2	120.7218	0.015	5	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|Cl<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.1620	0.116	2	121.2667	0.040	3	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|Cl<1>,2|C<3>}	H(C[6]C[6]2)	121.4760	0.000	1	121.2667	0.040	3	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]F)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]F)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|F<1>,2|C<3>}	H(C[6]C[6]2)	121.1910	0.341	2	121.1910	0.116	2	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]B[3,3,5,3x6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<5>,1|C<3>,1|H<1>}	C[6](N[6]B[3,3,5,3x6]C[6])(C[6]C[6]H)(H){1|B<5>,1|C<3>,1|C<4>,2|B<6>,2|H<1>}	H(C[6]C[6]2)	118.1310	0.000	1	118.8923	3.019	4	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]B[3,3,5,3x6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<5>,1|C<3>,1|H<1>}	C[6](N[6]B[3,3,5,3x6]C[6])(C[6]C[6]H)(H){1|C<3>,3|B<6>,3|H<1>}	H(C[6]C[6]2)	120.3210	0.030	2	118.8923	3.019	4	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]B[3,3,5,3x6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<6>,1|C<3>,1|C<4>}	C[6](N[6]B[3,3,5,3x6]C[6])(C[6]C[6]H)(H){1|Rh<6>,1|B<5>,1|C<3>,1|H<2>,2|B<6>,2|H<1>}	H(C[6]C[6]2)	116.7960	0.000	1	118.8923	3.019	4	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]B[3,3,5,4x6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<5>,1|C<3>,1|H<1>}	C[6](N[6]B[3,3,5,4x6]C[6])(C[6]C[6]H)(H){1|C<2>,1|C<3>,2|H<1>,3|B<6>}	H(C[6]C[6]2)	120.3312	0.260	4	119.9122	1.366	11	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]B[3,3,5,4x6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<5>,1|C<3>,1|H<1>}	C[6](N[6]B[3,3,5,4x6]C[6])(C[6]C[6]H)(H){1|Ni<9>,1|B<5>,1|C<3>,2|B<6>,2|H<1>}	H(C[6]C[6]2)	120.3270	0.069	2	119.9122	1.366	11	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]B[3,3,5,4x6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<5>,1|C<3>,1|H<1>}	C[6](N[6]B[3,3,5,4x6]C[6])(C[6]C[6]H)(H){1|Rh<8>,1|C<3>,1|C<4>,1|H<1>,3|B<6>}	H(C[6]C[6]2)	120.6600	0.000	1	119.9122	1.366	11	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]B[3,3,5,4x6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<5>,1|C<3>,1|H<1>}	C[6](N[6]B[3,3,5,4x6]C[6])(C[6]C[6]H)(H){1|Rh<8>,1|C<3>,2|H<1>,3|B<6>}	H(C[6]C[6]2)	118.9910	1.749	2	119.9122	1.366	11	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]B[3,3,5,4x6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<5>,1|C<3>,1|H<1>}	C[6](N[6]B[3,3,5,4x6]C[6])(C[6]C[6]H)(H){1|Rh<9>,1|C<3>,2|H<1>,3|B<6>}	H(C[6]C[6]2)	119.2065	2.469	2	119.9122	1.366	11	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]B[3,3,5,6,6a,6a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<5>,1|C<3>,1|H<1>}	C[6](N[6]B[3,3,5,6,6a,6a]C[6])(C[6]C[6]H)(H){1|B<5>,1|C<3>,2|B<6>,3|H<1>}	H(C[6]C[6]2)	120.2690	0.140	2	120.2690	0.020	2	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]B[3x3,5,4x6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<6>,1|C<3>,1|H<1>}	C[6](N[6]B[3x3,5,4x6]C[6])(C[6]C[6]H)(H){1|Rh<6>,1|C<3>,1|H<2>,2|H<1>,3|B<6>}	H(C[6]C[6]2)	120.8850	0.641	2	119.9455	1.349	4	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]B[3x3,5,4x6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<6>,1|C<3>,1|H<1>}	C[6](N[6]B[3x3,5,4x6]C[6])(C[6]C[6]H)(H){1|Rh<7>,1|C<3>,1|H<2>,2|H<1>,3|B<6>}	H(C[6]C[6]2)	119.0060	0.324	2	119.9455	1.349	4	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]B[3x3,5,5,6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<5>,1|C<3>,1|H<1>}	C[6](N[6]B[3x3,5,5,6,6]C[6])(C[6]C[6]H)(H){1|B<5>,1|B<7>,1|C<3>,2|B<6>,2|H<1>}	H(C[6]C[6]2)	120.2480	0.071	2	120.2480	0.005	2	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]B[3x3,5,5,7x6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<5>,1|C<3>,1|H<1>}	C[6](N[6]B[3x3,5,5,7x6]C[6])(C[6]C[6]H)(H){1|B<5>,1|C<3>,1|C<5>,2|B<6>,2|H<1>}	H(C[6]C[6]2)	120.1955	0.009	2	120.1955	0.000	2	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]B[3x6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](N[6]B[3x6]C[6])(C[6]C[6]H)(H){1|C<3>,2|H<1>,3|C<4>}	H(C[6]C[6]2)	119.7310	0.686	4	119.9241	0.318	8	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]B[3x6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](N[6]B[3x6]C[6])(C[6]C[6]H)(H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.0290	0.676	2	119.9241	0.318	8	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]B[3x6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](N[6]B[3x6]C[6])(C[6]C[6]H)(H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.2055	0.158	2	119.9241	0.318	8	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]B[5]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](N[6]B[5]C[6])(C[6]C[6]H)(H){1|C<3>,1|N<3>,2|H<1>,2|O<2>}	H(C[6]C[6]2)	120.3715	0.168	4	120.3460	0.046	21	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]B[5]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](N[6]B[5]C[6])(C[6]C[6]H)(H){1|H<1>,2|C<4>,3|C<3>}	H(C[6]C[6]2)	120.7340	0.000	1	120.3460	0.046	21	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]B[5]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](N[6]B[5]C[6])(C[6]C[6]H)(H){1|N<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.2603	0.197	7	120.3460	0.046	21	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]B[5]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](N[6]B[5]C[6])(C[6]C[6]H)(H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.3581	0.221	9	120.3460	0.046	21	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]B[5]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<3>,1|H<1>,1|N<3>}	C[6](N[6]B[5]N[6])(C[6]C[6]H)(H){1|B<3>,1|C<3>,1|H<1>,2|O<2>}	H(C[6]C[6]2)	120.9550	0.000	1	120.9550	0.000	1	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]B[5a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](N[6]B[5a]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,2|H<1>,2|O<2>}	H(C[6]C[6]2)	119.2702	1.741	5	119.2702	3.030	5	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]B[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](N[6]B[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,4|C<4>}	H(C[6]C[6]2)	120.6605	0.009	2	120.3708	0.033	12	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]B[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](N[6]B[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,2|H<1>,3|C<4>}	H(C[6]C[6]2)	120.4655	0.009	2	120.3708	0.033	12	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]B[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](N[6]B[6,6]C[6])(C[6]C[6]H)(H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.2747	0.121	8	120.3708	0.033	12	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]B[6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<3>,1|C<3>,1|H<1>}	C[6](N[6]B[6]C[6])(C[6]C[6]H)(H){2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.6262	0.546	4	120.5169	0.266	9	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]B[6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](N[6]B[6]C[6])(C[6]C[6]H)(H){1|Cl<1>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.3585	1.046	2	120.5169	0.266	9	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]B[6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](N[6]B[6]C[6])(C[6]C[6]H)(H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.4767	0.143	3	120.5169	0.266	9	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]B[6a,6a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](N[6]B[6a,6a]C[6])(C[6]C[6]H)(H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.3280	0.142	3	120.3280	0.020	3	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]B[6a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<3>,1|C<3>,1|H<1>}	C[6](N[6]B[6a]C[6])(C[6]C[6]H)(H){1|C<3>,2|H<1>,2|O<2>}	H(C[6]C[6]2)	120.3964	0.615	8	120.3384	0.241	16	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]B[6a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](N[6]B[6a]C[6])(C[6]C[6]H)(H){1|C<3>,1|N<3>,2|H<1>,2|O<2>}	H(C[6]C[6]2)	120.2433	0.410	6	120.3384	0.241	16	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]B[6a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](N[6]B[6a]C[6])(C[6]C[6]H)(H){2|C<3>,2|H<1>,2|O<2>}	H(C[6]C[6]2)	120.3915	0.190	2	120.3384	0.241	16	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[4]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](N[6]C[4]C[6])(C[6]C[6]H)(H){2|H<1>,3|C<3>}	H(C[6]C[6]2)	122.3300	0.000	1	120.7530	1.875	3	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[4]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|O<2>,2|C<3>}	C[6](N[6]C[4]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	119.8680	0.000	1	120.7530	1.875	3	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[4]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){3|C<3>}	C[6](N[6]C[4]C[6])(C[6]C[6]H)(H){2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.0610	0.000	1	120.7530	1.875	3	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[5]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<4>,2|C<3>}	C[6](N[6]C[5]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<2>,3|H<1>}	H(C[6]C[6]2)	117.3495	2.668	2	119.4097	2.687	10	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[5]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](N[6]C[5]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<2>,2|H<1>}	H(C[6]C[6]2)	119.9610	0.411	4	119.4097	2.687	10	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[5]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](N[6]C[5]C[6])(C[6]C[6]H)(H){1|N<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2055	0.090	2	119.4097	2.687	10	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[5]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](N[6]C[5]C[6])(C[6]C[6]H)(H){2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.5715	2.351	2	119.4097	2.687	10	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[5a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](N[6]C[5a]C[6])(C[6]C[6]H)(H){2|H<1>,3|C<3>}	H(C[6]C[6]2)	118.4895	0.815	2	118.4895	0.665	2	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ag)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ag<3>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ag)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.7375	0.359	2	120.7570	0.406	94	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ag)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ag<3>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ag)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	121.0226	0.193	5	120.7570	0.406	94	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ag)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ag<3>,1|C<3>,1|N<3>}	C[6](N[6]C[6]Ag)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9330	0.000	1	120.7570	0.406	94	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ag)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ag<4>,1|C<2>,1|C<3>}	C[6](N[6]C[6]Ag)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	118.6655	0.881	4	120.7570	0.406	94	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ag)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ag<4>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Ag)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5890	0.455	2	120.7570	0.406	94	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ag)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ag<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ag)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.9331	0.245	13	120.7570	0.406	94	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ag)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ag<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ag)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.1024	0.470	8	120.7570	0.406	94	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ag)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ag<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ag)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<3>}	H(C[6]C[6]2)	120.4230	0.000	1	120.7570	0.406	94	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ag)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ag<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ag)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6775	0.135	2	120.7570	0.406	94	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ag)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ag<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ag)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.8468	0.411	36	120.7570	0.406	94	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ag)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ag<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ag)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.7070	0.434	6	120.7570	0.406	94	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ag)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ag<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ag)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.8723	0.798	9	120.7570	0.406	94	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ag)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ag<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ag)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<4>}	H(C[6]C[6]2)	120.7467	0.315	3	120.7570	0.406	94	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ag)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ag<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ag)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.6245	0.144	2	120.7570	0.406	94	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Al)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Al<3>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Al)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2910	0.000	1	120.6552	0.196	101	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Al)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Al<3>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Al)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.3810	0.000	1	120.6552	0.196	101	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Al)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Al<3>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Al)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5150	0.000	1	120.6552	0.196	101	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Al)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Al<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Al)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.6580	0.000	1	120.6552	0.196	101	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Al)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Al<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Al)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7880	0.000	1	120.6552	0.196	101	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Al)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Al<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Al)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5347	0.333	27	120.6552	0.196	101	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Al)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Al<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Al)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.8030	0.000	1	120.6552	0.196	101	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Al)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Al<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Al)(C[6]C[6]H)(H){1|Rh<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3690	0.000	1	120.6552	0.196	101	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Al)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Al<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Al)(C[6]C[6]H)(H){1|Si<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7400	0.000	1	120.6552	0.196	101	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Al)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Al<4>,1|C<4>,1|H<1>}	C[6](N[6]C[6]Al)(C[6]C[6]H)(H){2|C<3>,2|H<1>}	H(C[6]C[6]2)	121.6235	0.030	2	120.6552	0.196	101	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Al)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Al<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Al)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.5490	0.000	2	120.6552	0.196	101	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Al)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Al<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Al)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.8920	0.098	2	120.6552	0.196	101	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Al)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Al<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Al)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.1885	0.135	2	120.6552	0.196	101	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Al)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Al<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Al)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.7173	0.293	24	120.6552	0.196	101	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Al)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Al<5>,1|C<4>,1|H<1>}	C[6](N[6]C[6]Al)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.6317	0.043	3	120.6552	0.196	101	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Al)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Al<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Al)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.9777	0.045	3	120.6552	0.196	101	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Al)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Al<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Al)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.1525	0.169	2	120.6552	0.196	101	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Al)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Al<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Al)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3133	0.118	9	120.6552	0.196	101	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Al)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Al<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Al)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.6384	0.916	10	120.6552	0.196	101	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Al)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Al<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Al)(C[6]C[6]H)(H){1|Sn<3>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5787	0.626	4	120.6552	0.196	101	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Al)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Al<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Al)(C[6]C[6]H)(H){1|Sn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.9393	0.396	3	120.6552	0.196	101	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]As)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|As<2>,1|C<3>,1|H<1>}	C[6](N[6]C[6]As)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3830	0.000	1	120.3830	0.000	1	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Au)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Au<4>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Au)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	121.0760	0.021	2	120.6491	0.269	32	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Au)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Au<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Au)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3865	0.200	2	120.6491	0.269	32	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Au)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Au<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Au)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.6666	0.513	25	120.6491	0.269	32	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Au)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Au<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Au)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.9020	0.000	1	120.6491	0.269	32	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Au)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Au<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Au)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.1390	0.940	2	120.6491	0.269	32	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ba)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ba<12>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ba)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	121.2400	0.025	2	120.8019	0.114	8	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ba)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ba<13>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ba)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4787	0.152	3	120.8019	0.114	8	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ba)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ba<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ba)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.8330	0.162	3	120.8019	0.114	8	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Be)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Be<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Be)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4497	0.046	4	120.4497	0.002	4	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Bi)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Bi<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Bi)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.7622	0.313	4	120.7701	0.058	14	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Bi)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Bi<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Bi)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.9970	0.380	2	120.7701	0.058	14	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Bi)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Bi<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Bi)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6490	0.000	1	120.7701	0.058	14	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Bi)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Bi<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Bi)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.7640	0.150	3	120.7701	0.058	14	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Bi)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Bi<6>,1|C<3>,1|O<2>}	C[6](N[6]C[6]Bi)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5460	0.058	2	120.7701	0.058	14	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Bi)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Bi<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Bi)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.8525	0.189	2	120.7701	0.058	14	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ca)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ca<10>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ca)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.6560	0.000	1	120.8272	0.051	21	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ca)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ca<12>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ca)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6730	0.070	3	120.8272	0.051	21	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ca)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ca<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ca)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6882	0.175	4	120.8272	0.051	21	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ca)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ca<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ca)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	121.0032	0.157	6	120.8272	0.051	21	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ca)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ca<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ca)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.1080	0.368	2	120.8272	0.051	21	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ca)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ca<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ca)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.7416	0.159	5	120.8272	0.051	21	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cd<4>,1|C<2>,1|C<3>}	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.7440	0.000	1	120.6420	0.455	306	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cd<4>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5010	0.270	6	120.6420	0.455	306	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.9717	0.611	3	120.6420	0.455	306	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.0840	0.000	1	120.6420	0.455	306	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5236	0.266	12	120.6420	0.455	306	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cd<5>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2880	0.000	1	120.6420	0.455	306	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cd<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.7109	0.304	13	120.6420	0.455	306	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cd<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.0735	0.006	2	120.6420	0.455	306	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cd<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6576	0.265	7	120.6420	0.455	306	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cd<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.6185	0.714	41	120.6420	0.455	306	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cd<6>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	H(C[6]C[6]2)	120.8893	0.151	3	120.6420	0.455	306	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cd<6>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<3>}	H(C[6]C[6]2)	120.7970	0.000	1	120.6420	0.455	306	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cd<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.6923	0.333	35	120.6420	0.455	306	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cd<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.9290	0.000	1	120.6420	0.455	306	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cd<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6014	0.421	35	120.6420	0.455	306	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cd<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.7042	0.930	102	120.6420	0.455	306	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cd<6>,1|C<3>,1|N<3>}	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1912	0.512	17	120.6420	0.455	306	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cd<6>,1|C<3>,1|N<3>}	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.0530	0.000	1	120.6420	0.455	306	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cd<6>,2|C<3>}	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5990	0.667	9	120.6420	0.455	306	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cd<6>,2|C<3>}	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5520	0.000	1	120.6420	0.455	306	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cd<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.9683	0.749	3	120.6420	0.455	306	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cd<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.8052	0.186	6	120.6420	0.455	306	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cd<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.1455	0.108	4	120.6420	0.455	306	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cd<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.7180	0.000	1	120.6420	0.455	306	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Br<1>,1|Co<6>,1|C<3>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3700	0.000	1	120.4857	0.598	1748	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cl<1>,1|Co<6>,1|C<3>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2740	0.048	2	120.4857	0.598	1748	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<3>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3820	0.020	2	120.4857	0.598	1748	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<4>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.9415	0.057	2	120.4857	0.598	1748	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<4>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3095	0.347	2	120.4857	0.598	1748	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5825	0.196	2	120.4857	0.598	1748	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.6489	0.237	17	120.4857	0.598	1748	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.4995	0.643	2	120.4857	0.598	1748	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8661	0.314	23	120.4857	0.598	1748	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<4>}	H(C[6]C[6]2)	120.5625	1.030	2	120.4857	0.598	1748	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5077	0.522	18	120.4857	0.598	1748	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.4900	0.363	28	120.4857	0.598	1748	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.6692	0.194	48	120.4857	0.598	1748	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7493	0.423	125	120.4857	0.598	1748	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5253	0.604	18	120.4857	0.598	1748	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5186	0.299	34	120.4857	0.598	1748	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<5>,1|C<3>,1|N<3>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6130	0.000	1	120.4857	0.598	1748	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<5>,2|C<3>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5320	0.000	1	120.4857	0.598	1748	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<6>,1|B<4>,1|C<3>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6380	0.000	1	120.4857	0.598	1748	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<6>,1|C<2>,1|C<3>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	121.8770	0.000	1	120.4857	0.598	1748	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0710	0.000	1	120.4857	0.598	1748	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.4466	0.786	290	120.4857	0.598	1748	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.5453	0.247	3	120.4857	0.598	1748	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.9032	0.403	23	120.4857	0.598	1748	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.7200	0.898	2	120.4857	0.598	1748	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<4>}	H(C[6]C[6]2)	120.3680	0.136	3	120.4857	0.598	1748	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	H(C[6]C[6]2)	121.3850	0.941	3	120.4857	0.598	1748	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3573	0.688	262	120.4857	0.598	1748	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.4562	0.790	688	120.4857	0.598	1748	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|I<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2230	0.000	1	120.4857	0.598	1748	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|N<2>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1135	0.412	2	120.4857	0.598	1748	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|N<3>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0379	0.560	14	120.4857	0.598	1748	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|O<2>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1260	0.064	2	120.4857	0.598	1748	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|S<4>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9587	0.443	3	120.4857	0.598	1748	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<6>,1|C<3>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.9530	0.000	1	120.4857	0.598	1748	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<6>,1|C<4>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.6640	0.000	1	120.4857	0.598	1748	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<6>,2|C<3>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.7822	2.175	40	120.4857	0.598	1748	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<6>,2|C<3>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3140	0.798	5	120.4857	0.598	1748	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.6365	0.175	10	120.4857	0.598	1748	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.7460	0.389	2	120.4857	0.598	1748	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6372	0.161	10	120.4857	0.598	1748	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	121.0120	0.110	2	120.4857	0.598	1748	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5363	0.151	6	120.4857	0.598	1748	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.1165	0.894	31	120.4857	0.598	1748	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<7>,1|C<3>,1|N<3>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1940	0.257	2	120.4857	0.598	1748	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<7>,1|C<4>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	121.0080	0.000	1	120.4857	0.598	1748	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.2450	0.000	1	120.4857	0.598	1748	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.0810	0.136	2	120.4857	0.598	1748	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	H(C[6]C[6]2)	120.4470	0.000	1	120.4857	0.598	1748	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3640	0.088	6	120.4857	0.598	1748	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cr)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cr<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cr)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.5140	0.057	2	120.4710	0.578	241	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cr)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cr<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cr)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.6095	0.095	2	120.4710	0.578	241	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cr)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cr<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cr)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.2550	0.000	1	120.4710	0.578	241	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cr)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cr<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cr)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8350	0.355	21	120.4710	0.578	241	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cr)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cr<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cr)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	H(C[6]C[6]2)	119.9730	0.000	1	120.4710	0.578	241	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cr)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cr<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cr)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3793	0.099	6	120.4710	0.578	241	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cr)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cr<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cr)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	118.5850	2.249	4	120.4710	0.578	241	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cr)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cr<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cr)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.6602	0.728	42	120.4710	0.578	241	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cr)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cr<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cr)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.4673	0.372	8	120.4710	0.578	241	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cr)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cr<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cr)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8201	0.381	25	120.4710	0.578	241	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cr)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cr<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cr)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4331	0.245	19	120.4710	0.578	241	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cr)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cr<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cr)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3262	0.852	91	120.4710	0.578	241	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cr)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cr<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cr)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.5080	0.000	1	120.4710	0.578	241	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cr)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cr<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cr)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7735	0.122	2	120.4710	0.578	241	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cr)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cr<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cr)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.4242	0.236	6	120.4710	0.578	241	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cr)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cr<8>,1|C<4>,1|H<1>}	C[6](N[6]C[6]Cr)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5874	0.143	5	120.4710	0.578	241	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cr)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cr<9>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cr)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.0313	0.904	3	120.4710	0.578	241	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cr)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cr<9>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cr)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1805	0.022	2	120.4710	0.578	241	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Br<1>,1|Cu<4>,1|C<3>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2450	0.000	1	120.5386	0.646	1862	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Br<1>,1|Cu<5>,1|C<3>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8810	0.000	1	120.5386	0.646	1862	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cl<1>,1|Cu<4>,1|C<3>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5875	0.206	2	120.5386	0.646	1862	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cl<1>,1|Cu<5>,1|C<3>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2895	0.073	4	120.5386	0.646	1862	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<2>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.5793	0.198	3	120.5386	0.646	1862	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<3>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.7490	0.103	2	120.5386	0.646	1862	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<3>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.7470	0.133	2	120.5386	0.646	1862	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<3>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.0627	0.108	3	120.5386	0.646	1862	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<3>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.9120	0.889	17	120.5386	0.646	1862	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<3>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.9797	0.229	6	120.5386	0.646	1862	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<3>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<4>}	H(C[6]C[6]2)	120.5500	0.223	4	120.5386	0.646	1862	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<3>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4831	0.207	7	120.5386	0.646	1862	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<3>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3048	0.959	10	120.5386	0.646	1862	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<4>,1|C<2>,1|C<3>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4110	0.306	4	120.5386	0.646	1862	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.9083	1.195	3	120.5386	0.646	1862	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.6943	0.556	137	120.5386	0.646	1862	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.5335	0.330	2	120.5386	0.646	1862	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.9399	0.212	31	120.5386	0.646	1862	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	121.0705	0.226	2	120.5386	0.646	1862	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<4>}	H(C[6]C[6]2)	120.5920	0.350	81	120.5386	0.646	1862	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<3>}	H(C[6]C[6]2)	121.1550	0.000	1	120.5386	0.646	1862	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4379	1.000	120	120.5386	0.646	1862	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5113	0.513	230	120.5386	0.646	1862	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|N<3>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0953	0.060	4	120.5386	0.646	1862	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|O<2>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2595	0.066	2	120.5386	0.646	1862	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<4>,2|C<3>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4868	0.290	4	120.5386	0.646	1862	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<4>,2|C<3>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.7280	0.000	1	120.5386	0.646	1862	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<5>,1|C<2>,1|C<3>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5980	0.000	1	120.5386	0.646	1862	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<5>,1|C<2>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	122.8240	0.000	1	120.5386	0.646	1862	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5227	0.295	12	120.5386	0.646	1862	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.4150	0.286	4	120.5386	0.646	1862	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4200	0.000	1	120.5386	0.646	1862	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.5656	0.676	355	120.5386	0.646	1862	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	119.9437	1.035	3	120.5386	0.646	1862	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.2314	1.554	40	120.5386	0.646	1862	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.6100	0.139	2	120.5386	0.646	1862	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5583	0.691	121	120.5386	0.646	1862	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.4113	0.998	450	120.5386	0.646	1862	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|Si<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3650	0.031	2	120.5386	0.646	1862	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|O<2>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1780	0.322	2	120.5386	0.646	1862	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|O<2>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.8950	0.000	1	120.5386	0.646	1862	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	116.3255	1.839	2	120.5386	0.646	1862	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<2>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.4397	0.337	3	120.5386	0.646	1862	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<5>,1|C<4>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7670	0.000	1	120.5386	0.646	1862	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<5>,2|C<3>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4510	0.250	15	120.5386	0.646	1862	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<5>,2|C<3>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3600	0.010	2	120.5386	0.646	1862	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|Br<2>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6690	0.000	1	120.5386	0.646	1862	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.3704	1.247	25	120.5386	0.646	1862	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7837	0.106	16	120.5386	0.646	1862	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5276	0.376	26	120.5386	0.646	1862	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.6056	0.695	85	120.5386	0.646	1862	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|Si<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5840	0.000	1	120.5386	0.646	1862	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<6>,1|C<3>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.2230	0.000	1	120.5386	0.646	1862	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<6>,1|C<3>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|Si<5>,1|C<2>,1|H<1>}	H(C[6]C[6]2)	118.8600	0.000	1	120.5386	0.646	1862	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<6>,2|C<3>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	121.0610	0.000	1	120.5386	0.646	1862	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.1835	0.120	2	120.5386	0.646	1862	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<8>,2|C<3>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3100	0.000	1	120.5386	0.646	1862	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Er)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Er<15>,1|C<4>,1|H<1>}	C[6](N[6]C[6]Er)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7420	0.365	3	120.7420	0.133	3	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Eu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Eu<10>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Eu)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.8605	0.689	4	120.6238	0.356	23	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Eu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Eu<11>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Eu)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.8680	0.000	1	120.6238	0.356	23	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Eu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Eu<13>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Eu)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.6635	0.128	2	120.6238	0.356	23	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Eu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Eu<13>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Eu)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.4610	0.034	2	120.6238	0.356	23	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Eu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Eu<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Eu)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5593	0.678	12	120.6238	0.356	23	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Eu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Eu<9>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Eu)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.5380	0.966	2	120.6238	0.356	23	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<4>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	121.0950	0.000	1	120.4552	0.622	1916	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.9673	0.712	10	120.4552	0.622	1916	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.9420	0.000	1	120.4552	0.622	1916	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8643	0.111	12	120.4552	0.622	1916	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4843	0.253	16	120.4552	0.622	1916	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.7539	0.341	10	120.4552	0.622	1916	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.4913	0.952	42	120.4552	0.622	1916	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.9178	0.242	12	120.4552	0.622	1916	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<4>}	H(C[6]C[6]2)	120.2520	0.000	1	120.4552	0.622	1916	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4116	0.198	60	120.4552	0.622	1916	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|Fe<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.1470	0.000	1	120.4552	0.622	1916	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3547	0.619	35	120.4552	0.622	1916	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7085	0.035	2	120.4552	0.622	1916	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6798	0.402	5	120.4552	0.622	1916	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.9368	0.199	15	120.4552	0.622	1916	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.5512	0.481	846	120.4552	0.622	1916	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|C<3>,1|C<5>,1|H<1>}	H(C[6]C[6]2)	120.1763	0.441	6	120.4552	0.622	1916	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.8175	0.011	2	120.4552	0.622	1916	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6437	0.266	94	120.4552	0.622	1916	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<3>}	H(C[6]C[6]2)	120.4733	0.093	7	120.4552	0.622	1916	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<4>}	H(C[6]C[6]2)	120.2725	0.142	2	120.4552	0.622	1916	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3084	0.958	115	120.4552	0.622	1916	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3182	1.082	561	120.4552	0.622	1916	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|N<3>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1830	0.000	1	120.4552	0.622	1916	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|N<3>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5960	0.000	1	120.4552	0.622	1916	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|O<2>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.7630	0.815	6	120.4552	0.622	1916	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<6>,2|C<3>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4462	0.181	5	120.4552	0.622	1916	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.6678	0.181	13	120.4552	0.622	1916	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4150	0.142	4	120.4552	0.622	1916	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.4817	0.132	3	120.4552	0.622	1916	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<7>,1|C<4>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.7640	0.000	1	120.4552	0.622	1916	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<8>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.8480	0.000	1	120.4552	0.622	1916	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.6940	1.346	3	120.4552	0.622	1916	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|C<3>,1|C<5>,1|H<1>}	H(C[6]C[6]2)	120.3485	0.102	4	120.4552	0.622	1916	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	118.6146	2.026	16	120.4552	0.622	1916	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	121.0475	0.414	2	120.4552	0.622	1916	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ga)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ga<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ga)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.5490	0.000	1	119.9007	1.525	12	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ga)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ga<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ga)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8417	1.278	11	119.9007	1.525	12	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Hf)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Hf<10>,1|C<4>,1|H<1>}	C[6](N[6]C[6]Hf)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7610	0.000	1	120.7610	0.000	1	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Hg)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Hg<3>,1|C<3>,1|N<3>}	C[6](N[6]C[6]Hg)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.9350	0.000	1	120.6008	0.335	62	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Hg)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Hg<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Hg)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.7940	0.000	1	120.6008	0.335	62	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Hg)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Hg<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Hg)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.7050	0.000	1	120.6008	0.335	62	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Hg)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Hg<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Hg)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.6381	0.383	8	120.6008	0.335	62	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Hg)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Hg<4>,1|C<3>,1|N<3>}	C[6](N[6]C[6]Hg)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0649	0.311	11	120.6008	0.335	62	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Hg)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Hg<4>,2|C<3>}	C[6](N[6]C[6]Hg)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6500	0.655	31	120.6008	0.335	62	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Hg)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Hg<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Hg)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.7900	0.000	1	120.6008	0.335	62	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Hg)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Hg<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Hg)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	121.0070	0.341	8	120.6008	0.335	62	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]In)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|In<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]In)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.7790	0.141	2	120.5373	0.132	19	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]In)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|In<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]In)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3898	0.465	6	120.5373	0.132	19	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]In)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|In<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]In)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	121.0490	0.000	1	120.5373	0.132	19	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]In)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|In<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]In)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5262	0.293	10	120.5373	0.132	19	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<3>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4415	0.218	2	120.5452	0.347	1414	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<4>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7000	0.000	1	120.5452	0.347	1414	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<4>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4090	0.000	1	120.5452	0.347	1414	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.8780	0.685	3	120.5452	0.347	1414	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.6255	0.623	2	120.5452	0.347	1414	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3060	0.762	2	120.5452	0.347	1414	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8645	0.067	2	120.5452	0.347	1414	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4050	0.000	1	120.5452	0.347	1414	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.7223	0.433	8	120.5452	0.347	1414	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.4441	0.509	53	120.5452	0.347	1414	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,1|C<5>,1|H<1>}	H(C[6]C[6]2)	115.2640	0.000	1	120.5452	0.347	1414	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,1|C<6>,1|H<1>}	H(C[6]C[6]2)	120.0700	0.000	1	120.5452	0.347	1414	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	121.3980	0.000	1	120.5452	0.347	1414	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8206	0.597	19	120.5452	0.347	1414	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3743	0.455	53	120.5452	0.347	1414	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5852	0.537	1012	120.5452	0.347	1414	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|O<2>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1820	0.000	1	120.5452	0.347	1414	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|O<2>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.6893	0.451	3	120.5452	0.347	1414	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<7>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4310	0.085	2	120.5452	0.347	1414	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.3663	0.216	3	120.5452	0.347	1414	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,1|C<5>,1|H<1>}	H(C[6]C[6]2)	120.4420	0.000	1	120.5452	0.347	1414	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.7795	0.515	2	120.5452	0.347	1414	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<4>}	H(C[6]C[6]2)	119.6380	0.484	2	120.5452	0.347	1414	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5728	0.506	59	120.5452	0.347	1414	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|Ir<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9260	0.000	1	120.5452	0.347	1414	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<7>,1|C<4>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.3630	0.000	1	120.5452	0.347	1414	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<7>,1|C<4>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7750	0.000	1	120.5452	0.347	1414	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<7>,1|C<4>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<4>}	H(C[6]C[6]2)	120.7600	0.000	1	120.5452	0.347	1414	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<7>,1|C<4>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	121.0060	0.000	1	120.5452	0.347	1414	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.5980	0.000	1	120.5452	0.347	1414	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6860	0.000	1	120.5452	0.347	1414	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.8330	0.059	2	120.5452	0.347	1414	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.5481	0.473	32	120.5452	0.347	1414	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	119.9508	0.152	5	120.5452	0.347	1414	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5572	0.247	10	120.5452	0.347	1414	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<4>}	H(C[6]C[6]2)	120.0750	0.175	2	120.5452	0.347	1414	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	H(C[6]C[6]2)	120.6650	0.409	2	120.5452	0.347	1414	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7329	1.443	8	120.5452	0.347	1414	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.4170	0.873	99	120.5452	0.347	1414	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|N<3>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3390	0.014	2	120.5452	0.347	1414	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|O<2>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<3>}	H(C[6]C[6]2)	120.2870	0.173	3	120.5452	0.347	1414	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|O<2>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.9280	0.136	4	120.5452	0.347	1414	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<9>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.0445	0.568	2	120.5452	0.347	1414	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<9>,1|C<4>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.6940	0.000	1	120.5452	0.347	1414	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Li)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Li<3>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Li)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.7987	0.591	8	120.7298	0.228	92	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Li)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Li<3>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Li)(C[6]C[6]H)(H){1|Mg<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6890	0.000	1	120.7298	0.228	92	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Li)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Li<4>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Li)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.1890	0.246	2	120.7298	0.228	92	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Li)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Li<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Li)(C[6]C[6]H)(H){1|Al<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.0657	0.162	6	120.7298	0.228	92	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Li)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Li<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Li)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.8387	0.315	10	120.7298	0.228	92	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Li)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Li<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Li)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.3110	0.092	2	120.7298	0.228	92	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Li)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Li<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Li)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<3>}	H(C[6]C[6]2)	120.8125	0.094	4	120.7298	0.228	92	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Li)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Li<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Li)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5850	0.447	43	120.7298	0.228	92	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Li)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Li<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Li)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.7955	0.183	2	120.7298	0.228	92	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Li)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Li<4>,1|C<4>,1|H<1>}	C[6](N[6]C[6]Li)(C[6]C[6]H)(H){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	121.9980	0.000	1	120.7298	0.228	92	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Li)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Li<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Li)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.8688	0.362	5	120.7298	0.228	92	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Li)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Li<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Li)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.3700	0.000	1	120.7298	0.228	92	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Li)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Li<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Li)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4180	0.000	1	120.7298	0.228	92	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Li)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Li<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Li)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.8150	0.080	4	120.7298	0.228	92	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Li)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Li<5>,1|C<4>,1|H<1>}	C[6](N[6]C[6]Li)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<4>}	H(C[6]C[6]2)	120.4495	1.227	2	120.7298	0.228	92	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Mg)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mg<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mg)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	121.3335	0.095	2	120.7659	1.129	73	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Mg)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mg<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mg)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2071	1.018	18	120.7659	1.129	73	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Mg)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mg<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mg)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.8860	0.470	3	120.7659	1.129	73	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Mg)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mg<4>,1|C<4>,1|H<1>}	C[6](N[6]C[6]Mg)(C[6]C[6]H)(H){1|C<3>,3|H<1>}	H(C[6]C[6]2)	120.6800	0.000	1	120.7659	1.129	73	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Mg)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mg<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mg)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	121.1550	0.000	1	120.7659	1.129	73	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Mg)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mg<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mg)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6515	0.132	4	120.7659	1.129	73	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Mg)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mg<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mg)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.6717	0.213	3	120.7659	1.129	73	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Mg)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mg<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mg)(C[6]C[6]H)(H){1|Mg<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6060	0.000	1	120.7659	1.129	73	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Mg)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mg<5>,1|C<4>,1|H<1>}	C[6](N[6]C[6]Mg)(C[6]C[6]H)(H){1|C<3>,3|H<1>}	H(C[6]C[6]2)	127.8860	0.000	1	120.7659	1.129	73	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Mg)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mg<6>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Mg)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.6715	0.012	2	120.7659	1.129	73	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Mg)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mg<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mg)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.2106	0.201	11	120.7659	1.129	73	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Mg)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mg<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mg)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.7114	0.100	7	120.7659	1.129	73	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Mg)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mg<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mg)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.7330	0.000	1	120.7659	1.129	73	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Mg)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mg<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mg)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5430	0.303	15	120.7659	1.129	73	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Mg)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mg<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mg)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.7973	0.295	3	120.7659	1.129	73	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<3>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5790	0.000	1	120.5414	0.830	983	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.9118	0.135	5	120.5414	0.830	983	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4676	0.646	15	120.5414	0.830	983	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.6748	0.070	6	120.5414	0.830	983	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.6814	0.223	13	120.5414	0.830	983	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.9375	0.194	4	120.5414	0.830	983	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6111	0.180	14	120.5414	0.830	983	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5178	0.841	36	120.5414	0.830	983	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<5>,2|C<3>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2055	0.426	2	120.5414	0.830	983	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<6>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.2800	0.000	1	120.5414	0.830	983	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<6>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.0960	0.000	1	120.5414	0.830	983	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<6>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6770	0.000	2	120.5414	0.830	983	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.4418	1.033	238	120.5414	0.830	983	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.4386	0.485	5	120.5414	0.830	983	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8958	0.424	20	120.5414	0.830	983	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4699	0.991	81	120.5414	0.830	983	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.6201	0.671	418	120.5414	0.830	983	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<6>,1|C<3>,1|N<3>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2942	0.204	5	120.5414	0.830	983	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<6>,1|C<3>,1|N<3>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3840	0.000	1	120.5414	0.830	983	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<6>,1|C<3>,1|O<2>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3610	0.045	2	120.5414	0.830	983	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<6>,2|C<3>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5866	0.717	17	120.5414	0.830	983	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<6>,2|C<3>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.9755	0.023	2	120.5414	0.830	983	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.6686	0.410	39	120.5414	0.830	983	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4864	0.499	5	120.5414	0.830	983	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5034	0.344	21	120.5414	0.830	983	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.3706	3.708	16	120.5414	0.830	983	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<7>,2|C<3>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0430	0.000	1	120.5414	0.830	983	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.3655	0.057	2	120.5414	0.830	983	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5583	0.260	7	120.5414	0.830	983	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<9>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.7643	0.354	3	120.5414	0.830	983	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3054	0.299	7	120.3980	0.465	217	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<6>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.7390	0.000	1	120.3980	0.465	217	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.3318	0.589	21	120.3980	0.465	217	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.5162	0.247	12	120.3980	0.465	217	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.9615	0.233	2	120.3980	0.465	217	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0150	0.000	1	120.3980	0.465	217	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3998	0.615	46	120.3980	0.465	217	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3955	0.713	58	120.3980	0.465	217	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<6>,1|C<3>,1|O<2>}	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.1830	0.000	1	120.3980	0.465	217	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<6>,2|C<3>}	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	H(C[6]C[6]2)	120.5160	0.057	2	120.3980	0.465	217	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.4390	0.000	1	120.3980	0.465	217	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	H(C[6]C[6]2)	120.6437	0.368	3	120.3980	0.465	217	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3116	0.223	7	120.3980	0.465	217	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H){1|Se<2>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5230	0.057	2	120.3980	0.465	217	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.2241	1.549	16	120.3980	0.465	217	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.6070	0.064	2	120.3980	0.465	217	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	H(C[6]C[6]2)	120.6250	0.000	1	120.3980	0.465	217	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<3>}	H(C[6]C[6]2)	120.1470	0.000	1	120.3980	0.465	217	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5180	0.197	2	120.3980	0.465	217	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5850	0.254	11	120.3980	0.465	217	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<9>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.9120	0.345	2	120.3980	0.465	217	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<9>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.7970	0.000	1	120.3980	0.465	217	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<9>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	H(C[6]C[6]2)	120.8475	0.370	2	120.3980	0.465	217	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<9>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<3>}	H(C[6]C[6]2)	120.5095	0.005	2	120.3980	0.465	217	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<9>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2854	0.150	10	120.3980	0.465	217	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<9>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.6730	1.252	3	120.3980	0.465	217	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Nb)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Nb<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Nb)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6625	0.081	2	120.6640	0.051	11	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Nb)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Nb<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Nb)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6643	0.252	9	120.6640	0.051	11	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Nd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Nd<12>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Nd)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.6407	0.175	3	120.6407	0.031	3	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Br<1>,1|Ni<6>,1|C<3>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2245	0.098	2	120.5307	0.585	1606	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cl<1>,1|Ni<6>,1|C<3>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2078	0.117	6	120.5307	0.585	1606	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<3>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.7550	0.000	1	120.5307	0.585	1606	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.8833	0.141	4	120.5307	0.585	1606	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.5427	0.309	34	120.5307	0.585	1606	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8427	0.140	10	120.5307	0.585	1606	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3896	0.325	100	120.5307	0.585	1606	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.2327	1.159	81	120.5307	0.585	1606	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<5>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.7375	0.061	4	120.5307	0.585	1606	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.4209	1.210	39	120.5307	0.585	1606	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.9114	0.382	30	120.5307	0.585	1606	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	H(C[6]C[6]2)	120.6630	0.000	1	120.5307	0.585	1606	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5105	0.243	21	120.5307	0.585	1606	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.7107	0.400	23	120.5307	0.585	1606	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<5>,1|C<3>,1|N<3>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.4710	0.867	2	120.5307	0.585	1606	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<6>,1|C<2>,1|C<3>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4144	0.128	5	120.5307	0.585	1606	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5527	0.262	9	120.5307	0.585	1606	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.5988	0.782	320	120.5307	0.585	1606	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.4599	0.547	14	120.5307	0.585	1606	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6656	0.695	15	120.5307	0.585	1606	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<4>}	H(C[6]C[6]2)	121.1210	0.074	2	120.5307	0.585	1606	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	H(C[6]C[6]2)	120.8050	0.054	2	120.5307	0.585	1606	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<3>}	H(C[6]C[6]2)	120.6303	0.241	4	120.5307	0.585	1606	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<4>}	H(C[6]C[6]2)	120.3840	0.145	3	120.5307	0.585	1606	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4670	0.336	179	120.5307	0.585	1606	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|Cl<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4760	0.000	1	120.5307	0.585	1606	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5914	0.757	617	120.5307	0.585	1606	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|I<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2580	0.000	1	120.5307	0.585	1606	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|N<3>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.5920	1.025	6	120.5307	0.585	1606	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|N<3>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.7130	0.417	2	120.5307	0.585	1606	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|O<2>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9690	0.096	2	120.5307	0.585	1606	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|S<4>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.4860	0.854	4	120.5307	0.585	1606	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|C<2>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	118.7800	0.000	1	120.5307	0.585	1606	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<6>,2|C<3>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4045	0.182	22	120.5307	0.585	1606	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.9706	2.620	18	120.5307	0.585	1606	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3139	0.388	7	120.5307	0.585	1606	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.6062	0.301	10	120.5307	0.585	1606	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.0160	0.077	4	120.5307	0.585	1606	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Np)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Np<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Np)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5335	0.100	4	120.5335	0.010	4	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Os)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Os<10>,1|C<4>,1|H<1>}	C[6](N[6]C[6]Os)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.8210	0.000	1	120.4076	0.386	320	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Os)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Os<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Os)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	121.0397	1.645	7	120.4076	0.386	320	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Os)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Os<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Os)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	121.2600	0.000	1	120.4076	0.386	320	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Os)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Os<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Os)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7639	0.635	15	120.4076	0.386	320	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Os)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Os<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Os)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7780	0.269	2	120.4076	0.386	320	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Os)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Os<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Os)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.6155	0.602	2	120.4076	0.386	320	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Os)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Os<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Os)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.5141	0.258	7	120.4076	0.386	320	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Os)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Os<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Os)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.0747	0.536	10	120.4076	0.386	320	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Os)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Os<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Os)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6367	0.174	3	120.4076	0.386	320	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Os)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Os<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Os)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.1910	0.000	1	120.4076	0.386	320	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Os)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Os<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Os)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1653	0.580	10	120.4076	0.386	320	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Os)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Os<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Os)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3923	0.610	219	120.4076	0.386	320	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Os)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Os<6>,1|C<3>,1|O<2>}	C[6](N[6]C[6]Os)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.8555	0.391	4	120.4076	0.386	320	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Os)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Os<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Os)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.5990	0.320	2	120.4076	0.386	320	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Os)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Os<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Os)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3730	0.175	4	120.4076	0.386	320	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Os)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Os<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Os)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.2134	0.324	5	120.4076	0.386	320	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Os)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Os<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Os)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.3620	0.000	1	120.4076	0.386	320	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Os)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Os<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Os)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.2942	0.246	5	120.4076	0.386	320	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Os)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Os<8>,1|C<4>,1|H<1>}	C[6](N[6]C[6]Os)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.2680	0.256	3	120.4076	0.386	320	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Os)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Os<9>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Os)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.4670	0.245	2	120.4076	0.386	320	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Os)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Os<9>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Os)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.1850	0.048	2	120.4076	0.386	320	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Os)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Os<9>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Os)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0130	0.000	1	120.4076	0.386	320	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Os)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Os<9>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Os)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5403	0.691	3	120.4076	0.386	320	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Os)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Os<9>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Os)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3058	0.307	10	120.4076	0.386	320	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pb)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pb<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pb)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3590	0.000	1	120.3590	0.000	1	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Br<1>,1|Pd<4>,1|C<3>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0763	0.324	3	120.3722	0.665	1283	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cl<1>,1|Pd<4>,1|C<3>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0750	0.415	26	120.3722	0.665	1283	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<3>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5660	0.064	2	120.3722	0.665	1283	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<2>,1|C<3>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1662	0.663	14	120.3722	0.665	1283	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<2>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	114.4960	0.000	1	120.3722	0.665	1283	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.9067	0.398	3	120.3722	0.665	1283	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0498	0.617	10	120.3722	0.665	1283	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6056	0.205	5	120.3722	0.665	1283	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.4692	0.521	172	120.3722	0.665	1283	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.6110	0.203	6	120.3722	0.665	1283	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6015	0.420	75	120.3722	0.665	1283	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.8236	0.338	8	120.3722	0.665	1283	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<4>}	H(C[6]C[6]2)	120.9285	0.894	2	120.3722	0.665	1283	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	H(C[6]C[6]2)	120.8019	0.255	9	120.3722	0.665	1283	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<3>}	H(C[6]C[6]2)	119.8720	0.363	3	120.3722	0.665	1283	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4114	0.648	402	120.3722	0.665	1283	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|Cl<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9190	0.222	2	120.3722	0.665	1283	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3376	1.012	373	120.3722	0.665	1283	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|Se<2>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.8400	0.000	1	120.3722	0.665	1283	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|I<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3210	0.000	1	120.3722	0.665	1283	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|N<2>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9690	0.000	1	120.3722	0.665	1283	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|N<3>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7176	0.618	52	120.3722	0.665	1283	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|O<2>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.1698	0.469	11	120.3722	0.665	1283	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.3230	9.006	2	120.3722	0.665	1283	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,1|Si<4>,1|C<3>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3963	0.285	12	120.3722	0.665	1283	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,2|C<3>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9623	0.987	3	120.3722	0.665	1283	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,2|C<3>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5762	0.709	21	120.3722	0.665	1283	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,2|C<3>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5005	0.186	4	120.3722	0.665	1283	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.3935	0.247	4	120.3722	0.665	1283	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8524	0.217	7	120.3722	0.665	1283	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.7367	0.356	9	120.3722	0.665	1283	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.2432	1.775	6	120.3722	0.665	1283	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.5764	0.451	8	120.3722	0.665	1283	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5210	0.249	5	120.3722	0.665	1283	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.4596	0.150	10	120.3722	0.665	1283	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.7965	1.391	2	120.3722	0.665	1283	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5809	0.294	7	120.3722	0.665	1283	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5140	0.000	1	120.3722	0.665	1283	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Br<1>,1|Pt<6>,1|C<3>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3620	0.000	1	120.4327	0.402	1232	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<4>,1|C<2>,1|C<3>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4464	0.493	7	120.4327	0.402	1232	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3810	0.311	4	120.4327	0.402	1232	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|F<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.8375	0.499	2	120.4327	0.402	1232	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7815	0.054	2	120.4327	0.402	1232	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4317	0.721	6	120.4327	0.402	1232	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.3499	0.963	75	120.4327	0.402	1232	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.5178	0.656	9	120.4327	0.402	1232	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6398	0.289	50	120.4327	0.402	1232	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	121.7430	0.000	1	120.4327	0.402	1232	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3889	0.339	117	120.4327	0.402	1232	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.4196	0.603	712	120.4327	0.402	1232	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|Se<2>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.7620	0.000	1	120.4327	0.402	1232	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|Si<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6317	0.522	10	120.4327	0.402	1232	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|N<3>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	118.1662	4.255	4	120.4327	0.402	1232	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|O<2>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4630	0.000	1	120.4327	0.402	1232	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|O<2>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3350	0.000	1	120.4327	0.402	1232	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|C<2>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	122.9960	0.000	1	120.4327	0.402	1232	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<4>,2|C<3>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3743	0.363	10	120.4327	0.402	1232	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<4>,2|C<3>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.0435	0.868	4	120.4327	0.402	1232	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6260	0.000	1	120.4327	0.402	1232	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.5655	0.728	2	120.4327	0.402	1232	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.1940	0.000	1	120.4327	0.402	1232	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.9280	0.000	1	120.4327	0.402	1232	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6429	0.243	8	120.4327	0.402	1232	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.6789	0.507	15	120.4327	0.402	1232	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<6>,1|C<2>,1|C<3>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3760	0.347	7	120.4327	0.402	1232	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7967	0.224	7	120.4327	0.402	1232	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.6501	0.289	18	120.4327	0.402	1232	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7162	0.299	5	120.4327	0.402	1232	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3172	0.442	20	120.4327	0.402	1232	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.4734	0.524	109	120.4327	0.402	1232	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|Si<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7925	0.191	6	120.4327	0.402	1232	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<6>,1|C<3>,1|O<2>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0160	0.041	2	120.4327	0.402	1232	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<6>,2|C<3>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9765	0.144	2	120.4327	0.402	1232	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|Si<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3727	0.224	8	120.4327	0.402	1232	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){2|Pt<4>,1|C<3>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.7525	0.040	2	120.4327	0.402	1232	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pu<11>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pu)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2548	0.173	4	120.0132	0.314	5	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pu<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pu)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.0470	0.000	1	120.0132	0.314	5	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<5>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4965	0.730	11	120.3725	0.607	626	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.1000	0.000	1	120.3725	0.607	626	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6223	1.378	23	120.3725	0.607	626	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.4630	0.400	8	120.3725	0.607	626	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<5>,2|C<3>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.7730	1.502	2	120.3725	0.607	626	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<6>,1|C<2>,1|C<3>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2760	0.000	1	120.3725	0.607	626	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.5670	0.000	1	120.3725	0.607	626	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5935	0.364	4	120.3725	0.607	626	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	121.0230	0.000	1	120.3725	0.607	626	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2630	0.000	1	120.3725	0.607	626	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.3761	0.755	90	120.3725	0.607	626	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.0853	1.249	15	120.3725	0.607	626	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5968	0.433	39	120.3725	0.607	626	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	121.1050	0.000	1	120.3725	0.607	626	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<3>}	H(C[6]C[6]2)	120.5245	0.006	2	120.3725	0.607	626	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1995	0.580	80	120.3725	0.607	626	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3768	0.819	301	120.3725	0.607	626	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|N<2>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	118.5080	0.000	1	120.3725	0.607	626	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|N<3>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0367	0.240	6	120.3725	0.607	626	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|N<3>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.8498	0.125	6	120.3725	0.607	626	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|O<2>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.8663	0.758	3	120.3725	0.607	626	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<6>,2|C<3>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3276	0.459	18	120.3725	0.607	626	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.1255	0.039	2	120.3725	0.607	626	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|C<3>,1|C<5>,1|H<1>}	H(C[6]C[6]2)	120.5400	0.354	4	120.3725	0.607	626	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.4770	0.000	1	120.3725	0.607	626	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3665	0.093	2	120.3725	0.607	626	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.4600	0.000	1	120.3725	0.607	626	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<8>,1|C<4>,1|H<1>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	H(C[6]C[6]2)	120.1960	0.000	1	120.3725	0.607	626	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<4>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4535	0.247	2	120.4900	1.615	323	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<4>}	H(C[6]C[6]2)	120.5400	0.000	1	120.4900	1.615	323	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	121.9993	3.463	12	120.4900	1.615	323	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5523	0.690	7	120.4900	1.615	323	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<5>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2810	0.000	1	120.4900	1.615	323	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.7756	1.035	7	120.4900	1.615	323	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.8387	0.125	3	120.4900	1.615	323	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6422	0.261	21	120.4900	1.615	323	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9778	2.946	8	120.4900	1.615	323	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5105	0.413	12	120.4900	1.615	323	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<6>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.8670	0.000	1	120.4900	1.615	323	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.5667	2.338	19	120.4900	1.615	323	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.4320	0.321	2	120.4900	1.615	323	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7910	0.357	9	120.4900	1.615	323	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3169	1.433	48	120.4900	1.615	323	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5132	0.335	32	120.4900	1.615	323	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<6>,1|C<4>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.9950	0.052	2	120.4900	1.615	323	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.7105	0.151	2	120.4900	1.615	323	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.2906	0.133	5	120.4900	1.615	323	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<8>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.7715	0.036	2	120.4900	1.615	323	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.2912	1.720	14	120.4900	1.615	323	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.2200	0.000	1	120.4900	1.615	323	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8263	0.187	4	120.4900	1.615	323	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.7470	0.000	1	120.4900	1.615	323	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<4>}	H(C[6]C[6]2)	120.5620	0.000	1	120.4900	1.615	323	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	H(C[6]C[6]2)	120.6760	0.000	1	120.4900	1.615	323	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9559	1.154	9	120.4900	1.615	323	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5943	0.292	80	120.4900	1.615	323	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<8>,1|C<3>,1|O<2>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<3>}	H(C[6]C[6]2)	119.9058	0.415	6	120.4900	1.615	323	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<8>,2|C<3>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	121.1460	0.109	2	120.4900	1.615	323	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<8>,2|C<3>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2945	0.029	2	120.4900	1.615	323	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<9>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.6852	0.179	4	120.4900	1.615	323	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<9>,1|C<4>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	H(C[6]C[6]2)	120.4370	0.075	2	120.4900	1.615	323	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cl<1>,1|Ru<6>,1|C<3>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3410	0.000	1	120.3748	0.765	1717	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<10>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,1|C<5>,1|H<1>}	H(C[6]C[6]2)	119.8615	0.028	2	120.3748	0.765	1717	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<10>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.4025	0.271	2	120.3748	0.765	1717	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<10>,1|C<4>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.5040	0.000	1	120.3748	0.765	1717	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<10>,2|C<4>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.3745	0.056	2	120.3748	0.765	1717	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<5>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	122.8490	4.311	4	120.3748	0.765	1717	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.4710	0.706	23	120.3748	0.765	1717	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5753	0.798	40	120.3748	0.765	1717	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.5785	2.371	32	120.3748	0.765	1717	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5859	0.306	13	120.3748	0.765	1717	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1977	0.714	4	120.3748	0.765	1717	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.9105	0.011	2	120.3748	0.765	1717	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7947	0.286	8	120.3748	0.765	1717	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.5286	0.511	124	120.3748	0.765	1717	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.6543	0.415	15	120.3748	0.765	1717	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7205	0.580	22	120.3748	0.765	1717	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	H(C[6]C[6]2)	120.3316	0.224	5	120.3748	0.765	1717	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1826	0.966	182	120.3748	0.765	1717	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3757	0.842	941	120.3748	0.765	1717	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|N<3>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9153	0.130	3	120.3748	0.765	1717	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|O<2>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.4440	0.000	1	120.3748	0.765	1717	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<6>,1|C<4>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.2960	0.000	1	120.3748	0.765	1717	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<6>,2|C<3>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3386	0.135	5	120.3748	0.765	1717	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.6909	1.459	8	120.3748	0.765	1717	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.0431	0.349	10	120.3748	0.765	1717	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1935	0.078	2	120.3748	0.765	1717	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.2684	0.419	30	120.3748	0.765	1717	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<7>,1|C<4>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4405	0.243	2	120.3748	0.765	1717	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<7>,1|C<4>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<4>}	H(C[6]C[6]2)	120.1020	0.000	1	120.3748	0.765	1717	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<7>,1|C<4>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.4500	0.000	1	120.3748	0.765	1717	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<7>,1|C<4>,1|O<2>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.6075	0.269	2	120.3748	0.765	1717	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.3970	0.225	2	120.3748	0.765	1717	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.6690	0.027	2	120.3748	0.765	1717	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7577	0.566	18	120.3748	0.765	1717	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4229	0.142	12	120.3748	0.765	1717	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3944	0.297	29	120.3748	0.765	1717	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<8>,1|C<4>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.4627	0.172	3	120.3748	0.765	1717	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<9>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4380	0.000	1	120.3748	0.765	1717	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<9>,1|C<3>,1|F<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.7422	0.265	6	120.3748	0.765	1717	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<9>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.9155	0.190	2	120.3748	0.765	1717	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<9>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.4607	0.405	22	120.3748	0.765	1717	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<9>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.3417	0.491	3	120.3748	0.765	1717	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<9>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4381	0.437	20	120.3748	0.765	1717	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<9>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.6140	0.010	2	120.3748	0.765	1717	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<9>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<4>}	H(C[6]C[6]2)	120.4760	0.000	1	120.3748	0.765	1717	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<9>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.6532	1.720	12	120.3748	0.765	1717	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<9>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3795	0.315	80	120.3748	0.765	1717	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<9>,1|C<3>,1|O<2>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.6367	0.219	3	120.3748	0.765	1717	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<9>,1|C<3>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<2>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7930	0.000	2	120.3748	0.765	1717	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<9>,1|C<4>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<4>}	H(C[6]C[6]2)	120.0120	0.000	1	120.3748	0.765	1717	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<9>,2|C<3>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2223	0.671	7	120.3748	0.765	1717	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Sb)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sb<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Sb)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.8905	0.723	2	120.8905	0.523	2	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Sc)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sc<13>,1|C<4>,1|H<1>}	C[6](N[6]C[6]Sc)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	H(C[6]C[6]2)	121.4710	0.000	1	120.4800	0.206	7	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Sc)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sc<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Sc)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2580	0.124	4	120.4800	0.206	7	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Sc)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sc<9>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Sc)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4285	0.062	2	120.4800	0.206	7	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Si)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Si<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Si)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	H(C[6]C[6]2)	120.6440	0.000	1	120.2076	0.265	8	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Si)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Si<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Si)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1250	0.697	4	120.2076	0.265	8	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Si)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Si<6>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Si)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0200	0.195	2	120.2076	0.265	8	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Si)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Si<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Si)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4770	0.000	1	120.2076	0.265	8	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Sm)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sm<10>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Sm)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.8100	0.706	2	120.5694	0.186	17	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Sm)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sm<12>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Sm)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6328	0.185	4	120.5694	0.186	17	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Sm)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sm<13>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Sm)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.8885	0.381	2	120.5694	0.186	17	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Sm)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sm<14>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Sm)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6060	0.277	3	120.5694	0.186	17	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Sm)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sm<14>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Sm)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3450	0.000	1	120.5694	0.186	17	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Sm)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sm<15>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Sm)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.9685	0.750	2	120.5694	0.186	17	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Sm)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sm<9>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Sm)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5503	0.209	3	120.5694	0.186	17	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Sn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sn<3>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Sn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.9369	0.509	14	120.7109	0.185	101	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Sn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sn<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Sn)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.9924	0.433	9	120.7109	0.185	101	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Sn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sn<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Sn)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	H(C[6]C[6]2)	120.7499	0.202	9	120.7109	0.185	101	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Sn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sn<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Sn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.7310	0.337	10	120.7109	0.185	101	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Sn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sn<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Sn)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	H(C[6]C[6]2)	120.8172	0.217	6	120.7109	0.185	101	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Sn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Sn)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.0995	0.438	2	120.7109	0.185	101	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Sn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Sn)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	H(C[6]C[6]2)	120.7747	0.079	3	120.7109	0.185	101	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Sn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Sn)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5657	0.245	6	120.7109	0.185	101	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Sn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Sn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5656	0.296	27	120.7109	0.185	101	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Sn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Sn)(C[6]C[6]H)(H){1|Se<2>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5497	0.175	3	120.7109	0.185	101	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Sn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sn<6>,1|C<3>,1|O<2>}	C[6](N[6]C[6]Sn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	118.2580	0.000	1	120.7109	0.185	101	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Sn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sn<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Sn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.6612	0.349	4	120.7109	0.185	101	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Sn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sn<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Sn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.7025	0.176	4	120.7109	0.185	101	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Sn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sn<9>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Sn)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.7467	0.184	3	120.7109	0.185	101	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Sr)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sr<10>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Sr)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.9620	0.086	2	120.8131	0.061	15	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Sr)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sr<12>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Sr)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	121.1260	0.024	2	120.8131	0.061	15	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Sr)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sr<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Sr)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.7367	0.256	6	120.8131	0.061	15	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Sr)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sr<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Sr)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.7202	0.222	5	120.8131	0.061	15	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ta)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ta<10>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ta)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.8720	0.000	1	120.3726	0.424	13	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ta)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ta<10>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ta)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6515	0.866	2	120.3726	0.424	13	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ta)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ta<10>,1|C<4>,1|H<1>}	C[6](N[6]C[6]Ta)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.4265	0.510	2	120.3726	0.424	13	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ta)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ta<13>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Ta)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.5065	0.278	2	120.3726	0.424	13	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ta)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ta<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ta)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1338	0.802	6	120.3726	0.424	13	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Tc)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Tc<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Tc)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.5605	0.012	2	120.2891	0.765	27	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Tc)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Tc<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Tc)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2918	0.365	21	120.2891	0.765	27	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Tc)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Tc<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Tc)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.1397	2.380	4	120.2891	0.765	27	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Te)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Te<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Te)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.8440	0.000	1	120.4477	0.144	3	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Te)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Te<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Te)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.2495	0.227	2	120.4477	0.144	3	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Th)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Th<14>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Th)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.3150	0.000	1	121.3150	0.000	1	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ti)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ti<10>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ti)(C[6]C[6]H)(H){1|C<3>,1|C<5>,1|H<1>}	H(C[6]C[6]2)	120.3540	0.000	1	120.4573	0.048	90	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ti)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ti<10>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ti)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5000	0.125	5	120.4573	0.048	90	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ti)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ti<10>,1|C<4>,1|H<1>}	C[6](N[6]C[6]Ti)(C[6]C[6]H)(H){1|C<3>,1|C<5>,1|H<1>}	H(C[6]C[6]2)	121.0820	0.000	1	120.4573	0.048	90	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ti)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ti<11>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ti)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.8230	0.047	2	120.4573	0.048	90	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ti)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ti<11>,1|C<4>,1|H<1>}	C[6](N[6]C[6]Ti)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.4665	0.129	2	120.4573	0.048	90	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ti)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ti<12>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ti)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4478	0.214	10	120.4573	0.048	90	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ti)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ti<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ti)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5120	0.169	12	120.4573	0.048	90	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ti)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ti<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ti)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3271	0.233	28	120.4573	0.048	90	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ti)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ti<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ti)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5180	0.000	1	120.4573	0.048	90	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ti)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ti<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ti)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5096	0.082	8	120.4573	0.048	90	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ti)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ti<7>,1|C<4>,1|H<1>}	C[6](N[6]C[6]Ti)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.9470	0.000	1	120.4573	0.048	90	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ti)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ti<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ti)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4726	0.140	14	120.4573	0.048	90	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ti)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ti<9>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Ti)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.7760	0.182	2	120.4573	0.048	90	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ti)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ti<9>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ti)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4030	0.086	2	120.4573	0.048	90	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ti)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ti<9>,1|C<4>,1|H<1>}	C[6](N[6]C[6]Ti)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3450	0.000	1	120.4573	0.048	90	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Yb)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Yb<15>,1|C<4>,1|H<1>}	C[6](N[6]C[6]Yb)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8910	0.000	1	120.8910	0.000	1	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cl<1>,1|Zn<4>,1|C<3>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4403	0.241	6	120.5676	0.502	1088	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<3>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	118.4540	0.000	1	120.5676	0.502	1088	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<4>,1|C<2>,1|C<3>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3380	0.007	2	120.5676	0.502	1088	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<4>,1|C<2>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<2>,1|H<1>}	H(C[6]C[6]2)	117.0790	0.000	1	120.5676	0.502	1088	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<4>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3503	0.113	9	120.5676	0.502	1088	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<4>,1|C<3>,1|F<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2333	0.104	3	120.5676	0.502	1088	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.6410	0.314	62	120.5676	0.502	1088	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	121.0117	0.188	6	120.5676	0.502	1088	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.9119	0.607	36	120.5676	0.502	1088	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<4>}	H(C[6]C[6]2)	121.0590	0.000	1	120.5676	0.502	1088	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<3>}	H(C[6]C[6]2)	120.4420	0.000	1	120.5676	0.502	1088	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	H(C[6]C[6]2)	120.8220	0.000	1	120.5676	0.502	1088	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5339	0.659	74	120.5676	0.502	1088	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.6513	0.673	114	120.5676	0.502	1088	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<4>,1|C<3>,1|I<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3255	1.158	2	120.5676	0.502	1088	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<4>,1|C<3>,1|N<3>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1593	0.344	12	120.5676	0.502	1088	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<4>,1|C<3>,1|O<2>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.6830	0.000	1	120.5676	0.502	1088	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<4>,1|C<3>,1|S<2>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	121.6040	0.000	1	120.5676	0.502	1088	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<4>,2|C<3>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0428	1.146	5	120.5676	0.502	1088	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<5>,1|C<2>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9040	0.000	1	120.5676	0.502	1088	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<5>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5953	0.088	3	120.5676	0.502	1088	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<5>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3825	0.141	2	120.5676	0.502	1088	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.4971	0.806	136	120.5676	0.502	1088	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.9165	0.081	2	120.5676	0.502	1088	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.0917	0.414	13	120.5676	0.502	1088	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	H(C[6]C[6]2)	120.8360	0.000	1	120.5676	0.502	1088	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3829	1.026	116	120.5676	0.502	1088	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.6904	0.367	169	120.5676	0.502	1088	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<5>,1|C<3>,1|N<3>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1523	0.297	3	120.5676	0.502	1088	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<5>,1|C<3>,1|N<3>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3760	0.000	1	120.5676	0.502	1088	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<5>,1|C<3>,1|O<2>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.9550	0.000	1	120.5676	0.502	1088	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<5>,2|C<3>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3480	0.166	3	120.5676	0.502	1088	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<6>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	H(C[6]C[6]2)	121.1610	0.011	2	120.5676	0.502	1088	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<6>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.7360	0.000	1	120.5676	0.502	1088	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.6311	0.600	74	120.5676	0.502	1088	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.8160	0.148	2	120.5676	0.502	1088	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.9838	0.222	4	120.5676	0.502	1088	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4797	0.153	25	120.5676	0.502	1088	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5296	0.861	175	120.5676	0.502	1088	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<6>,1|C<3>,1|N<2>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5230	0.000	1	120.5676	0.502	1088	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<6>,1|C<3>,1|N<3>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3140	0.100	2	120.5676	0.502	1088	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<6>,1|C<3>,1|O<2>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.0030	0.027	3	120.5676	0.502	1088	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<6>,2|C<3>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3513	0.153	9	120.5676	0.502	1088	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<6>,2|C<3>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.8670	0.000	1	120.5676	0.502	1088	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Zr)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zr<10>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zr)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4985	0.006	2	120.6914	0.111	19	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Zr)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zr<13>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zr)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0440	0.000	1	120.6914	0.111	19	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Zr)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zr<13>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zr)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5870	0.000	1	120.6914	0.111	19	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Zr)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zr<14>,1|C<4>,1|H<1>}	C[6](N[6]C[6]Zr)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.6707	0.176	3	120.6914	0.111	19	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Zr)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zr<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zr)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6680	0.052	4	120.6914	0.111	19	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Zr)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zr<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zr)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.8923	0.440	3	120.6914	0.111	19	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Zr)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zr<8>,1|C<4>,1|H<1>}	C[6](N[6]C[6]Zr)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.2980	0.177	2	120.6914	0.111	19	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Zr)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zr<9>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zr)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5170	0.150	3	120.6914	0.111	19	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|P<3>,2|C<3>}	H(C[6]C[6]2)	119.7700	1.531	3	120.1999	0.342	23	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.9640	0.000	1	120.1999	0.342	23	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,1|P<3>,3|C<3>}	H(C[6]C[6]2)	120.6580	0.000	1	120.1999	0.342	23	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,1|P<4>,3|C<3>}	H(C[6]C[6]2)	120.6520	0.000	1	120.1999	0.342	23	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(H){2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.1772	0.282	17	120.1999	0.342	23	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]Ga[3x6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ga<5>,1|C<3>,1|H<1>}	C[6](N[6]Ga[3x6]C[6])(C[6]C[6]H)(H){1|C<3>,2|H<1>,2|N<3>,2|O<2>}	H(C[6]C[6]2)	120.4045	0.158	2	120.4045	0.025	2	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]Ga[5]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ga<4>,1|C<3>,1|H<1>}	C[6](N[6]Ga[5]C[6])(C[6]C[6]H)(H){1|C<3>,1|I<1>,2|H<1>,2|N<3>}	H(C[6]C[6]2)	120.4535	0.062	2	120.5134	0.008	8	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]Ga[5]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ga<4>,1|C<3>,1|H<1>}	C[6](N[6]Ga[5]C[6])(C[6]C[6]H)(H){1|C<3>,1|P<2>,2|H<1>,2|N<3>}	H(C[6]C[6]2)	120.5333	0.089	6	120.5134	0.008	8	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]Ga[6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ga<4>,1|C<3>,1|H<1>}	C[6](N[6]Ga[6]C[6])(C[6]C[6]H)(H){1|C<3>,1|P<2>,2|H<1>,2|N<3>}	H(C[6]C[6]2)	120.6595	0.035	2	120.6048	0.024	5	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]Ga[6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ga<4>,1|C<3>,1|H<1>}	C[6](N[6]Ga[6]C[6])(C[6]C[6]H)(H){1|Cl<1>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.4870	0.211	2	120.6048	0.024	5	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]Ga[6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ga<5>,1|C<3>,1|H<1>}	C[6](N[6]Ga[6]C[6])(C[6]C[6]H)(H){2|Cl<1>,1|C<3>,1|C<4>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.7310	0.000	1	120.6048	0.024	5	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]Ge[4x6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ge<5>,1|C<3>,1|H<1>}	C[6](N[6]Ge[4x6]C[6])(C[6]C[6]H)(H){1|C<3>,2|H<1>,4|N<3>}	H(C[6]C[6]2)	120.6430	0.000	1	120.6430	0.000	1	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]In[3x5]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|In<6>,1|C<3>,1|H<1>}	C[6](N[6]In[3x5]C[6])(C[6]C[6]H)(H){1|Cl<1>,1|C<3>,1|N<4>,2|H<1>,3|N<3>}	H(C[6]C[6]2)	120.4820	0.066	2	120.4820	0.004	2	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]In[5]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|In<6>,1|C<3>,1|H<1>}	C[6](N[6]In[5]C[6])(C[6]C[6]H)(H){1|Cl<1>,1|C<3>,2|H<1>,2|N<3>,2|O<2>}	H(C[6]C[6]2)	120.3990	0.178	4	120.3990	0.032	4	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]In[6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|In<4>,1|C<3>,1|H<1>}	C[6](N[6]In[6]C[6])(C[6]C[6]H)(H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.5600	0.040	2	120.5600	0.002	2	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]N[6]Ce)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ce<17>,1|H<1>,1|N<3>}	C[6](N[6]N[6]Ce)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.1085	0.380	2	121.1085	0.144	2	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]N[6]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<6>,1|H<1>,1|N<2>}	C[6](N[6]N[6]Co)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.3623	0.115	4	121.3623	0.013	4	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]N[6]Ni)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<6>,1|H<1>,1|N<2>}	C[6](N[6]N[6]Ni)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.3290	0.209	10	121.3022	0.036	14	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]N[6]Ni)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<6>,1|H<1>,1|N<3>}	C[6](N[6]N[6]Ni)(C[6]C[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.2352	0.134	4	121.3022	0.036	14	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]N[6]Pd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,1|H<1>,1|N<2>}	C[6](N[6]N[6]Pd)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.3033	0.442	4	121.3033	0.195	4	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]N[6]Re)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<6>,1|H<1>,1|N<2>}	C[6](N[6]N[6]Re)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3610	0.000	1	120.9956	0.084	7	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]N[6]Re)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<6>,1|H<1>,1|N<3>}	C[6](N[6]N[6]Re)(C[6]C[6]H)(H){1|Re<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.1013	0.085	6	120.9956	0.084	7	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]N[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<6>,1|H<1>,1|N<2>}	C[6](N[6]N[6]Ru)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.0240	0.000	1	121.0240	0.000	1	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]N[6]Zn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<4>,1|H<1>,1|N<2>}	C[6](N[6]N[6]Zn)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.3775	0.239	4	121.3775	0.057	4	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]Nb[3,3,3x6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Nb<8>,1|C<3>,1|H<1>}	C[6](N[6]Nb[3,3,3x6]C[6])(C[6]C[6]H)(H){2|C<4>,2|H<1>,3|C<3>,3|N<3>}	H(C[6]C[6]2)	120.2300	0.025	2	120.2300	0.001	2	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]Nb[3,3]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Nb<6>,1|C<3>,1|H<1>}	C[6](N[6]Nb[3,3]C[6])(C[6]C[6]H)(H){1|Nb<6>,1|C<3>,1|N<2>,1|N<3>,2|H<1>,2|O<2>}	H(C[6]C[6]2)	120.3570	0.386	2	120.3570	0.149	2	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]Nb[3x3]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Nb<7>,1|C<3>,1|H<1>}	C[6](N[6]Nb[3x3]C[6])(C[6]C[6]H)(H){1|Cl<1>,1|Cl<2>,1|Nb<7>,1|C<3>,2|H<1>,3|N<3>}	H(C[6]C[6]2)	120.4165	0.166	4	120.2378	0.144	12	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]Nb[3x3]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Nb<7>,1|C<3>,1|H<1>}	C[6](N[6]Nb[3x3]C[6])(C[6]C[6]H)(H){1|Cl<1>,1|Nb<7>,3|Cl<2>,1|C<3>,1|N<2>,2|H<1>}	H(C[6]C[6]2)	120.2730	0.523	2	120.2378	0.144	12	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]Nb[3x3]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Nb<7>,1|C<3>,1|H<1>}	C[6](N[6]Nb[3x3]C[6])(C[6]C[6]H)(H){1|Cl<2>,1|Nb<7>,2|Cl<1>,1|C<3>,2|H<1>,2|N<3>}	H(C[6]C[6]2)	120.5910	0.345	2	120.2378	0.144	12	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]Nb[3x3]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Nb<7>,1|C<3>,1|H<1>}	C[6](N[6]Nb[3x3]C[6])(C[6]C[6]H)(H){1|Nb<7>,3|Cl<2>,1|C<3>,1|N<2>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.8648	0.239	4	120.2378	0.144	12	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]Nb[3x5]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Nb<7>,1|C<3>,1|H<1>}	C[6](N[6]Nb[3x5]C[6])(C[6]C[6]H)(H){1|C<3>,2|H<1>,6|O<2>}	H(C[6]C[6]2)	120.0945	0.299	2	120.0945	0.089	2	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]Nb[3x6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Nb<6>,1|C<3>,1|H<1>}	C[6](N[6]Nb[3x6]C[6])(C[6]C[6]H)(H){1|C<3>,1|N<2>,1|P<4>,2|H<1>,3|N<3>}	H(C[6]C[6]2)	120.4965	0.032	2	120.4220	0.049	4	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]Nb[3x6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Nb<6>,1|C<3>,1|H<1>}	C[6](N[6]Nb[3x6]C[6])(C[6]C[6]H)(H){1|Cl<1>,1|C<3>,1|N<2>,2|H<1>,3|N<3>}	H(C[6]C[6]2)	120.3475	0.351	2	120.4220	0.049	4	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]Nb[5]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Nb<5>,1|C<3>,1|H<1>}	C[6](N[6]Nb[5]C[6])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>,2|N<2>}	H(C[6]C[6]2)	120.4305	0.414	2	120.4305	0.171	2	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]Nb[6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Nb<6>,1|C<3>,1|H<1>}	C[6](N[6]Nb[6]C[6])(C[6]C[6]H)(H){1|C<3>,1|N<2>,2|C<2>,2|H<1>,2|N<3>}	H(C[6]C[6]2)	120.3450	0.000	1	120.3450	0.000	1	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]Si[4]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Si<5>,1|C<3>,1|H<1>}	C[6](N[6]Si[4]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,1|S<1>,1|S<2>,2|C<3>}	H(C[6]C[6]2)	120.3793	0.069	3	120.3793	0.005	3	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]I)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]I)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|I<1>}	H(C[6]C[6]2)	120.3180	0.011	2	120.3180	0.000	2	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]I)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]I)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|I<1>,2|C<3>}	H(C[6]C[6]2)	120.8685	0.114	2	120.8685	0.013	2	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]B[3a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](N[6]B[3a]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,4|C<3>}	H(C[6]C[6]2)	119.9865	0.077	2	119.9865	0.006	2	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]B[3x6a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](N[6]B[3x6a]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,4|C<3>}	H(C[6]C[6]2)	119.8655	0.093	4	119.8655	0.009	4	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]B[5]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](N[6]B[5]C[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.0270	0.161	2	119.9292	0.027	4	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]B[5]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](N[6]B[5]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,4|C<3>}	H(C[6]C[6]2)	119.8315	0.135	2	119.9292	0.027	4	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]B[5a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|B<3>,1|C<3>,1|H<1>}	C[6](N[6]B[5a]C[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,3|N<3>}	H(C[6]C[6]2)	119.5850	0.246	2	119.5850	0.061	2	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]B[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](N[6]B[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|N<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.9920	0.040	2	119.9920	0.002	2	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]B[6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](N[6]B[6]C[6])(C[6]C[6]H)(H){1|C<3>,1|N<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	120.0030	0.004	2	119.9213	0.018	6	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]B[6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](N[6]B[6]C[6])(C[6]C[6]H)(H){1|C<3>,2|H<1>,3|N<3>}	H(C[6]C[6]2)	119.8480	0.188	2	119.9213	0.018	6	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]B[6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](N[6]B[6]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	119.9130	0.168	2	119.9213	0.018	6	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]C[4]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](N[6]C[4]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	119.7235	0.023	2	119.6547	0.014	3	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]C[4]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](N[6]C[4]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	119.5170	0.000	1	119.6547	0.014	3	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]C[5]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](N[6]C[5]C[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.5015	0.575	2	119.5015	0.330	2	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ag)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Ag<2>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ag)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0025	0.029	2	120.0733	0.008	4	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ag)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Ag<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ag)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1440	0.059	2	120.0733	0.008	4	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]C[6]Al)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Al<3>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Al)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9417	0.096	4	119.8735	0.034	10	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]C[6]Al)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Al<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Al)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9635	0.078	4	119.8735	0.034	10	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]C[6]Al)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Al<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Al)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.5570	0.081	2	119.8735	0.034	10	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]C[6]As)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|As<3>,1|C<3>,1|H<1>}	C[6](N[6]C[6]As)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7202	0.271	5	119.7407	0.050	7	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]C[6]As)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|As<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]As)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7920	0.017	2	119.7407	0.050	7	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]C[6]Au)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Au<2>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Au)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.3540	0.507	4	119.5040	0.219	6	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]C[6]Au)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Au<3>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Au)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8040	0.229	2	119.5040	0.219	6	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Cd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4050	0.440	2	120.3738	0.108	8	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Cd<6>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0080	0.100	2	120.3738	0.108	8	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Cd<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5410	0.239	4	120.3738	0.108	8	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Co<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	119.9755	0.073	2	120.3639	0.398	54	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Co<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0048	0.117	4	120.3639	0.398	54	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Co<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9275	0.166	2	120.3639	0.398	54	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.5900	0.288	2	120.3639	0.398	54	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4238	0.673	44	120.3639	0.398	54	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cr)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Cr<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cr)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9510	0.099	2	119.2600	0.790	4	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cr)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Cr<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cr)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	118.5690	0.670	2	119.2600	0.790	4	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Cu<3>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.0680	0.140	2	120.0406	0.145	53	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Cu<3>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9843	0.120	6	120.0406	0.145	53	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.1800	0.229	2	120.0406	0.145	53	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9646	0.186	17	120.0406	0.145	53	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	121.6665	0.025	2	120.0406	0.145	53	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.1640	0.000	1	120.0406	0.145	53	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9503	0.235	23	120.0406	0.145	53	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Fe<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9945	0.142	6	120.1745	0.162	19	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Fe<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9447	0.171	6	120.1745	0.162	19	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.9550	0.720	2	120.1745	0.162	19	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1635	0.309	2	120.1745	0.162	19	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.4810	0.138	3	120.1745	0.162	19	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ga)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Ga<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ga)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	118.4300	0.745	2	118.4300	0.555	2	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ge)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Ge<3>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ge)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7390	0.181	2	119.7390	0.033	2	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]C[6]In)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|In<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]In)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0125	0.069	2	120.0125	0.005	2	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8528	0.223	12	120.0813	0.155	27	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|N<2>,2|C<3>}	H(C[6]C[6]2)	120.8725	0.281	2	120.0813	0.155	27	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.2039	0.367	11	120.0813	0.155	27	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9870	0.068	2	120.0813	0.155	27	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]C[6]Mg)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Mg<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mg)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1005	0.401	4	120.0978	0.080	8	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]C[6]Mg)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Mg<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mg)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0950	0.157	4	120.0978	0.080	8	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	121.0960	0.000	1	120.0878	0.263	11	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9870	0.409	10	120.0878	0.263	11	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Mo<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8587	0.142	21	119.8587	0.020	21	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Ni<3>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8250	0.769	6	120.1221	0.339	24	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.1873	0.116	4	120.1221	0.339	24	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2309	0.561	14	120.1221	0.339	24	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]C[6]P[4])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|P<3>}	C[6](N[6]C[6]P[4])(C[6]C[6]H)(H){1|C<3>,1|H<1>,3|N<3>}	H(C[6]C[6]2)	119.7303	0.141	3	119.7303	0.020	3	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0567	0.507	62	120.0567	0.257	62	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.5106	0.405	14	120.1609	0.349	33	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.5427	0.750	6	120.1609	0.349	33	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.8245	0.152	2	120.1609	0.349	33	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Pt<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.8960	0.000	1	120.1609	0.349	33	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Pt<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8969	0.261	8	120.1609	0.349	33	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Pt<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.5935	0.135	2	120.1609	0.349	33	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.7225	0.022	2	119.8418	0.377	22	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7511	0.598	18	119.8418	0.377	22	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Re<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7780	0.365	2	119.8418	0.377	22	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Rh<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2625	0.257	4	120.2625	0.066	4	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8842	0.291	42	119.9110	0.133	54	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	121.0665	0.192	2	119.9110	0.133	54	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Ru<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.6090	0.044	4	119.9110	0.133	54	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Ru<9>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8046	0.181	5	119.9110	0.133	54	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Ru<9>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.4640	0.000	1	119.9110	0.133	54	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]C[6]Si)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Si<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Si)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0651	0.350	12	120.1039	0.120	17	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]C[6]Si)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Si<4>,1|C<4>,1|H<1>}	C[6](N[6]C[6]Si)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>,1|P<4>}	H(C[6]C[6]2)	120.8180	0.000	1	120.1039	0.120	17	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]C[6]Si)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Si<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Si)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0420	0.082	4	120.1039	0.120	17	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]C[6]Sn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Sn<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Sn)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0651	0.300	8	120.0651	0.090	8	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]C[6]Te)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Te<3>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Te)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0745	0.086	2	120.0745	0.007	2	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]C[6]Th)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Th<13>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Th)(C[6]C[6]H)(H){1|C<3>,1|N<3>}	H(C[6]C[6]2)	119.8510	0.000	1	119.8510	0.000	1	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ti)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Ti<10>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ti)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9885	0.138	4	119.9885	0.019	4	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Zn<4>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8760	0.000	1	120.2898	0.491	61	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.1715	0.841	4	120.2898	0.491	61	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3203	0.890	30	120.2898	0.491	61	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Zn<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0949	0.295	14	120.2898	0.491	61	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Zn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.8049	0.076	7	120.2898	0.491	61	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Zn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9827	0.115	4	120.2898	0.491	61	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Zn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.6120	0.000	1	120.2898	0.491	61	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]C[6]Zr)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Zr<12>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zr)(C[6]C[6]H)(H){1|C<3>,1|N<3>}	H(C[6]C[6]2)	119.2845	0.969	2	119.3278	0.949	6	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]C[6]Zr)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Zr<13>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zr)(C[6]C[6]H)(H){1|C<3>,1|N<3>}	H(C[6]C[6]2)	117.7090	0.000	1	119.3278	0.949	6	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]C[6]Zr)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Zr<13>,1|C<4>,1|H<1>}	C[6](N[6]C[6]Zr)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.5220	0.000	1	119.3278	0.949	6	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]C[6]Zr)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Zr<14>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zr)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0835	0.057	2	119.3278	0.949	6	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.6005	0.080	2	119.6565	0.008	4	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	119.7125	0.064	2	119.6565	0.008	4	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]Ga[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Ga<4>,1|C<3>,1|H<1>}	C[6](N[6]Ga[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>,3|S<2>}	H(C[6]C[6]2)	120.1185	0.441	2	120.1185	0.194	2	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]Ga[6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Ga<4>,1|C<3>,1|H<1>}	C[6](N[6]Ga[6]C[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,2|N<3>,2|S<2>}	H(C[6]C[6]2)	119.8083	0.357	4	119.8083	0.127	4	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]Ge[4]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Ge<3>,1|C<3>,1|H<1>}	C[6](N[6]Ge[4]C[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,3|N<3>}	H(C[6]C[6]2)	120.0055	0.210	2	120.0055	0.044	2	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]Nb[6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Nb<5>,1|C<3>,1|H<1>}	C[6](N[6]Nb[6]C[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>,1|O<1>,3|N<3>}	H(C[6]C[6]2)	120.1500	0.013	2	120.1500	0.000	2	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]Si[4]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Si<4>,1|C<3>,1|H<1>}	C[6](N[6]Si[4]C[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|W<6>,3|N<3>}	H(C[6]C[6]2)	120.0685	0.009	2	120.0685	0.000	2	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]Si[5]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Si<4>,1|C<3>,1|H<1>}	C[6](N[6]Si[5]C[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>,1|O<1>,2|C<4>}	H(C[6]C[6]2)	119.7795	0.088	2	119.7795	0.008	2	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]Si[6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Si<4>,1|C<3>,1|H<1>}	C[6](N[6]Si[6]C[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>,3|N<3>}	H(C[6]C[6]2)	119.8425	0.066	2	119.7297	0.025	6	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]Si[6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Si<4>,1|C<3>,1|H<1>}	C[6](N[6]Si[6]C[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>,3|N<3>}	H(C[6]C[6]2)	119.5635	0.183	2	119.7297	0.025	6	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]Si[6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Si<4>,1|C<3>,1|H<1>}	C[6](N[6]Si[6]C[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<3>,3|N<3>}	H(C[6]C[6]2)	119.7830	0.037	2	119.7297	0.025	6	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](N[6]Si[6a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Si<3>,1|C<3>,1|H<1>}	C[6](N[6]Si[6a]C[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,3|N<3>}	H(C[6]C[6]2)	119.9450	0.045	2	119.9450	0.002	2	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[5])(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]N[6]H)(H){1|Cu<4>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7025	0.076	2	120.7025	0.006	2	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[5])(C[6]N[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]N[6]H)(H){2|Ir<8>,3|C<3>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.2960	0.000	1	121.2960	0.000	1	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[5])(C[6]N[6]H)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]N[6]H)(H){2|Rh<8>,3|C<3>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.5490	0.000	1	121.5490	0.000	1	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[5])(C[6]N[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]N[6]H)(H){2|Ru<9>,3|C<3>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.5385	0.445	2	121.5385	0.198	2	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[5])(C[6]N[6]H)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]N[6]H)(H){1|Zn<3>,1|C<3>,1|H<1>,2|C<4>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7940	0.095	2	120.2350	0.384	4	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[5])(C[6]N[6]H)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]N[6]H)(H){1|Zn<5>,1|C<3>,1|H<1>,2|C<4>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6760	0.605	2	120.2350	0.384	4	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[5])(C[6]N[6]H)(H)	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]N[6]H)(H){1|H<1>,2|C<3>,2|C<4>}	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	119.7065	0.110	2	119.7065	0.012	2	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H){1|Cu<6>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6900	0.122	2	120.8428	0.091	11	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H){2|Cu<4>,1|N<3>,2|C<3>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.1730	0.000	1	120.8428	0.091	11	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H){2|Cu<5>,1|N<3>,2|C<3>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8397	0.324	8	120.8428	0.091	11	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|H<1>,2|C<4>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.0975	0.552	4	119.0975	0.304	4	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H){1|Zn<4>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.9070	0.156	4	120.9070	0.024	4	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H)	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H){1|H<1>,2|C<3>,2|C<4>}	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	119.4850	0.096	2	119.4850	0.009	2	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](N[6]B[3x6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](N[6]B[3x6]C[6])(C[6]C[6]H)(H){1|H<1>,1|O<2>,4|C<3>}	H(C[6]C[6]2)	120.3855	0.090	2	120.3855	0.008	2	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](N[6]B[4x3,4x5,4x6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|B<5>,1|C<3>,1|H<1>}	C[6](N[6]B[4x3,4x5,4x6]C[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>,4|B<6>}	H(C[6]C[6]2)	120.4545	0.280	4	120.4545	0.078	4	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](N[6]B[5x3,5x5,20x6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|B<6>,1|C<3>,1|H<1>}	C[6](N[6]B[5x3,5x5,20x6]C[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>,5|B<6>}	H(C[6]C[6]2)	120.1750	1.261	4	120.1750	1.591	4	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](N[6]C[4]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](N[6]C[4]C[6])(C[6]C[6]H)(H){1|H<1>,1|O<2>,3|C<3>}	H(C[6]C[6]2)	120.1035	0.380	2	120.1035	0.144	2	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](N[6]C[5x3,5x5,20x6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|C<3>,1|C<6>,1|H<1>}	C[6](N[6]C[5x3,5x5,20x6]C[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>,5|B<6>}	H(C[6]C[6]2)	120.2432	0.121	4	120.2432	0.015	4	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.5285	0.367	2	120.5010	0.051	4	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|Co<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|O<2>,2|C<3>}	H(C[6]C[6]2)	120.4735	0.118	2	120.5010	0.051	4	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<2>}	H(C[6]C[6]2)	120.8440	0.246	2	120.8282	0.106	10	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|O<2>,2|C<3>}	H(C[6]C[6]2)	120.8120	0.130	4	120.8282	0.106	10	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<2>}	H(C[6]C[6]2)	121.1705	0.332	2	120.8282	0.106	10	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|O<2>,2|C<3>}	H(C[6]C[6]2)	120.5025	0.535	2	120.8282	0.106	10	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<2>}	H(C[6]C[6]2)	120.8160	0.474	2	120.6156	0.288	8	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.8985	0.192	2	120.6156	0.288	8	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|C<3>,1|N<2>,1|O<2>}	H(C[6]C[6]2)	120.8740	0.355	4	120.6156	0.288	8	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.4570	0.000	1	120.8899	0.490	17	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|O<2>,2|C<3>}	H(C[6]C[6]2)	121.0752	0.724	12	120.8899	0.490	17	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|O<2>,2|C<3>}	H(C[6]C[6]2)	120.4420	0.471	4	120.8899	0.490	17	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|C<3>,1|N<2>,1|O<2>}	H(C[6]C[6]2)	121.1322	0.300	4	120.9957	0.100	6	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|O<2>,2|C<3>}	H(C[6]C[6]2)	120.7225	0.078	2	120.9957	0.100	6	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|O<2>,2|C<3>}	H(C[6]C[6]2)	120.9309	0.737	22	120.9309	0.543	22	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.3145	0.293	6	120.3323	0.056	9	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|C<3>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.3680	0.092	3	120.3323	0.056	9	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.2836	0.422	7	120.4343	0.162	15	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|Pt<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.5867	0.155	4	120.4343	0.162	15	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|Pt<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|O<2>,2|C<3>}	H(C[6]C[6]2)	120.5455	0.525	4	120.4343	0.162	15	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.4946	0.335	8	120.5740	0.137	20	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|O<2>,2|C<3>}	H(C[6]C[6]2)	120.6269	0.398	12	120.5740	0.137	20	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|Rh<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|O<2>,2|C<3>}	H(C[6]C[6]2)	120.5310	0.744	2	120.5310	0.553	2	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.5513	0.453	20	120.5202	0.122	40	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,1|N<2>,1|O<2>}	H(C[6]C[6]2)	120.6195	0.357	2	120.5202	0.122	40	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|O<2>,2|C<3>}	H(C[6]C[6]2)	120.4580	0.143	6	120.5202	0.122	40	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|Ru<9>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|O<2>,2|C<3>}	H(C[6]C[6]2)	120.4828	0.221	12	120.5202	0.122	40	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|Zn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<3>,1|N<2>,1|O<2>}	H(C[6]C[6]2)	121.0450	0.195	4	120.8610	0.057	10	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|Zn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|O<2>,2|C<3>}	H(C[6]C[6]2)	120.7383	0.185	6	120.8610	0.057	10	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,1|O<2>,3|C<3>}	H(C[6]C[6]2)	120.0560	0.059	2	119.7820	0.227	3	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){3|C<3>}	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(H){2|O<1>,3|C<3>}	H(C[6]C[6]2)	119.2340	0.000	1	119.7820	0.227	3	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]P)(C[6]N[6]H)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]P)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<4>}	H(C[6]C[6]2)	120.1145	0.197	2	120.1145	0.039	2	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]P)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]P)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|P<4>,2|C<3>}	H(C[6]C[6]2)	120.0684	0.275	5	120.0684	0.075	5	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]P)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]P)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|P<4>,2|C<3>}	H(C[6]C[6]2)	120.3715	0.231	4	120.3715	0.053	4	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	C[6](N[6]C[5]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|O<2>}	C[6](N[6]C[5]C[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>,1|S<1>,2|C<4>}	H(C[6]C[6]2)	119.5990	0.000	1	119.5990	0.000	1	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|Cd<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	H(C[6]C[6]2)	120.5765	0.185	2	120.5765	0.034	2	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	H(C[6]C[6]2)	120.3787	0.091	9	120.3754	0.014	11	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<4>}	H(C[6]C[6]2)	120.3605	0.272	2	120.3754	0.014	11	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|Cu<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	H(C[6]C[6]2)	120.5110	0.247	2	120.5110	0.061	2	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	H(C[6]C[6]2)	120.4665	0.228	4	120.4665	0.052	4	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	C[6](N[6]C[6]Hg)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|Hg<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Hg)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	H(C[6]C[6]2)	120.4673	0.265	4	120.4673	0.070	4	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	H(C[6]C[6]2)	119.9895	1.122	16	120.2251	1.382	20	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<3>}	H(C[6]C[6]2)	121.1672	0.989	4	120.2251	1.382	20	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	H(C[6]C[6]2)	120.4633	0.153	4	120.4633	0.024	4	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	H(C[6]C[6]2)	119.3167	1.408	4	119.3167	1.982	4	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	H(C[6]C[6]2)	120.2590	0.484	6	120.2590	0.235	6	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|S<2>,2|C<3>}	H(C[6]C[6]2)	120.6590	0.000	1	120.6590	0.000	1	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|Ru<9>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	H(C[6]C[6]2)	120.2591	0.304	12	120.2591	0.092	12	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	H(C[6]C[6]2)	120.2305	0.362	4	120.2652	1.484	6	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|Zn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	H(C[6]C[6]2)	120.3345	2.648	2	120.2652	1.484	6	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Se)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Se)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|Se<2>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6560	0.346	4	120.6560	0.120	4	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](N[6]C[4]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|H<1>,4|C<3>}	C[6](N[6]C[4]C[6])(C[6]C[6]H)(H){1|H<1>,4|C<3>}	H(C[6]C[6]2)	119.4210	0.008	2	119.4210	0.000	2	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](N[6]C[5]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|C<4>,1|H<1>,3|C<3>}	C[6](N[6]C[5]C[6])(C[6]C[6]H)(H){2|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.4340	0.535	2	119.4340	0.286	2	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Cd<5>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.1355	0.090	2	120.1355	0.008	2	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Co<6>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	H(C[6]C[6]2)	119.6510	0.000	1	119.9128	0.059	38	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Co<6>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.9199	0.241	37	119.9128	0.059	38	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Cu<4>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.8441	0.874	7	120.0110	0.328	33	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>,2|N<2>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3545	0.537	2	120.0110	0.328	33	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Cu<5>,1|H<1>,1|N<2>,2|C<3>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.8482	0.592	10	120.0110	0.328	33	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Cu<5>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3280	0.312	8	120.0110	0.328	33	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Cu<6>,1|H<1>,1|N<2>,2|C<3>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.1245	0.008	2	120.0110	0.328	33	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Cu<6>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.8473	0.231	4	120.0110	0.328	33	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Fe<6>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.4671	2.145	8	119.5714	3.728	10	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Fe<6>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){3|C<3>}	H(C[6]C[6]2)	119.9885	0.945	2	119.5714	3.728	10	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](N[6]C[6]Hg)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Hg<4>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Hg)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	118.5390	0.024	2	118.5390	0.001	2	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Ir<6>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){3|C<3>}	H(C[6]C[6]2)	120.1228	0.546	46	120.2133	0.298	70	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|H<1>,2|N<2>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3880	0.530	20	120.2133	0.298	70	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Ir<8>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3790	0.488	4	120.2133	0.298	70	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>,2|N<2>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5515	0.161	2	120.0553	0.097	28	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Mn<6>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.0039	0.288	24	120.0553	0.097	28	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Mn<6>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){3|C<3>}	H(C[6]C[6]2)	120.1755	0.312	2	120.0553	0.097	28	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Ni<5>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.9305	0.186	2	119.9677	0.030	28	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Ni<6>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	H(C[6]C[6]2)	120.2090	0.000	1	119.9677	0.030	28	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Ni<6>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.9635	0.177	24	119.9677	0.030	28	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Ni<6>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){3|C<3>}	H(C[6]C[6]2)	119.9030	0.000	1	119.9677	0.030	28	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](N[6]C[6]Os)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Os<7>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Os)(C[6]C[6]H)(H){3|C<3>}	H(C[6]C[6]2)	119.5360	0.000	1	119.5360	0.000	1	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>,2|N<2>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5035	0.403	14	120.2529	0.234	28	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Pd<4>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.0023	0.434	14	120.2529	0.234	28	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Pt<4>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.2870	0.384	4	120.1166	0.501	10	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Pt<4>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){3|C<3>}	H(C[6]C[6]2)	120.0030	0.880	6	120.1166	0.501	10	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Re<5>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.6705	1.751	6	119.8630	0.727	26	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|H<1>,2|N<2>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3535	0.558	2	119.8630	0.727	26	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Re<6>,1|H<1>,1|N<2>,2|C<3>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.8674	0.195	5	119.8630	0.727	26	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Re<6>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.0292	0.395	6	119.8630	0.727	26	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Re<6>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){3|C<3>}	H(C[6]C[6]2)	119.7424	0.323	7	119.8630	0.727	26	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Rh<6>,1|C<4>,3|C<3>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.7800	0.000	1	120.0298	0.508	13	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Rh<8>,1|C<3>,1|H<1>,2|N<2>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.4057	0.170	4	120.0298	0.508	13	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Rh<8>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.8731	0.861	8	120.0298	0.508	13	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Ru<6>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){3|C<3>}	H(C[6]C[6]2)	119.6132	0.153	4	120.1628	0.194	28	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Ru<9>,1|C<3>,1|H<1>,2|N<2>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.2544	0.404	24	120.1628	0.194	28	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](N[6]C[6]Sm)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Sm<12>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Sm)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.9900	0.143	3	119.9900	0.020	3	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Zn<4>,1|H<1>,1|N<2>,2|C<3>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.0097	0.189	4	119.9890	0.346	40	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Zn<4>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.9200	0.324	4	119.9890	0.346	40	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Zn<5>,1|H<1>,1|N<2>,2|C<3>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.0521	0.329	8	119.9890	0.346	40	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Zn<5>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.8752	0.986	13	119.9890	0.346	40	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Zn<6>,1|H<1>,1|N<2>,2|C<3>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.1148	0.197	4	119.9890	0.346	40	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Zn<6>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	H(C[6]C[6]2)	119.8460	0.000	1	119.9890	0.346	40	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Zn<6>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.1078	0.129	4	119.9890	0.346	40	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Zn<6>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){3|C<3>}	H(C[6]C[6]2)	120.1565	0.250	2	119.9890	0.346	40	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|H<1>,4|C<3>}	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<2>}	H(C[6]C[6]2)	115.5920	0.389	2	119.1925	2.376	14	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|H<1>,4|C<3>}	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,4|C<3>}	H(C[6]C[6]2)	119.7926	0.212	12	119.1925	2.376	14	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](N[6]Ga[3x6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Ga<4>,1|H<1>,3|C<3>}	C[6](N[6]Ga[3x6]C[6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,3|S<2>}	H(C[6]C[6]2)	119.9687	0.513	3	119.9687	0.263	3	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]O[6])(C[6]N[6]H)(H)	C[6](N[6]C[6a]B[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]O[6])(C[6]N[6]H)(H){1|B<4>,3|C<3>}	C[6](N[6]C[6a]B[6])(C[6]C[6]H)(H){1|O<2>,2|F<1>,3|C<3>}	H(C[6]C[6]2)	118.1740	0.000	1	118.1740	0.000	1	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[5,6]Ag)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]N[6]H)(H){1|Ag<5>,1|C<3>,1|N<2>}	C[6](N[6]C[5,6]Ag)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.3525	0.108	2	120.3525	0.012	2	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]N)(C[6]N[6]H)(H)	C[6](N[6]C[5,6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]N)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|N<2>}	C[6](N[6]C[5,6]Cu)(C[6]C[6]H)(H){3|N<3>}	H(C[6]C[6]2)	118.2940	2.404	2	118.2940	5.780	2	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5a,6]N)(C[6]N[6]H)(H)	C[6](N[6]C[5a,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5a,6]N)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](N[6]C[5a,6]H)(C[6]C[6]H)(H){1|N<2>,2|N<3>}	H(C[6]C[6]2)	119.6950	0.000	1	119.6950	0.000	1	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5a]C[6])(C[6]N[6]H)(H)	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5a]C[6])(C[6]N[6]H)(H){1|Cd<4>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.4365	0.793	2	121.3720	0.253	4	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5a]C[6])(C[6]N[6]H)(H)	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5a]C[6])(C[6]N[6]H)(H){1|Cd<6>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.3075	0.339	2	121.3720	0.253	4	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5a]C[6])(C[6]N[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5a]C[6])(C[6]N[6]H)(H){1|Ru<9>,1|H<1>,1|N<2>,2|C<3>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5255	0.373	4	120.5255	0.139	4	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5a]C[6])(C[6]N[6]H)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5a]C[6])(C[6]N[6]H)(H){1|Zn<4>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5875	0.240	2	120.5875	0.057	2	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6]Fe)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]N[6]H)(H){1|Fe<6>,2|C<3>}	C[6](N[6]C[6,6]Fe)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9480	0.000	1	119.9480	0.000	1	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]C)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<2>}	H(C[6]C[6]2)	121.3665	0.129	2	120.7679	0.847	7	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]C)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.9570	0.000	1	120.7679	0.847	7	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]C)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<4>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	121.5100	0.000	1	120.7679	0.847	7	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]C)(C[6]N[6]H)(H){1|Cu<5>,1|Cu<6>,1|C<3>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7595	1.310	2	120.7679	0.847	7	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]C)(C[6]N[6]H)(H){2|Cu<4>,1|C<3>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.6560	0.000	1	120.7679	0.847	7	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]C)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<2>}	H(C[6]C[6]2)	120.9485	0.013	2	121.0930	0.129	5	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]C)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.6440	0.000	1	121.0930	0.129	5	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]C)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|N<2>,2|C<3>}	H(C[6]C[6]2)	121.4620	0.042	2	121.0930	0.129	5	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ti)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]C)(C[6]N[6]H)(H){1|Ti<10>,1|C<3>}	C[6](N[6]C[6]Ti)(C[6]C[6]H)(H){1|N<2>,2|C<3>}	H(C[6]C[6]2)	120.8730	0.136	2	120.8730	0.018	2	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[5]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)(C[6]N[6]N)(H){1|B<4>,1|C<3>,1|C<4>}	C[6](N[6]C[5]C[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<1>,1|O<2>,2|N<3>}	H(C[6]C[6]2)	123.3810	0.000	1	120.7749	0.310	34	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[5]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)(C[6]N[6]N)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](N[6]C[5]C[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<1>,1|O<2>,2|N<3>}	H(C[6]C[6]2)	120.6960	0.318	33	120.7749	0.310	34	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(C[6]N[6]O)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)(C[6]N[6]O)(H){1|Pd<4>,1|C<3>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|N<2>,1|O<2>,1|S<2>}	H(C[6]C[6]2)	120.6580	0.000	1	120.6580	0.000	1	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](N[6]C[6]Ag)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Ag<4>,1|C<3>}	C[6](N[6]C[6]Ag)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|S<2>}	H(C[6]C[6]2)	121.5400	0.000	1	121.5400	0.000	1	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](N[6]C[6]Ca)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Ca<11>,1|C<4>}	C[6](N[6]C[6]Ca)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	121.8070	0.000	1	121.8370	0.002	2	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](N[6]C[6]Ca)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Ca<8>,1|C<4>}	C[6](N[6]C[6]Ca)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	121.8670	0.000	1	121.8370	0.002	2	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Cd<6>,1|C<3>}	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	121.2687	0.235	3	121.4800	0.215	4	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Cd<6>,1|C<3>}	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	122.1140	0.000	1	121.4800	0.215	4	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](N[6]C[6]Ce)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Ce<17>,1|C<4>}	C[6](N[6]C[6]Ce)(C[6]C[6]H)(H){1|N<2>,2|H<1>}	H(C[6]C[6]2)	121.5830	0.000	1	121.5830	0.000	1	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Co<6>,1|C<3>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.7834	0.923	10	120.6608	1.383	16	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){2|Co<4>,1|C<3>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.1060	0.016	2	120.6608	1.383	16	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){2|Co<6>,1|C<3>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1318	1.950	4	120.6608	1.383	16	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](N[6]C[6]Cr)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Cr<6>,1|C<3>}	C[6](N[6]C[6]Cr)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	121.1530	0.000	1	121.1530	0.000	1	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Cu<4>,1|C<3>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	121.3030	0.135	4	121.3896	0.176	37	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Cu<4>,1|C<3>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	121.6528	0.152	6	121.3896	0.176	37	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Cu<4>,1|C<3>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|N<2>,2|H<1>}	H(C[6]C[6]2)	121.5840	0.000	1	121.3896	0.176	37	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>}	H(C[6]C[6]2)	121.6030	0.000	1	121.3896	0.176	37	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Cu<5>,1|C<3>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	122.7300	0.000	1	121.3896	0.176	37	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Cu<5>,1|C<3>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	121.4390	0.265	11	121.3896	0.176	37	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Cu<5>,1|C<3>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|O<2>}	H(C[6]C[6]2)	121.7190	0.000	1	121.3896	0.176	37	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Cu<6>,1|C<3>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	121.9070	0.000	1	121.3896	0.176	37	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Cu<6>,1|C<3>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|H<1>,2|N<2>}	H(C[6]C[6]2)	121.2980	0.000	1	121.3896	0.176	37	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){2|Cu<4>,1|C<3>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.9615	0.312	10	121.3896	0.176	37	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](N[6]C[6]Eu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Eu<9>,1|C<3>}	C[6](N[6]C[6]Eu)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	121.5648	0.121	4	121.5648	0.015	4	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Fe<6>,1|C<3>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	121.1641	0.308	20	121.1066	0.113	37	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Fe<6>,1|C<3>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	121.4557	0.238	4	121.1066	0.113	37	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){2|Fe<6>,1|C<3>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.9106	0.295	13	121.1066	0.113	37	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Ir<6>,1|C<3>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	121.3961	0.616	14	121.4766	0.692	24	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Ir<8>,1|C<3>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	121.9724	0.835	8	121.4766	0.692	24	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){2|Ir<6>,1|C<3>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0575	0.127	2	121.4766	0.692	24	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Mn<6>,1|C<3>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	121.5204	0.391	29	121.4072	0.143	45	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Mn<6>,1|C<3>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	121.3275	0.286	2	121.4072	0.143	45	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Mn<6>,1|C<3>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|N<2>,2|H<1>}	H(C[6]C[6]2)	121.3500	0.000	1	121.4072	0.143	45	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Mn<7>,1|C<4>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|S<2>}	H(C[6]C[6]2)	121.3100	0.000	1	121.4072	0.143	45	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){2|Mn<6>,1|C<3>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.1596	0.272	12	121.4072	0.143	45	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Ni<4>,1|C<3>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	121.3053	0.133	4	121.1181	3.488	44	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Ni<4>,1|C<3>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	121.7205	0.457	2	121.1181	3.488	44	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Ni<6>,1|C<3>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	121.3850	0.330	21	121.1181	3.488	44	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Ni<6>,1|C<3>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	118.6972	6.245	4	121.1181	3.488	44	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Ni<6>,1|C<3>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|S<2>}	H(C[6]C[6]2)	121.8182	0.138	6	121.1181	3.488	44	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){2|Ni<6>,1|C<3>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8214	0.428	7	121.1181	3.488	44	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Pd<4>,1|C<3>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	121.4262	0.369	14	121.3797	0.103	44	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Pd<4>,1|C<3>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	121.2874	0.280	20	121.3797	0.103	44	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Pd<4>,1|C<3>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|S<2>}	H(C[6]C[6]2)	121.9615	0.105	2	121.3797	0.103	44	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Pd<4>,1|C<3>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|N<2>,2|H<1>}	H(C[6]C[6]2)	121.3235	0.243	4	121.3797	0.103	44	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Pd<6>,1|C<3>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	121.5600	0.161	2	121.3797	0.103	44	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){2|Pd<4>,1|C<3>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>}	H(C[6]C[6]2)	121.3265	0.052	2	121.3797	0.103	44	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>}	H(C[6]C[6]2)	117.2530	0.000	1	120.9914	0.754	30	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Pt<4>,1|C<3>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	121.1122	0.587	21	120.9914	0.754	30	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Pt<5>,1|C<3>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|S<2>}	H(C[6]C[6]2)	121.4505	0.272	2	120.9914	0.754	30	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Pt<6>,1|C<3>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	121.0175	0.241	4	120.9914	0.754	30	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){2|Pt<4>,1|C<3>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>}	H(C[6]C[6]2)	121.0810	0.051	2	120.9914	0.754	30	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Re<6>,1|C<3>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	121.3415	0.385	18	121.2894	0.218	24	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Re<6>,1|C<3>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	121.0228	0.253	4	121.2894	0.218	24	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Re<6>,1|C<3>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|S<3>}	H(C[6]C[6]2)	120.3640	0.000	1	121.2894	0.218	24	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Re<6>,1|C<3>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|N<2>,2|H<1>}	H(C[6]C[6]2)	122.3440	0.000	1	121.2894	0.218	24	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Rh<6>,1|C<3>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	121.0980	0.532	2	121.3857	0.942	7	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Rh<8>,1|C<3>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	121.5008	1.133	5	121.3857	0.942	7	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Ru<6>,1|C<3>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	121.1690	0.466	4	121.1382	0.210	22	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Ru<6>,1|C<3>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	121.2971	0.381	7	121.1382	0.210	22	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Ru<7>,1|C<4>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|S<2>}	H(C[6]C[6]2)	120.1380	0.000	1	121.1382	0.210	22	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Ru<8>,1|C<4>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|S<2>}	H(C[6]C[6]2)	121.2574	0.307	7	121.1382	0.210	22	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Ru<9>,1|C<3>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	121.4390	0.000	1	121.1382	0.210	22	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){2|Ru<6>,1|C<3>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4525	0.008	2	121.1382	0.210	22	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](N[6]C[6]Sn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Sn<7>,1|C<3>}	C[6](N[6]C[6]Sn)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|S<2>}	H(C[6]C[6]2)	121.3565	0.197	2	121.3565	0.039	2	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Zn<4>,1|C<3>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	122.0290	0.000	1	121.6550	0.254	9	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Zn<4>,1|C<3>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|H<1>,2|N<2>}	H(C[6]C[6]2)	122.1045	0.701	2	121.6550	0.254	9	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Zn<5>,1|C<3>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	121.8630	0.170	2	121.6550	0.254	9	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Zn<6>,1|C<3>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	121.4170	0.148	2	121.6550	0.254	9	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){2|Zn<6>,1|C<3>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.0485	0.087	2	121.6550	0.254	9	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Si<5>,2|C<3>}	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(H){2|Cl<1>,1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.2350	0.051	2	119.2350	0.003	2	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)2(H)	C[6](N[6]Ge[4,6]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)2(H){1|Ge<4>,2|C<3>}	C[6](N[6]Ge[4,6]C[6a])(C[6]C[6]H)(H){2|As<2>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	118.5203	0.151	4	118.5203	0.023	4	120.3696	0.646	27294	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[4,6]H)(C[6]N[6]O)(H)	C[6](N[6]C[4,6]C)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[4,6]H)(C[6]N[6]O)(H){1|H<1>,3|C<4>}	C[6](N[6]C[4,6]C)(C[6]C[6]H)(O){2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.1720	0.000	1	118.1720	0.000	1	116.6561	22.730	17	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[4,6]H)(C[6]N[6]O)(H)	C[6](N[6]C[4,6]H)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[4,6]H)(C[6]N[6]O)(H){1|Cl<1>,1|H<1>,2|C<4>}	C[6](N[6]C[4,6]H)(C[6]C[6]H)(O){2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.8805	1.259	2	118.8490	0.796	3	116.6561	22.730	17	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[4,6]H)(C[6]N[6]O)(H)	C[6](N[6]C[4,6]H)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[4,6]H)(C[6]N[6]O)(H){1|H<1>,3|C<4>}	C[6](N[6]C[4,6]H)(C[6]C[6]H)(O){2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.7860	0.000	1	118.8490	0.796	3	116.6561	22.730	17	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]N[6]O)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]N[6]O)(H){1|Fe<10>,2|Pd<4>,1|C<3>,2|C<4>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(O){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.1310	0.000	1	119.1310	0.000	1	116.6561	22.730	17	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]O)(H)	C[6](N[6]C[6,6]C)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]O)(H){1|C<3>,2|C<4>}	C[6](N[6]C[6,6]C)(C[6]C[6]H)(O){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	118.7940	0.000	1	118.7940	0.000	1	116.6561	22.730	17	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]O)(H)	C[6](N[6]C[6,6]S)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]O)(H){1|C<3>,1|S<4>,2|C<4>}	C[6](N[6]C[6,6]S)(C[6]C[6]H)(O){2|C<4>,2|H<1>}	H(C[6]C[6]2)	115.7050	0.000	1	115.7050	0.000	1	116.6561	22.730	17	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]O)(H)	C[6](N[6]C[6,6]H)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]O)(H){1|C<4>,1|H<1>,1|O<1>}	C[6](N[6]C[6,6]H)(C[6]C[6]H)(O){1|C<3>,1|C<4>,2|N<3>}	H(C[6]C[6]2)	118.2430	0.000	1	118.2430	0.000	1	116.6561	22.730	17	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]O)(H)	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]O)(H){1|C<4>,1|H<1>,4|C<3>}	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(O){1|C<4>,1|H<1>,4|C<3>}	H(C[6]C[6]2)	113.7410	1.375	2	115.2860	8.106	3	116.6561	22.730	17	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]O)(H)	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]O)(H){2|H<1>,4|C<3>}	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(O){1|C<4>,1|O<1>,3|C<3>}	H(C[6]C[6]2)	118.3760	0.000	1	115.2860	8.106	3	116.6561	22.730	17	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]N[5,6]O)(C[6]N[6]O)(H)	C[6](N[6]C[5,6]H)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]N[5,6]O)(C[6]N[6]O)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](N[6]C[5,6]H)(C[6]C[6]H)(O){1|N<2>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	99.7264	0.000	1	99.7264	0.000	1	116.6561	22.730	17	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]N[6,6]C[6a])(C[6]N[6]O)(H)	C[6](N[6]C[6,6]H)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]N[6,6]C[6a])(C[6]N[6]O)(H){1|C<4>,1|H<1>,3|C<3>}	C[6](N[6]C[6,6]H)(C[6]C[6]H)(O){1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.5220	0.000	1	119.5220	0.000	1	116.6561	22.730	17	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]N[6]H)(C[6]N[6]O)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]N[6]H)(C[6]N[6]O)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(O){1|H<1>,1|N<3>,1|S<3>}	H(C[6]C[6]2)	119.7620	0.000	1	119.7620	0.000	1	116.6561	22.730	17	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]N[6]H)(C[6]N[6]O)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]N[6]H)(C[6]N[6]O)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(O){1|H<1>,2|N<3>}	H(C[6]C[6]2)	118.0000	0.000	1	118.0000	0.000	1	116.6561	22.730	17	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]N[6]H)(C[6]N[6]O)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]N[6]H)(C[6]N[6]O)(H){1|Zn<4>,1|C<3>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(O){1|H<1>,1|N<2>,1|O<1>}	H(C[6]C[6]2)	115.6110	0.000	1	115.6110	0.000	1	116.6561	22.730	17	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]N[6]O)(C[6]O[6]C)(H)	C[6](N[6]S[6]Pd)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]N[6]O)(C[6]O[6]C)(H){1|Pd<4>,1|S<4>}	C[6](N[6]S[6]Pd)(C[6]C[6]H)(O){1|C<4>,1|O<2>,2|O<1>}	H(C[6]C[6]2)	118.0830	0.000	1	118.0830	0.000	1	116.6561	22.730	17	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:S-1:	C[6]-3:	C[6](C[6]C[6,6a]C[6a])(C[6]N[6]S)(H)	C[6](N[6]C[6,6a]H)(C[6]C[6]H)(S)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C[6a])(C[6]N[6]S)(H){1|H<1>,4|C<3>}	C[6](N[6]C[6,6a]H)(C[6]C[6]H)(S){3|C<3>}	H(C[6]C[6]2)	118.4550	0.219	2	118.4550	0.048	2	119.5034	0.536	13	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:S-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]S)(H)	C[6](N[6]C[6,6a]H)(C[6]C[6]H)(S)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]S)(H){1|H<1>,2|C<3>}	C[6](N[6]C[6,6a]H)(C[6]C[6]H)(S){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.3566	0.190	8	119.3566	0.036	8	119.5034	0.536	13	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:S-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](N[6]Si[4]C[6])(C[6]C[6]H)(S)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Si<5>,1|C<3>,1|H<1>}	C[6](N[6]Si[4]C[6])(C[6]C[6]H)(S){1|N<2>,1|N<3>,1|S<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5937	0.313	3	120.5937	0.098	3	119.5034	0.536	13	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	P[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]P[6]Cl)(C[6]C[6]H)(H)	C[6](P[6]C[6]Re)(C[6]C[6]H)(Cl)	H(C[6]C[6]2)	C[6](C[6]P[6]Cl)(C[6]C[6]H)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](P[6]C[6]Re)(C[6]C[6]H)(Cl){1|C<3>,2|H<1>}	H(C[6]C[6]2)	118.4326	0.203	5	118.4326	0.041	5	118.4326	0.041	5	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	P[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]P[6]H)(H)	C[6](P[6]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]P[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](P[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	118.4510	0.000	1	118.4510	0.000	1	118.0170	0.348	5	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	P[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]P[6]H)(H)	C[6](P[6]C[6]Re)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]P[6]H)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](P[6]C[6]Re)(C[6]C[6]H)(H){1|Cl<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	117.9085	0.620	4	117.9085	0.385	4	118.0170	0.348	5	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:C[6]-3:H-1:	P[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]P[6]O)(H)	C[6](P[6]C[6]Au)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]P[6]O)(H){1|Au<2>,1|H<1>,3|C<3>}	C[6](P[6]C[6]Au)(C[6]C[6]H)(O){3|C<3>}	H(C[6]C[6]2)	116.5900	0.000	1	116.5900	0.000	1	116.5900	0.000	1	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(N[6]C[6]C)(H)	C[6](C[5,6]C[5,6]2)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[5,6]H)(N[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[5,6]C[5,6]2)(C[6]N[6]H)(H){1|C<4>,1|P<4>,3|C<3>}	H(C[6]C[6]N[6])	119.1315	0.153	4	119.1315	0.023	4	119.1315	0.023	4	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(N[6]C[6]C)(H)	C[6](C[5a,6]C[5a,6]C[5a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[5a,6]H)(N[6]C[6]C)(H){1|S<1>,2|C<3>}	C[6](C[5a,6]C[5a,6]C[5a])(C[6]N[6]H)(H){1|C<4>,1|H<1>,1|S<2>,2|C<3>}	H(C[6]C[6]N[6])	118.5517	0.139	3	118.5517	0.019	3	118.3924	0.209	25	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(N[6]C[6]C)(H)	C[6](C[5a,6]C[5a,6a]C[5a,6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[5a,6]H)(N[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[5a,6]C[5a,6a]C[5a,6])(C[6]N[6]H)(H){1|C<4>,1|S<2>,3|C<3>}	H(C[6]C[6]N[6])	119.3000	0.000	1	119.3000	0.000	1	118.3924	0.209	25	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(N[6]C[6]Co)(H)	C[6](C[5a,6]C[5a,6]O[5a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[5a,6]H)(N[6]C[6]Co)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[5a,6]C[5a,6]O[5a])(C[6]N[6]H)(H){1|Co<4>,3|C<3>}	H(C[6]C[6]N[6])	118.0340	0.000	1	118.0340	0.000	1	118.3924	0.209	25	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(N[6]C[6]Cu)(H)	C[6](C[5a,6]C[5a,6]O[5a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[5a,6]H)(N[6]C[6]Cu)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[5a,6]C[5a,6]O[5a])(C[6]N[6]H)(H){1|Cu<5>,3|C<3>}	H(C[6]C[6]N[6])	117.8520	0.000	1	117.8520	0.000	1	118.3924	0.209	25	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(N[6]C[6]H)(H)	C[6](C[5a,6]C[5a,6]2)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[5a,6]H)(N[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[5a,6]C[5a,6]2)(C[6]N[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]N[6])	119.1220	0.000	1	119.1220	0.000	1	118.3924	0.209	25	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(N[6]C[6]H)(H)	C[6](C[5a,6]C[5a,6]N[5a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[5a,6]H)(N[6]C[6]H)(H){1|N<3>,2|C<3>}	C[6](C[5a,6]C[5a,6]N[5a])(C[6]N[6]H)(H){2|H<1>,3|C<3>}	H(C[6]C[6]N[6])	119.3370	0.000	1	119.3370	0.000	1	118.3924	0.209	25	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(N[6]C[6]Ir)(H)	C[6](C[5a,6]C[5a,6]O[5a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[5a,6]H)(N[6]C[6]Ir)(H){1|O<2>,2|C<3>}	C[6](C[5a,6]C[5a,6]O[5a])(C[6]N[6]H)(H){1|Ir<6>,3|C<3>}	H(C[6]C[6]N[6])	118.0590	0.393	3	118.0590	0.154	3	118.3924	0.209	25	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(N[6]C[6]Ir)(H)	C[6](C[5a,6]C[5a,6]S[5a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[5a,6]H)(N[6]C[6]Ir)(H){1|S<2>,2|C<3>}	C[6](C[5a,6]C[5a,6]S[5a])(C[6]N[6]H)(H){1|Ir<6>,3|C<3>}	H(C[6]C[6]N[6])	118.4605	0.006	2	118.4605	0.000	2	118.3924	0.209	25	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(N[6]C[6]Ir)(H)	C[6](C[5a,6]C[5a,6a]C[5a,6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[5a,6]H)(N[6]C[6]Ir)(H){3|C<3>}	C[6](C[5a,6]C[5a,6a]C[5a,6])(C[6]N[6]H)(H){1|Ir<6>,1|N<3>,3|C<3>}	H(C[6]C[6]N[6])	118.5165	0.137	6	118.5165	0.019	6	118.3924	0.209	25	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(N[6]C[6]Ni)(H)	C[6](C[5a,6]C[5a,6]O[5a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[5a,6]H)(N[6]C[6]Ni)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[5a,6]C[5a,6]O[5a])(C[6]N[6]H)(H){1|Ni<6>,3|C<3>}	H(C[6]C[6]N[6])	117.6140	0.065	2	117.6140	0.004	2	118.3924	0.209	25	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(N[6]C[6]Pd)(H)	C[6](C[5a,6]C[5a,6a]C[5a,6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[5a,6]H)(N[6]C[6]Pd)(H){3|C<3>}	C[6](C[5a,6]C[5a,6a]C[5a,6])(C[6]N[6]H)(H){1|Pd<4>,1|N<3>,3|C<3>}	H(C[6]C[6]N[6])	118.5450	0.000	1	118.5450	0.000	1	118.3924	0.209	25	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(N[6]C[6]Re)(H)	C[6](C[5a,6]C[5a,6a]C[5a,6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[5a,6]H)(N[6]C[6]Re)(H){1|H<1>,2|C<3>}	C[6](C[5a,6]C[5a,6a]C[5a,6])(C[6]N[6]H)(H){1|Re<6>,1|N<3>,3|C<3>}	H(C[6]C[6]N[6])	118.1195	0.049	2	118.1803	0.012	3	118.3924	0.209	25	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(N[6]C[6]Re)(H)	C[6](C[5a,6]C[5a,6a]C[5a,6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[5a,6]H)(N[6]C[6]Re)(H){3|C<3>}	C[6](C[5a,6]C[5a,6a]C[5a,6])(C[6]N[6]H)(H){1|Re<6>,1|N<3>,3|C<3>}	H(C[6]C[6]N[6])	118.3020	0.000	1	118.1803	0.012	3	118.3924	0.209	25	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6,6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6,6]Br)(N[6]C[6]C)(H)	C[6](C[6,6]N[6,6]N[6])(C[6]N[6]H)(Br)	H(C[6]C[6]N[6])	C[6](C[6]C[6,6]Br)(N[6]C[6]C)(H){1|O<1>,2|N<3>}	C[6](C[6,6]N[6,6]N[6])(C[6]N[6]H)(Br){1|B<4>,1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6]N[6])	119.4970	0.000	1	119.4970	0.000	1	119.4970	0.000	1	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(N[6]B[5]C[6])(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6,6a]H)(N[6]B[5]C[6])(H){1|C<4>,1|H<1>,2|C<3>,2|O<2>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|B<3>,1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6]N[6])	119.1240	0.041	2	118.9227	0.122	3	119.1475	0.757	223	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(N[6]B[5]C[6])(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6,6a]H)(N[6]B[5]C[6])(H){1|H<1>,2|C<3>,2|O<2>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|B<3>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]N[6])	118.5200	0.000	1	118.9227	0.122	3	119.1475	0.757	223	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(N[6]C[5,6]S)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6,6a]H)(N[6]C[5,6]S)(H){2|C<3>,2|O<2>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|C<4>,1|H<1>,1|S<4>,2|C<3>}	H(C[6]C[6]N[6])	118.7870	0.000	1	118.7870	0.000	1	119.1475	0.757	223	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(N[6]C[6,6]Pt)(H)	C[6](C[6,6a]C[6,6,6a]C[6a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6,6a]H)(N[6]C[6,6]Pt)(H){3|C<3>}	C[6](C[6,6a]C[6,6,6a]C[6a])(C[6]N[6]H)(H){1|Pt<4>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.4930	0.000	1	118.4930	0.000	1	119.1475	0.757	223	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(N[6]C[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6,6a]H)(N[6]C[6]C)(H){1|C<2>,1|C<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|C<4>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	119.6860	0.000	1	119.4480	0.394	61	119.1475	0.757	223	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(N[6]C[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6,6a]H)(N[6]C[6]C)(H){1|C<2>,1|H<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|C<4>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	119.5700	0.000	1	119.4480	0.394	61	119.1475	0.757	223	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(N[6]C[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6,6a]H)(N[6]C[6]C)(H){1|C<2>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|C<4>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	121.0305	1.768	2	119.4480	0.394	61	119.1475	0.757	223	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(N[6]C[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6,6a]H)(N[6]C[6]C)(H){1|C<2>,3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|C<4>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.6350	0.000	1	119.4480	0.394	61	119.1475	0.757	223	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(N[6]C[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6,6a]H)(N[6]C[6]C)(H){1|C<4>,1|H<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|Br<1>,1|C<4>,3|C<3>}	H(C[6]C[6]N[6])	119.1025	0.004	2	119.4480	0.394	61	119.1475	0.757	223	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(N[6]C[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6,6a]H)(N[6]C[6]C)(H){1|C<4>,1|H<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|C<4>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	119.6200	0.309	3	119.4480	0.394	61	119.1475	0.757	223	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(N[6]C[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6,6a]H)(N[6]C[6]C)(H){1|H<1>,1|N<3>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|C<4>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	119.1935	0.520	2	119.4480	0.394	61	119.1475	0.757	223	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(N[6]C[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6,6a]H)(N[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|C<4>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	119.4655	0.562	30	119.4480	0.394	61	119.1475	0.757	223	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(N[6]C[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6,6a]H)(N[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|C<4>,1|O<2>,3|C<3>}	H(C[6]C[6]N[6])	119.9620	0.000	1	119.4480	0.394	61	119.1475	0.757	223	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(N[6]C[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6,6a]H)(N[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|C<4>,4|C<3>}	H(C[6]C[6]N[6])	119.3494	0.145	5	119.4480	0.394	61	119.1475	0.757	223	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(N[6]C[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6,6a]H)(N[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|H<1>,4|C<3>}	H(C[6]C[6]N[6])	120.0750	0.000	1	119.4480	0.394	61	119.1475	0.757	223	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(N[6]C[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6,6a]H)(N[6]C[6]C)(H){1|H<1>,3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|Br<1>,1|C<4>,3|C<3>}	H(C[6]C[6]N[6])	118.4580	0.000	1	119.4480	0.394	61	119.1475	0.757	223	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(N[6]C[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6,6a]H)(N[6]C[6]C)(H){1|H<1>,3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|C<4>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	119.9950	0.000	1	119.4480	0.394	61	119.1475	0.757	223	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(N[6]C[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6,6a]H)(N[6]C[6]C)(H){1|Ir<8>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|C<4>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.9267	0.556	3	119.4480	0.394	61	119.1475	0.757	223	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(N[6]C[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6,6a]H)(N[6]C[6]C)(H){1|Rh<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|C<4>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	119.2083	0.199	3	119.4480	0.394	61	119.1475	0.757	223	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(N[6]C[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6,6a]H)(N[6]C[6]C)(H){1|Se<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|C<4>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.8780	0.016	2	119.4480	0.394	61	119.1475	0.757	223	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(N[6]C[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6,6a]H)(N[6]C[6]C)(H){3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|C<4>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	119.7795	0.199	2	119.4480	0.394	61	119.1475	0.757	223	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(N[6]C[6]Cd)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6,6a]H)(N[6]C[6]Cd)(H){1|C<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|Cd<7>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.5069	0.203	15	118.5069	0.041	15	119.1475	0.757	223	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(N[6]C[6]Co)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6,6a]H)(N[6]C[6]Co)(H){1|C<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|Co<6>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.1790	0.000	1	118.7670	0.206	4	119.1475	0.757	223	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(N[6]C[6]Co)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6,6a]H)(N[6]C[6]Co)(H){3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|Co<6>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.9630	0.280	3	118.7670	0.206	4	119.1475	0.757	223	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(N[6]C[6]Cr)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6,6a]H)(N[6]C[6]Cr)(H){1|H<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|Cr<6>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.6481	0.508	7	118.6481	0.258	7	119.1475	0.757	223	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(N[6]C[6]Cu)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6,6a]H)(N[6]C[6]Cu)(H){1|H<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|Cu<4>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.3170	0.152	3	118.5943	0.245	8	119.1475	0.757	223	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(N[6]C[6]Cu)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6,6a]H)(N[6]C[6]Cu)(H){1|H<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|Cu<5>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.0150	0.000	1	118.5943	0.245	8	119.1475	0.757	223	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(N[6]C[6]Cu)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6,6a]H)(N[6]C[6]Cu)(H){3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|Cu<2>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.5980	0.249	2	118.5943	0.245	8	119.1475	0.757	223	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(N[6]C[6]Cu)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6,6a]H)(N[6]C[6]Cu)(H){3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|Cu<5>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	119.2960	0.240	2	118.5943	0.245	8	119.1475	0.757	223	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(N[6]C[6]Fe)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6,6a]H)(N[6]C[6]Fe)(H){1|H<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|Fe<8>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.3400	0.000	1	118.3657	0.361	3	119.1475	0.757	223	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(N[6]C[6]Fe)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6,6a]H)(N[6]C[6]Fe)(H){1|N<3>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|Fe<6>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	117.7780	0.000	1	118.3657	0.361	3	119.1475	0.757	223	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(N[6]C[6]Fe)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6,6a]H)(N[6]C[6]Fe)(H){3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|Fe<6>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.9790	0.000	1	118.3657	0.361	3	119.1475	0.757	223	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(N[6]C[6]Ga)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6,6a]H)(N[6]C[6]Ga)(H){1|H<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|Ga<6>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.6563	0.384	3	118.6563	0.148	3	119.1475	0.757	223	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(N[6]C[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6,6a]H)(N[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){2|H<1>,3|C<3>}	H(C[6]C[6]N[6])	120.1792	0.706	10	120.0812	0.383	16	119.1475	0.757	223	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(N[6]C[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6,6a]H)(N[6]C[6]H)(H){1|N<3>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){2|H<1>,3|C<3>}	H(C[6]C[6]N[6])	119.6620	0.291	2	120.0812	0.383	16	119.1475	0.757	223	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(N[6]C[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6,6a]H)(N[6]C[6]H)(H){1|O<2>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){2|H<1>,3|C<3>}	H(C[6]C[6]N[6])	119.3650	0.000	1	120.0812	0.383	16	119.1475	0.757	223	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(N[6]C[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6,6a]H)(N[6]C[6]H)(H){3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){2|H<1>,3|C<3>}	H(C[6]C[6]N[6])	120.2730	0.221	3	120.0812	0.383	16	119.1475	0.757	223	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(N[6]C[6]H)(H)	C[6](C[6,6a]C[6,6a]N[6a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6,6a]H)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6,6a]C[6,6a]N[6a])(C[6]N[6]H)(H){1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	120.0645	0.103	2	120.4487	0.448	3	119.1475	0.757	223	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(N[6]C[6]H)(H)	C[6](C[6,6a]C[6,6a]N[6a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6,6a]H)(N[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>}	C[6](C[6,6a]C[6,6a]N[6a])(C[6]N[6]H)(H){1|H<1>,2|C<3>,2|C<4>}	H(C[6]C[6]N[6])	121.2170	0.000	1	120.4487	0.448	3	119.1475	0.757	223	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(N[6]C[6]Ir)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6,6a]H)(N[6]C[6]Ir)(H){3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|Ir<6>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.7217	0.555	25	118.7170	0.270	29	119.1475	0.757	223	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(N[6]C[6]Ir)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6,6a]H)(N[6]C[6]Ir)(H){3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|Ir<7>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.6875	0.239	4	118.7170	0.270	29	119.1475	0.757	223	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(N[6]C[6]Mn)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6,6a]H)(N[6]C[6]Mn)(H){1|C<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|Mn<6>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	119.0105	0.159	4	118.8184	0.113	8	119.1475	0.757	223	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(N[6]C[6]Mn)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6,6a]H)(N[6]C[6]Mn)(H){1|C<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|Mn<7>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.5157	0.369	3	118.8184	0.113	8	119.1475	0.757	223	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(N[6]C[6]Mn)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6,6a]H)(N[6]C[6]Mn)(H){3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|Mn<6>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.9580	0.000	1	118.8184	0.113	8	119.1475	0.757	223	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(N[6]C[6]N)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6,6a]H)(N[6]C[6]N)(H){1|C<4>,1|H<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]N[6])	119.5150	0.000	1	121.2057	7.392	3	119.1475	0.757	223	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(N[6]C[6]N)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6,6a]H)(N[6]C[6]N)(H){1|H<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|H<1>,1|N<2>,3|C<3>}	H(C[6]C[6]N[6])	124.3420	0.000	1	121.2057	7.392	3	119.1475	0.757	223	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(N[6]C[6]N)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6,6a]H)(N[6]C[6]N)(H){3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]N[6])	119.7600	0.000	1	121.2057	7.392	3	119.1475	0.757	223	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(N[6]C[6]Ni)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6,6a]H)(N[6]C[6]Ni)(H){1|H<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|Ni<6>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.7225	0.179	2	118.7963	0.032	3	119.1475	0.757	223	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(N[6]C[6]Ni)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6,6a]H)(N[6]C[6]Ni)(H){3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|Ni<6>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.9440	0.000	1	118.7963	0.032	3	119.1475	0.757	223	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(N[6]C[6]O)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6,6a]H)(N[6]C[6]O)(H){1|H<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|H<1>,1|O<1>,3|C<3>}	H(C[6]C[6]N[6])	120.0270	0.000	1	120.1323	2.373	6	119.1475	0.757	223	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(N[6]C[6]O)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6,6a]H)(N[6]C[6]O)(H){3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|H<1>,1|O<1>,3|C<3>}	H(C[6]C[6]N[6])	120.1534	1.721	5	120.1323	2.373	6	119.1475	0.757	223	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(N[6]C[6]Pd)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6,6a]H)(N[6]C[6]Pd)(H){1|C<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|Pd<4>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.9376	0.182	5	118.8612	0.136	17	119.1475	0.757	223	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(N[6]C[6]Pd)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6,6a]H)(N[6]C[6]Pd)(H){1|H<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|Pd<4>,1|C<2>,3|C<3>}	H(C[6]C[6]N[6])	118.5100	0.068	2	118.8612	0.136	17	119.1475	0.757	223	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(N[6]C[6]Pd)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6,6a]H)(N[6]C[6]Pd)(H){1|H<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|Pd<4>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.5700	0.000	1	118.8612	0.136	17	119.1475	0.757	223	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(N[6]C[6]Pd)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6,6a]H)(N[6]C[6]Pd)(H){3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|Pd<4>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.9292	0.453	9	118.8612	0.136	17	119.1475	0.757	223	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(N[6]C[6]Pt)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6,6a]H)(N[6]C[6]Pt)(H){1|H<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|Pt<4>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	119.5860	0.000	1	118.8368	0.174	6	119.1475	0.757	223	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(N[6]C[6]Pt)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6,6a]H)(N[6]C[6]Pt)(H){1|N<3>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|Pt<4>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.6250	0.000	1	118.8368	0.174	6	119.1475	0.757	223	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(N[6]C[6]Pt)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6,6a]H)(N[6]C[6]Pt)(H){3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|Pt<4>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.7025	0.252	4	118.8368	0.174	6	119.1475	0.757	223	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(N[6]C[6]Re)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6,6a]H)(N[6]C[6]Re)(H){3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|Re<6>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	119.2350	0.000	1	119.2350	0.000	1	119.1475	0.757	223	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(N[6]C[6]Rh)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6,6a]H)(N[6]C[6]Rh)(H){1|H<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|Rh<6>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	119.1460	0.000	1	119.1460	0.000	1	119.1475	0.757	223	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(N[6]C[6]Tc)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6,6a]H)(N[6]C[6]Tc)(H){3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|Tc<6>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.8185	0.049	2	118.8185	0.002	2	119.1475	0.757	223	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(N[6]C[6]Th)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6,6a]H)(N[6]C[6]Th)(H){2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|Th<13>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	119.5270	0.000	1	119.5270	0.000	1	119.1475	0.757	223	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(N[6]C[6]Zn)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6,6a]H)(N[6]C[6]Zn)(H){1|C<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|Zn<5>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.7975	0.463	15	119.0711	1.387	21	119.1475	0.757	223	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(N[6]C[6]Zn)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6,6a]H)(N[6]C[6]Zn)(H){1|C<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|Zn<6>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	122.3170	0.969	2	119.0711	1.387	21	119.1475	0.757	223	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(N[6]C[6]Zn)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6,6a]H)(N[6]C[6]Zn)(H){1|H<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|Zn<4>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.2860	0.187	2	119.0711	1.387	21	119.1475	0.757	223	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(N[6]C[6]Zn)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6,6a]H)(N[6]C[6]Zn)(H){3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|Zn<4>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.6625	0.022	2	119.0711	1.387	21	119.1475	0.757	223	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(N[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Br)	H(C[6]C[6]N[6])	C[6](C[6]C[6]Br)(N[6]C[6]C)(H){1|Br<1>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Br){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	119.2357	0.208	3	120.0778	0.190	33	119.9072	1.012	164	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(N[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Br)	H(C[6]C[6]N[6])	C[6](C[6]C[6]Br)(N[6]C[6]C)(H){1|C<3>,1|H<1>,1|I<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Br){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	119.4190	0.000	1	120.0778	0.190	33	119.9072	1.012	164	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(N[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Br)	H(C[6]C[6]N[6])	C[6](C[6]C[6]Br)(N[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Br){1|Br<1>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	120.2699	0.389	14	120.0778	0.190	33	119.9072	1.012	164	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(N[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Br)	H(C[6]C[6]N[6])	C[6](C[6]C[6]Br)(N[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Br){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	120.1109	0.259	15	120.0778	0.190	33	119.9072	1.012	164	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(N[6]C[6]C)(H)	C[6](C[6]N[6]H)(C[6]N[6]O)(Br)	H(C[6]C[6]N[6])	C[6](C[6]C[6]Br)(N[6]C[6]C)(H){1|C<4>,1|H<1>,1|N<3>,1|O<1>}	C[6](C[6]N[6]H)(C[6]N[6]O)(Br){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	123.1850	0.000	1	124.2800	2.398	2	119.9072	1.012	164	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(N[6]C[6]C)(H)	C[6](C[6]N[6]H)(C[6]N[6]O)(Br)	H(C[6]C[6]N[6])	C[6](C[6]C[6]Br)(N[6]C[6]C)(H){1|N<2>,2|O<1>}	C[6](C[6]N[6]H)(C[6]N[6]O)(Br){1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	125.3750	0.000	1	124.2800	2.398	2	119.9072	1.012	164	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(N[6]C[6]Co)(H)	C[6](C[6]C[6]Br)(C[6]N[6]H)(Br)	H(C[6]C[6]N[6])	C[6](C[6]C[6]Br)(N[6]C[6]Co)(H){1|Br<1>,1|C<3>,1|H<1>}	C[6](C[6]C[6]Br)(C[6]N[6]H)(Br){1|Br<1>,1|Co<6>,1|C<3>}	H(C[6]C[6]N[6])	118.7557	0.477	6	118.7557	0.228	6	119.9072	1.012	164	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(N[6]C[6]Co)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Br)	H(C[6]C[6]N[6])	C[6](C[6]C[6]Br)(N[6]C[6]Co)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Br){1|Br<1>,1|Co<6>,1|C<3>}	H(C[6]C[6]N[6])	119.4488	0.453	19	119.4156	0.216	20	119.9072	1.012	164	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(N[6]C[6]Co)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Br)	H(C[6]C[6]N[6])	C[6](C[6]C[6]Br)(N[6]C[6]Co)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Br){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7860	0.000	1	119.4156	0.216	20	119.9072	1.012	164	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(N[6]C[6]Co)(H)	C[6](C[6]N[6]H)2(Br)	H(C[6]C[6]N[6])	C[6](C[6]C[6]Br)(N[6]C[6]Co)(H){1|N<2>,2|H<1>}	C[6](C[6]N[6]H)2(Br){1|Co<6>,1|C<3>}	H(C[6]C[6]N[6])	119.4630	0.000	1	119.4630	0.000	1	119.9072	1.012	164	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(N[6]C[6]Cu)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Br)	H(C[6]C[6]N[6])	C[6](C[6]C[6]Br)(N[6]C[6]Cu)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Br){1|Cu<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.9000	0.000	1	119.1045	0.084	2	119.9072	1.012	164	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(N[6]C[6]Cu)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Br)	H(C[6]C[6]N[6])	C[6](C[6]C[6]Br)(N[6]C[6]Cu)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Br){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.3090	0.000	1	119.1045	0.084	2	119.9072	1.012	164	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(N[6]C[6]Fe)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Br)	H(C[6]C[6]N[6])	C[6](C[6]C[6]Br)(N[6]C[6]Fe)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Br){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.1398	0.212	6	119.1398	0.045	6	119.9072	1.012	164	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(N[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(Br)	H(C[6]C[6]N[6])	C[6](C[6]C[6]Br)(N[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(Br){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	120.4760	0.000	1	120.4760	0.000	1	119.9072	1.012	164	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Br)	H(C[6]C[6]N[6])	C[6](C[6]C[6]Br)(N[6]C[6]H)(H){1|Br<1>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Br){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	120.3530	0.000	1	120.3842	0.567	52	119.9072	1.012	164	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Br)	H(C[6]C[6]N[6])	C[6](C[6]C[6]Br)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Br){1|Br<1>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	120.8580	0.000	1	120.3842	0.567	52	119.9072	1.012	164	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Br)	H(C[6]C[6]N[6])	C[6](C[6]C[6]Br)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Br){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	120.0145	0.169	2	120.3842	0.567	52	119.9072	1.012	164	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Br)	H(C[6]C[6]N[6])	C[6](C[6]C[6]Br)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Br){1|Br<1>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	121.6460	2.289	3	120.3842	0.567	52	119.9072	1.012	164	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Br)	H(C[6]C[6]N[6])	C[6](C[6]C[6]Br)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Br){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	119.9842	0.200	16	120.3842	0.567	52	119.9072	1.012	164	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Br)	H(C[6]C[6]N[6])	C[6](C[6]C[6]Br)(N[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Br){1|Br<1>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	120.0653	1.275	3	120.3842	0.567	52	119.9072	1.012	164	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Br)	H(C[6]C[6]N[6])	C[6](C[6]C[6]Br)(N[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Br){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	120.5600	0.472	25	120.3842	0.567	52	119.9072	1.012	164	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Br)	H(C[6]C[6]N[6])	C[6](C[6]C[6]Br)(N[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Br){1|H<1>,2|C<3>}	H(C[6]C[6]N[6])	119.8560	0.000	1	120.3842	0.567	52	119.9072	1.012	164	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(N[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(Br)	H(C[6]C[6]N[6])	C[6](C[6]C[6]Br)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(Br){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	119.0230	0.000	1	119.0230	0.000	1	119.9072	1.012	164	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(N[6]C[6]H)(H)	C[6](C[6]N[6]H)(C[6]N[6]N)(Br)	H(C[6]C[6]N[6])	C[6](C[6]C[6]Br)(N[6]C[6]H)(H){1|O<1>,2|N<3>}	C[6](C[6]N[6]H)(C[6]N[6]N)(Br){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	120.8560	0.000	1	120.8560	0.000	1	119.9072	1.012	164	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(N[6]C[6]Ir)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Br)	H(C[6]C[6]N[6])	C[6](C[6]C[6]Br)(N[6]C[6]Ir)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Br){1|Ir<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.6385	0.580	6	119.6385	0.336	6	119.9072	1.012	164	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(N[6]C[6]Ni)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Br)	H(C[6]C[6]N[6])	C[6](C[6]C[6]Br)(N[6]C[6]Ni)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Br){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.1258	0.784	6	119.0456	0.464	8	119.9072	1.012	164	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(N[6]C[6]Ni)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Br)	H(C[6]C[6]N[6])	C[6](C[6]C[6]Br)(N[6]C[6]Ni)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Br){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8050	0.130	2	119.0456	0.464	8	119.9072	1.012	164	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(N[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Br)	H(C[6]C[6]N[6])	C[6](C[6]C[6]Br)(N[6]C[6]O)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Br){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]N[6])	119.5265	0.193	2	121.0410	3.316	6	119.9072	1.012	164	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(N[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Br)	H(C[6]C[6]N[6])	C[6](C[6]C[6]Br)(N[6]C[6]O)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Br){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]N[6])	121.7982	1.795	4	121.0410	3.316	6	119.9072	1.012	164	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(N[6]C[6]Os)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Br)	H(C[6]C[6]N[6])	C[6](C[6]C[6]Br)(N[6]C[6]Os)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Br){1|Os<9>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.3803	0.143	3	119.3803	0.020	3	119.9072	1.012	164	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(N[6]C[6]Pd)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Br)	H(C[6]C[6]N[6])	C[6](C[6]C[6]Br)(N[6]C[6]Pd)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Br){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.1680	0.079	2	119.1680	0.006	2	119.9072	1.012	164	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(N[6]C[6]Pt)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Br)	H(C[6]C[6]N[6])	C[6](C[6]C[6]Br)(N[6]C[6]Pt)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Br){1|Pt<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8900	0.000	1	118.8900	0.000	1	119.9072	1.012	164	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(N[6]C[6]Re)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Br)	H(C[6]C[6]N[6])	C[6](C[6]C[6]Br)(N[6]C[6]Re)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Br){1|Re<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7340	0.000	1	118.7770	0.214	3	119.9072	1.012	164	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(N[6]C[6]Re)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Br)	H(C[6]C[6]N[6])	C[6](C[6]C[6]Br)(N[6]C[6]Re)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Br){1|Re<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7985	0.653	2	118.7770	0.214	3	119.9072	1.012	164	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(N[6]C[6]Ru)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Br)	H(C[6]C[6]N[6])	C[6](C[6]C[6]Br)(N[6]C[6]Ru)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Br){1|Ru<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.2570	0.491	2	119.2570	0.241	2	119.9072	1.012	164	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(N[6]C[6]Ru)(H)	C[6](C[6]N[6]H)2(Br)	H(C[6]C[6]N[6])	C[6](C[6]C[6]Br)(N[6]C[6]Ru)(H){1|C<4>,1|H<1>,1|N<2>}	C[6](C[6]N[6]H)2(Br){1|Ru<5>,1|C<3>}	H(C[6]C[6]N[6])	119.6695	0.209	2	119.6695	0.044	2	119.9072	1.012	164	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(N[6]C[6]Zn)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Br)	H(C[6]C[6]N[6])	C[6](C[6]C[6]Br)(N[6]C[6]Zn)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Br){1|Zn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5900	0.000	1	118.6493	0.028	3	119.9072	1.012	164	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(N[6]C[6]Zn)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Br)	H(C[6]C[6]N[6])	C[6](C[6]C[6]Br)(N[6]C[6]Zn)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Br){1|Zn<6>,2|C<3>}	H(C[6]C[6]N[6])	118.6790	0.226	2	118.6493	0.028	3	119.9072	1.012	164	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(N[6]C[6]Zn)(H)	C[6](C[6]C[6]N[6])(C[6]N[6]H)(Br)	H(C[6]C[6]N[6])	C[6](C[6]C[6]Br)(N[6]C[6]Zn)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]N[6])(C[6]N[6]H)(Br){1|Zn<4>,1|N<3>,2|C<3>}	H(C[6]C[6]N[6])	119.4780	0.000	1	119.4780	0.000	1	119.9072	1.012	164	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(N[6]N[6]C)(H)	C[6](C[6]C[6]O)(C[6]N[6]H)(Br)	H(C[6]C[6]N[6])	C[6](C[6]C[6]Br)(N[6]N[6]C)(H){1|C<3>,1|C<4>,1|O<1>}	C[6](C[6]C[6]O)(C[6]N[6]H)(Br){1|Br<1>,1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]N[6])	118.4810	0.000	1	118.4810	0.000	1	119.9072	1.012	164	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(N[6]N[6]H)(H)	C[6](C[6]C[6]O)(C[6]N[6]H)(Br)	H(C[6]C[6]N[6])	C[6](C[6]C[6]Br)(N[6]N[6]H)(H){1|C<3>,1|O<2>}	C[6](C[6]C[6]O)(C[6]N[6]H)(Br){1|N<2>,2|H<1>}	H(C[6]C[6]N[6])	120.0710	0.000	1	120.0710	0.000	1	119.9072	1.012	164	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(N[6]C[6]B)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Cl)	H(C[6]C[6]N[6])	C[6](C[6]C[6]Cl)(N[6]C[6]B)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Cl){1|B<3>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.2660	0.000	1	119.2660	0.000	1	120.1430	1.773	153	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(N[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Cl)	H(C[6]C[6]N[6])	C[6](C[6]C[6]Cl)(N[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Cl){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	120.1490	0.213	3	120.1490	0.045	3	120.1430	1.773	153	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(N[6]C[6]Co)(H)	C[6](C[6]C[6]2)(C[6]N[6]H)(Cl)	H(C[6]C[6]N[6])	C[6](C[6]C[6]Cl)(N[6]C[6]Co)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]2)(C[6]N[6]H)(Cl){1|Co<6>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	119.0850	0.000	1	119.0850	0.000	1	120.1430	1.773	153	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(N[6]C[6]Co)(H)	C[6](C[6]C[6]Cl)(C[6]N[6]H)(Cl)	H(C[6]C[6]N[6])	C[6](C[6]C[6]Cl)(N[6]C[6]Co)(H){1|Cl<1>,1|C<3>,1|H<1>}	C[6](C[6]C[6]Cl)(C[6]N[6]H)(Cl){1|Cl<1>,1|Co<6>,1|C<3>}	H(C[6]C[6]N[6])	118.7855	0.028	2	118.7855	0.001	2	120.1430	1.773	153	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(N[6]C[6]Co)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Cl)	H(C[6]C[6]N[6])	C[6](C[6]C[6]Cl)(N[6]C[6]Co)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Cl){1|Cl<1>,1|Co<6>,1|C<3>}	H(C[6]C[6]N[6])	119.4855	0.302	4	119.3402	0.105	6	120.1430	1.773	153	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(N[6]C[6]Co)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Cl)	H(C[6]C[6]N[6])	C[6](C[6]C[6]Cl)(N[6]C[6]Co)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Cl){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.0495	0.006	2	119.3402	0.105	6	120.1430	1.773	153	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(N[6]C[6]Cu)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Cl)	H(C[6]C[6]N[6])	C[6](C[6]C[6]Cl)(N[6]C[6]Cu)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Cl){1|Cl<1>,1|Cu<5>,1|C<3>}	H(C[6]C[6]N[6])	118.6610	0.000	1	119.1414	0.061	7	120.1430	1.773	153	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(N[6]C[6]Cu)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Cl)	H(C[6]C[6]N[6])	C[6](C[6]C[6]Cl)(N[6]C[6]Cu)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Cl){1|Cu<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.1070	0.214	2	119.1414	0.061	7	120.1430	1.773	153	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(N[6]C[6]Cu)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Cl)	H(C[6]C[6]N[6])	C[6](C[6]C[6]Cl)(N[6]C[6]Cu)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Cl){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.2788	0.054	4	119.1414	0.061	7	120.1430	1.773	153	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(N[6]C[6]Er)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Cl)	H(C[6]C[6]N[6])	C[6](C[6]C[6]Cl)(N[6]C[6]Er)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Cl){1|Er<15>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	118.9540	0.000	1	118.9540	0.000	1	120.1430	1.773	153	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(N[6]C[6]Fe)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Cl)	H(C[6]C[6]N[6])	C[6](C[6]C[6]Cl)(N[6]C[6]Fe)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Cl){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.4115	0.111	2	119.4115	0.012	2	120.1430	1.773	153	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Cl)	H(C[6]C[6]N[6])	C[6](C[6]C[6]Cl)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Cl){1|Cl<1>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	120.4930	0.000	1	121.1307	1.882	66	120.1430	1.773	153	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Cl)	H(C[6]C[6]N[6])	C[6](C[6]C[6]Cl)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Cl){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	121.5337	2.253	21	121.1307	1.882	66	120.1430	1.773	153	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Cl)	H(C[6]C[6]N[6])	C[6](C[6]C[6]Cl)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Cl){1|Cl<1>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	122.4230	2.587	2	121.1307	1.882	66	120.1430	1.773	153	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Cl)	H(C[6]C[6]N[6])	C[6](C[6]C[6]Cl)(N[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Cl){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	120.8475	0.442	16	121.1307	1.882	66	120.1430	1.773	153	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Cl)	H(C[6]C[6]N[6])	C[6](C[6]C[6]Cl)(N[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Cl){1|Cl<1>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	120.9047	0.238	26	121.1307	1.882	66	120.1430	1.773	153	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(N[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(Cl)	H(C[6]C[6]N[6])	C[6](C[6]C[6]Cl)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(Cl){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	119.1140	0.000	1	119.1140	0.000	1	120.1430	1.773	153	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(N[6]C[6]H)(H)	C[6](C[6]N[6]H)2(Cl)	H(C[6]C[6]N[6])	C[6](C[6]C[6]Cl)(N[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]N[6]H)2(Cl){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	120.5600	0.000	1	120.5600	0.000	1	120.1430	1.773	153	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(N[6]C[6]Ni)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Cl)	H(C[6]C[6]N[6])	C[6](C[6]C[6]Cl)(N[6]C[6]Ni)(H){1|C<3>,1|H<1>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Cl){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.5900	0.316	6	119.3351	0.166	14	120.1430	1.773	153	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(N[6]C[6]Ni)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Cl)	H(C[6]C[6]N[6])	C[6](C[6]C[6]Cl)(N[6]C[6]Ni)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Cl){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.0270	0.186	7	119.3351	0.166	14	120.1430	1.773	153	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(N[6]C[6]Ni)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Cl)	H(C[6]C[6]N[6])	C[6](C[6]C[6]Cl)(N[6]C[6]Ni)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Cl){2|Ni<4>,1|C<3>}	H(C[6]C[6]N[6])	119.9620	0.000	1	119.3351	0.166	14	120.1430	1.773	153	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(N[6]C[6]Os)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Cl)	H(C[6]C[6]N[6])	C[6](C[6]C[6]Cl)(N[6]C[6]Os)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Cl){1|Os<9>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.6105	0.045	2	119.6105	0.002	2	120.1430	1.773	153	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(N[6]C[6]Pd)(H)	C[6](C[6]C[6]Cl)(C[6]N[6]H)(Cl)	H(C[6]C[6]N[6])	C[6](C[6]C[6]Cl)(N[6]C[6]Pd)(H){1|Cl<1>,1|C<3>,1|H<1>}	C[6](C[6]C[6]Cl)(C[6]N[6]H)(Cl){1|Cl<1>,1|Pd<4>,1|C<3>}	H(C[6]C[6]N[6])	118.7433	0.341	4	118.7433	0.116	4	120.1430	1.773	153	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(N[6]C[6]Pd)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Cl)	H(C[6]C[6]N[6])	C[6](C[6]C[6]Cl)(N[6]C[6]Pd)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Cl){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.2762	0.479	28	119.2762	0.229	28	120.1430	1.773	153	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(N[6]C[6]Re)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Cl)	H(C[6]C[6]N[6])	C[6](C[6]C[6]Cl)(N[6]C[6]Re)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Cl){1|Re<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.7707	0.130	3	119.7707	0.017	3	120.1430	1.773	153	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(N[6]C[6]Ru)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Cl)	H(C[6]C[6]N[6])	C[6](C[6]C[6]Cl)(N[6]C[6]Ru)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Cl){1|Ru<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.1050	0.000	1	119.1050	0.000	1	120.1430	1.773	153	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(N[6]C[6]Ru)(H)	C[6](C[6]N[6]H)2(Cl)	H(C[6]C[6]N[6])	C[6](C[6]C[6]Cl)(N[6]C[6]Ru)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]N[6]H)2(Cl){1|Ru<6>,1|C<3>}	H(C[6]C[6]N[6])	119.5335	0.039	2	119.5335	0.002	2	120.1430	1.773	153	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(N[6]C[6]Y)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Cl)	H(C[6]C[6]N[6])	C[6](C[6]C[6]Cl)(N[6]C[6]Y)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Cl){1|Y<15>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	119.1340	0.000	1	119.1340	0.000	1	120.1430	1.773	153	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(N[6]C[6]Zn)(H)	C[6](C[6]C[6]Cl)(C[6]N[6]H)(Cl)	H(C[6]C[6]N[6])	C[6](C[6]C[6]Cl)(N[6]C[6]Zn)(H){1|Cl<1>,1|C<3>,1|H<1>}	C[6](C[6]C[6]Cl)(C[6]N[6]H)(Cl){1|Cl<1>,1|Zn<4>,1|C<3>}	H(C[6]C[6]N[6])	122.1400	1.171	2	122.1400	1.371	2	120.1430	1.773	153	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(N[6]C[6]Zn)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(Cl)	H(C[6]C[6]N[6])	C[6](C[6]C[6]Cl)(N[6]C[6]Zn)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(Cl){1|Zn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.5758	0.158	5	119.5758	0.025	5	120.1430	1.773	153	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:F-1:	C[6]-3:	C[6](C[6]C[6]F)(N[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(F)	H(C[6]C[6]N[6])	C[6](C[6]C[6]F)(N[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(F){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	120.7220	0.000	1	120.7220	0.000	1	120.4612	0.679	20	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:F-1:	C[6]-3:	C[6](C[6]C[6]F)(N[6]C[6]C)(H)	C[6](C[6]N[6]H)(C[6]N[6]O)(F)	H(C[6]C[6]N[6])	C[6](C[6]C[6]F)(N[6]C[6]C)(H){1|N<2>,2|O<1>}	C[6](C[6]N[6]H)(C[6]N[6]O)(F){1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	120.2835	0.098	2	120.2835	0.010	2	120.4612	0.679	20	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:F-1:	C[6]-3:	C[6](C[6]C[6]F)(N[6]C[6]H)(H)	C[6](C[6]N[6]H)(C[6]N[6]N)(F)	H(C[6]C[6]N[6])	C[6](C[6]C[6]F)(N[6]C[6]H)(H){1|O<1>,2|N<3>}	C[6](C[6]N[6]H)(C[6]N[6]N)(F){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	120.1615	0.251	15	120.1615	0.063	15	120.4612	0.679	20	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:F-1:	C[6]-3:	C[6](C[6]C[6]F)(N[6]C[6]O)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(F)	H(C[6]C[6]N[6])	C[6](C[6]C[6]F)(N[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(F){1|C<3>,1|F<1>,1|O<1>}	H(C[6]C[6]N[6])	122.7560	0.010	2	122.7560	0.000	2	120.4612	0.679	20	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]2)(H)	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]2)(H){1|H<1>,4|C<3>}	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|H<1>,4|C<3>}	H(C[6]C[6]N[6])	119.7630	0.147	4	119.7630	0.022	4	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]2)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]2)(H){1|B<6>,1|C<3>,1|C<4>,3|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	119.6200	0.485	2	119.8033	0.231	10	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]2)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]2)(H){1|C<4>,2|C<3>,3|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	119.7775	0.026	2	119.8033	0.231	10	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]2)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]2)(H){1|H<1>,1|N<3>,1|O<2>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]N[6])	119.4393	0.460	3	119.8033	0.231	10	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]2)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]2)(H){2|H<1>,3|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<4>,2|C<3>}	H(C[6]C[6]N[6])	120.6590	0.000	1	119.8033	0.231	10	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]2)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]2)(H){2|H<1>,3|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]N[6])	120.1305	0.063	2	119.8033	0.231	10	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]2)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]2)(H){1|C<3>,1|N<3>,2|C<4>,2|H<1>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	119.1315	0.028	2	119.1315	0.001	2	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]B)(H)	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]B)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|B<4>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	119.2060	0.146	2	119.2060	0.021	2	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]B)(H)	C[6](C[6]C[6]B)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]B)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]B)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7380	0.074	9	118.7380	0.006	9	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]B)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]B)(H){1|C<2>,1|C<3>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8672	0.161	6	118.8948	0.080	40	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]B)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]B)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|B<3>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.2040	0.297	2	118.8948	0.080	40	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]B)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]B)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8896	0.296	31	118.8948	0.080	40	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]B)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]B)(H){1|C<3>,1|C<5>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6050	0.000	1	118.8948	0.080	40	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]B)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]B)(H){1|C<2>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<4>,1|C<2>,1|C<3>}	H(C[6]C[6]N[6])	118.3530	0.133	2	119.1114	1.178	166	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]B)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]B)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2475	0.132	6	119.1114	1.178	166	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]B)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]B)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6570	0.176	3	119.1114	1.178	166	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]B)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]B)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<3>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8425	0.456	2	119.1114	1.178	166	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]B)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]B)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3115	0.062	2	119.1114	1.178	166	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]B)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]B)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.4395	1.390	4	119.1114	1.178	166	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]B)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]B)(H){1|C<3>,1|H<1>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8969	0.292	9	119.1114	1.178	166	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]B)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]B)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<3>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8862	0.509	12	119.1114	1.178	166	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]B)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]B)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.2690	1.287	96	119.1114	1.178	166	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]B)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]B)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|N<3>}	H(C[6]C[6]N[6])	119.0461	0.113	19	119.1114	1.178	166	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]B)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]B)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,2|B<4>}	H(C[6]C[6]N[6])	121.3100	0.882	2	119.1114	1.178	166	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]B)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]B)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cl<1>,1|B<3>,1|C<3>}	H(C[6]C[6]N[6])	118.9330	0.000	1	119.1114	1.178	166	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]B)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]B)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<3>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.1520	0.000	1	119.1114	1.178	166	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]B)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]B)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2438	0.454	5	119.1114	1.178	166	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]B)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]B)(H){1|Ru<9>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.3310	0.000	1	119.1114	1.178	166	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]B)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]B)(H){2|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	118.6060	0.000	1	119.1114	1.178	166	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]B)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]B)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|B<3>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2600	0.353	6	118.1881	0.034	38	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]B)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]B)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.1746	0.138	32	118.1881	0.034	38	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[4]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[4]C[6])(C[6]N[6]H)(H){1|C<3>,2|H<1>,3|C<4>}	H(C[6]C[6]N[6])	122.8125	0.896	2	122.8125	0.803	2	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>,2|N<2>}	H(C[6]C[6]N[6])	119.5992	0.208	30	119.6054	0.083	39	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>,2|N<3>}	H(C[6]C[6]N[6])	119.6760	0.505	6	119.6054	0.083	39	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H){1|H<1>,1|O<2>,3|C<3>}	H(C[6]C[6]N[6])	119.2125	0.059	2	119.6054	0.083	39	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|C<4>,2|N<3>}	H(C[6]C[6]N[6])	120.1520	0.000	1	119.6054	0.083	39	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]N[6])	119.5157	0.378	4	119.4727	0.123	6	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|N<2>,1|S<2>}	H(C[6]C[6]N[6])	119.3865	0.405	2	119.4727	0.123	6	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<2>,1|C<3>,1|H<1>}	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|C<2>,1|C<4>,2|C<3>}	H(C[6]C[6]N[6])	124.2680	0.000	1	119.7370	1.020	700	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|C<4>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	119.7292	0.999	695	119.7370	1.020	700	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|Ir<6>,1|C<4>,1|N<3>,2|C<3>}	H(C[6]C[6]N[6])	119.9620	0.177	4	119.7370	1.020	700	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<2>,1|C<3>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	119.5870	0.666	72	119.8197	1.376	576	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<2>,1|C<3>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|I<1>}	H(C[6]C[6]N[6])	119.6693	0.143	11	119.8197	1.376	576	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<2>,1|C<3>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]N[6])	119.7010	0.479	6	119.8197	1.376	576	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	119.9549	1.377	125	119.8197	1.376	576	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,2|C<4>}	H(C[6]C[6]N[6])	119.7240	0.157	2	119.8197	1.376	576	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]N[6])	119.9535	0.148	10	119.8197	1.376	576	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,1|C<4>,1|N<2>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<2>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	118.4920	0.000	1	119.8197	1.376	576	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	119.3620	0.000	1	119.8197	1.376	576	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,2|C<4>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	119.9080	1.223	2	119.8197	1.376	576	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	119.3640	0.208	10	119.8197	1.376	576	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	119.8379	1.266	316	119.8197	1.376	576	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|O<2>}	H(C[6]C[6]N[6])	120.5195	0.022	2	119.8197	1.376	576	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<4>,2|C<3>}	H(C[6]C[6]N[6])	120.1000	1.143	3	119.8197	1.376	576	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]N[6])	120.0900	0.096	6	119.8197	1.376	576	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|U<12>,1|C<3>,1|C<4>,1|O<2>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|U<12>,1|O<2>,2|C<4>}	H(C[6]C[6]N[6])	119.5845	0.489	4	119.8197	1.376	576	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|U<14>,1|C<3>,1|C<4>,1|O<2>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|U<14>,1|O<2>,2|C<4>}	H(C[6]C[6]N[6])	119.7880	0.000	1	119.8197	1.376	576	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|Yb<14>,1|C<3>,1|C<4>,1|O<2>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Yb<14>,1|O<2>,2|C<4>}	H(C[6]C[6]N[6])	119.5600	0.168	3	119.8197	1.376	576	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){3|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	119.2240	0.000	1	119.8197	1.376	576	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|Br<1>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	119.2040	0.000	1	120.1457	2.145	992	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<2>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	119.4331	0.346	8	120.1457	2.145	992	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<2>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	121.8492	5.448	4	120.1457	2.145	992	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<2>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){2|C<3>}	H(C[6]C[6]N[6])	118.9770	0.000	1	120.1457	2.145	992	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	119.6797	1.062	29	120.1457	2.145	992	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,2|C<4>}	H(C[6]C[6]N[6])	119.4740	0.000	1	120.1457	2.145	992	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	125.9090	0.000	1	120.1457	2.145	992	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]N[6])	118.7300	0.636	2	120.1457	2.145	992	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,1|C<4>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	119.1580	0.000	1	120.1457	2.145	992	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,1|F<1>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	119.6275	0.052	2	120.1457	2.145	992	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	119.6935	1.464	11	120.1457	2.145	992	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	119.3119	0.431	25	120.1457	2.145	992	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	119.4215	0.122	4	120.1457	2.145	992	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|O<2>}	H(C[6]C[6]N[6])	119.8060	0.000	1	120.1457	2.145	992	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,1|H<1>,1|P<4>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	119.4110	0.055	2	120.1457	2.145	992	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,1|H<1>,1|P<5>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	119.3120	0.000	1	120.1457	2.145	992	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,1|H<1>,1|S<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]N[6])	119.2960	0.000	1	120.1457	2.145	992	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,1|H<1>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	119.0143	0.277	4	120.1457	2.145	992	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,1|H<1>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|O<2>}	H(C[6]C[6]N[6])	120.5818	0.719	5	120.1457	2.145	992	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,1|H<1>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]N[6])	119.8240	0.000	1	120.1457	2.145	992	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<2>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	131.4890	0.000	1	120.1457	2.145	992	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<3>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	119.8290	0.000	1	120.1457	2.145	992	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Br<1>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	119.9931	0.259	15	120.1457	2.145	992	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<2>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	120.2579	1.470	8	120.1457	2.145	992	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|F<1>}	H(C[6]C[6]N[6])	119.8710	0.000	1	120.1457	2.145	992	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	120.1933	1.427	638	120.1457	2.145	992	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|I<1>}	H(C[6]C[6]N[6])	119.9982	0.455	24	120.1457	2.145	992	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|N<2>}	H(C[6]C[6]N[6])	120.4013	0.221	3	120.1457	2.145	992	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]N[6])	120.2630	0.171	28	120.1457	2.145	992	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|O<2>}	H(C[6]C[6]N[6])	120.5634	0.470	11	120.1457	2.145	992	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<5>,1|H<1>}	H(C[6]C[6]N[6])	118.9370	0.683	4	120.1457	2.145	992	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,2|C<4>}	H(C[6]C[6]N[6])	120.0634	0.447	20	120.1457	2.145	992	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<4>,2|C<3>}	H(C[6]C[6]N[6])	120.1961	1.311	43	120.1457	2.145	992	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cl<1>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	119.7627	0.376	3	120.1457	2.145	992	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]N[6])	121.7510	2.498	10	120.1457	2.145	992	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<4>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	120.2440	0.000	1	120.1457	2.145	992	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|O<2>,2|C<3>}	H(C[6]C[6]N[6])	120.6260	0.000	1	120.1457	2.145	992	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	119.5090	0.000	1	120.1457	2.145	992	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){3|C<3>}	H(C[6]C[6]N[6])	120.0760	0.000	1	120.1457	2.145	992	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|Cl<1>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	119.4647	0.236	4	120.1457	2.145	992	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	120.1351	2.136	46	120.1457	2.145	992	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	126.0240	0.000	1	120.1457	2.145	992	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]N[6])	119.6660	0.000	1	120.1457	2.145	992	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	119.2078	0.197	4	120.1457	2.145	992	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	119.7860	0.304	4	120.1457	2.145	992	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|Ir<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	119.7040	0.000	1	120.1457	2.145	992	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|Ir<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,2|C<4>}	H(C[6]C[6]N[6])	119.3840	0.000	1	120.1457	2.145	992	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<4>,2|C<3>}	H(C[6]C[6]N[6])	119.9980	0.000	1	120.1457	2.145	992	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|Pd<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<4>,2|C<3>}	H(C[6]C[6]N[6])	119.0955	0.421	2	120.1457	2.145	992	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|Ru<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	120.1290	0.274	2	120.1457	2.145	992	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|Ru<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]N[6])	123.0320	0.000	1	120.1457	2.145	992	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|Zr<16>,1|C<4>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zr<16>,1|O<2>,2|C<4>}	H(C[6]C[6]N[6])	119.7498	0.028	4	120.1457	2.145	992	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){2|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	119.1980	0.000	1	120.1457	2.145	992	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6]Ir)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|Ir<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]Ir)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]N[6])	119.3965	0.558	2	119.8013	1.384	6	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6]Ir)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|Ir<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]Ir)(C[6]N[6]H)(H){1|C<4>,2|C<3>}	H(C[6]C[6]N[6])	120.0037	1.428	4	119.8013	1.384	6	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	119.9223	1.808	12	119.2324	0.835	181	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	119.1811	0.888	136	119.2324	0.835	181	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]N[6])	119.7250	0.000	1	119.2324	0.835	181	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|S<4>}	H(C[6]C[6]N[6])	119.0075	0.325	2	119.2324	0.835	181	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,2|C<4>}	H(C[6]C[6]N[6])	119.4423	0.067	3	119.2324	0.835	181	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]N[6])	119.1596	0.200	27	119.2324	0.835	181	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6]N[5])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[5])(C[6]N[6]H)(H){1|Rh<6>,1|C<4>,3|C<3>}	H(C[6]C[6]N[6])	119.1860	0.000	1	119.0960	0.016	2	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6]N[5])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[5])(C[6]N[6]H)(H){2|C<3>,3|C<4>}	H(C[6]C[6]N[6])	119.0060	0.000	1	119.0960	0.016	2	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H){1|C<3>,1|H<1>,3|C<4>}	H(C[6]C[6]N[6])	118.8792	0.178	4	118.8792	0.032	4	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6]Ni)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|Cl<1>,1|Ni<4>,1|C<3>}	C[6](C[6]C[6]Ni)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	119.4050	0.000	1	119.4050	0.000	1	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<2>,1|C<4>,1|H<1>,1|O<1>}	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6]N[6])	117.9785	0.671	2	119.2741	2.529	14	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,1|C<4>,1|O<2>}	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|O<2>}	H(C[6]C[6]N[6])	120.7392	2.347	4	119.2741	2.529	14	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	119.1530	0.140	4	119.2741	2.529	14	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]N[6])	118.7635	0.653	2	119.2741	2.529	14	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,1|O<1>,2|C<4>}	C[6](C[6]C[6]O)(C[6]N[6]H)(H){2|C<4>,2|H<1>}	H(C[6]C[6]N[6])	117.5760	0.000	1	119.2741	2.529	14	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|H<1>,1|O<1>,2|C<4>}	C[6](C[6]C[6]O)(C[6]N[6]H)(H){2|C<4>,2|H<1>}	H(C[6]C[6]N[6])	119.2080	0.000	1	119.2741	2.529	14	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6]P)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,1|H<1>,1|P<4>}	C[6](C[6]C[6]P)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	119.8210	0.119	2	119.8210	0.014	2	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6]Pd)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|Cl<1>,1|Pd<4>,1|C<3>}	C[6](C[6]C[6]Pd)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	119.4560	0.000	1	119.4560	0.000	1	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,1|C<4>,1|S<2>}	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|O<2>}	H(C[6]C[6]N[6])	119.6089	0.156	13	119.4669	0.072	19	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,1|C<4>,1|S<3>}	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|O<2>}	H(C[6]C[6]N[6])	119.1490	0.380	2	119.4669	0.072	19	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,1|H<1>,1|S<1>}	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	119.1645	0.107	4	119.4669	0.072	19	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>,2|N<2>}	H(C[6]C[6]N[6])	119.7655	0.326	28	119.7055	0.617	207	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|C<4>,1|H<1>,1|N<2>,2|C<3>}	H(C[6]C[6]N[6])	119.5633	0.207	16	119.7055	0.617	207	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|C<4>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	119.7092	0.872	163	119.7055	0.617	207	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]N[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|N<2>,1|N<3>,1|O<1>}	C[6](C[6]N[6]H)(C[6]N[6]N)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	120.3960	2.664	2	119.5399	2.796	24	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]N[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|N<2>,1|N<3>,1|O<1>}	C[6](C[6]N[6]H)(C[6]N[6]N)(H){1|Pt<4>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	118.9820	0.000	1	119.5399	2.796	24	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]N[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|N<2>,2|N<3>}	C[6](C[6]N[6]H)(C[6]N[6]N)(H){1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	123.5170	0.785	2	119.5399	2.796	24	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]N[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|O<1>,2|N<3>}	C[6](C[6]N[6]H)(C[6]N[6]N)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	119.0054	1.221	9	119.5399	2.796	24	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]N[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|O<1>,2|N<3>}	C[6](C[6]N[6]H)(C[6]N[6]N)(H){1|Pd<4>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	119.4380	0.253	2	119.5399	2.796	24	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]N[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|O<1>,2|N<3>}	C[6](C[6]N[6]H)(C[6]N[6]N)(H){1|Pt<4>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	119.0837	1.108	6	119.5399	2.796	24	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]N[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|O<1>,2|N<3>}	C[6](C[6]N[6]H)(C[6]N[6]N)(H){1|Re<6>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	119.2340	0.000	1	119.5399	2.796	24	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]N[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|O<1>,2|N<3>}	C[6](C[6]N[6]H)(C[6]N[6]N)(H){1|Zn<4>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	118.4880	0.000	1	119.5399	2.796	24	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]N[6]H)(C[6]N[6]O)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,1|H<1>,1|N<3>,1|O<1>}	C[6](C[6]N[6]H)(C[6]N[6]O)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	123.1690	0.180	2	120.9688	6.492	4	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]N[6]H)(C[6]N[6]O)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|N<2>,2|O<1>}	C[6](C[6]N[6]H)(C[6]N[6]O)(H){1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	118.7685	0.281	2	120.9688	6.492	4	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<2>,1|H<1>,1|N<2>}	C[6](C[6]N[6]H)2(H){1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	120.2230	0.000	1	119.8997	0.154	4	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]N[6]H)2(H){1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	119.5850	0.255	2	119.8997	0.154	4	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|N<2>,2|H<1>}	C[6](C[6]N[6]H)2(H){1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	120.2060	0.000	1	119.8997	0.154	4	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]D)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]D)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|D<1>,1|H<1>}	H(C[6]C[6]N[6])	119.8895	0.066	2	122.1992	3.366	6	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]D)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]D)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|D<1>,1|H<1>}	H(C[6]C[6]N[6])	123.3540	0.523	4	122.1992	3.366	6	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]D)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]D)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|D<1>,1|H<1>}	H(C[6]C[6]N[6])	119.9640	0.000	1	120.1470	0.022	4	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]D)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]D)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|D<1>}	H(C[6]C[6]N[6])	120.1520	0.000	1	120.1470	0.022	4	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]D)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]D)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|D<1>,1|H<1>}	H(C[6]C[6]N[6])	120.2360	0.132	2	120.1470	0.022	4	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]D)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]D)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|D<1>,1|H<1>}	H(C[6]C[6]N[6])	119.4320	0.039	4	119.4320	0.002	4	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]F)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]F)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|F<1>,1|H<1>}	H(C[6]C[6]N[6])	121.6100	1.584	2	121.6100	2.509	2	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]B[6,6]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]B[6,6]C[6])(C[6]N[6]H)(H){1|C<3>,1|O<2>,2|H<1>,2|N<3>}	H(C[6]C[6]N[6])	118.1680	0.444	2	118.1680	0.197	2	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[4]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[4]C[6])(C[6]N[6]H)(H){1|C<3>,2|C<4>,3|H<1>}	H(C[6]C[6]N[6])	119.9669	0.447	19	119.9669	0.200	19	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H){1|Fe<10>,1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]N[6])	119.3018	0.363	6	119.7524	0.179	35	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H){1|C<3>,1|N<2>,1|N<3>,2|H<1>}	H(C[6]C[6]N[6])	119.9390	0.024	2	119.7524	0.179	35	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H){1|C<3>,2|H<1>,2|N<2>}	H(C[6]C[6]N[6])	119.9975	0.299	2	119.7524	0.179	35	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H){1|C<3>,2|H<1>,2|N<3>}	H(C[6]C[6]N[6])	119.8922	0.520	12	119.7524	0.179	35	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H){1|S<2>,2|C<3>,2|H<1>}	H(C[6]C[6]N[6])	119.6860	0.306	6	119.7524	0.179	35	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H){2|H<1>,3|C<3>}	H(C[6]C[6]N[6])	119.8324	0.179	7	119.7524	0.179	35	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H){1|C<3>,1|N<2>,1|N<3>,2|H<1>}	H(C[6]C[6]N[6])	119.8093	0.357	30	119.8408	0.238	96	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H){1|C<3>,1|N<2>,1|O<2>,2|H<1>}	H(C[6]C[6]N[6])	119.7081	0.781	23	119.8408	0.238	96	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H){1|C<3>,1|N<2>,1|S<2>,2|H<1>}	H(C[6]C[6]N[6])	119.7195	0.288	6	119.8408	0.238	96	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H){1|C<3>,2|H<1>,2|N<2>}	H(C[6]C[6]N[6])	120.0275	0.195	12	119.8408	0.238	96	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H){1|N<2>,2|C<3>,2|H<1>}	H(C[6]C[6]N[6])	119.8267	0.204	10	119.8408	0.238	96	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]N[6])	120.0313	0.507	11	119.8408	0.238	96	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H){1|S<2>,2|C<3>,2|H<1>}	H(C[6]C[6]N[6])	119.9723	0.306	4	119.8408	0.238	96	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<2>,1|C<3>,1|H<1>}	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|C<2>,1|H<1>,2|C<3>}	H(C[6]C[6]N[6])	120.0455	0.477	2	119.9570	1.298	525	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<2>,1|C<3>,1|H<1>}	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	115.3000	0.000	1	119.9570	1.298	525	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]2)(C[6]N[6]H)(H){2|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]N[6])	120.5530	0.000	1	119.9570	1.298	525	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|C<2>,2|C<3>,2|H<1>}	H(C[6]C[6]N[6])	121.5700	1.762	2	119.9570	1.298	525	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|H<1>,4|C<3>}	H(C[6]C[6]N[6])	120.1050	0.547	2	119.9570	1.298	525	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]N[6])	120.1710	0.324	4	119.9570	1.298	525	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]2)(C[6]N[6]H)(H){2|H<1>,3|C<3>}	H(C[6]C[6]N[6])	119.9561	1.126	513	119.9570	1.298	525	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]B)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|B<3>,1|C<3>,1|H<1>}	C[6](C[6]C[6]B)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	120.5780	1.489	35	120.5590	2.167	36	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]B)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|B<4>,1|C<3>,1|C<4>}	C[6](C[6]C[6]B)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	119.8940	0.000	1	120.5590	2.167	36	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]Br)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|Br<1>,1|C<3>,1|H<1>}	C[6](C[6]C[6]Br)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	120.0255	0.341	46	120.0255	0.117	46	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|Br<1>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	119.6233	0.863	3	120.3324	3.105	1155	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<2>,1|C<3>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	120.0624	1.065	32	120.3324	3.105	1155	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<2>,1|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<2>,2|H<1>}	H(C[6]C[6]N[6])	123.1740	0.000	1	120.3324	3.105	1155	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Br<1>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.9280	0.000	1	120.3324	3.105	1155	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	121.2214	2.490	23	120.3324	3.105	1155	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|S<4>}	H(C[6]C[6]N[6])	120.0925	0.025	2	120.3324	3.105	1155	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	120.4292	1.958	420	120.3324	3.105	1155	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<2>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	122.8677	2.796	3	120.3324	3.105	1155	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]N[6])	119.6523	0.440	3	120.3324	3.105	1155	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	120.0874	2.096	46	120.3324	3.105	1155	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<2>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	120.9710	2.582	3	120.3324	3.105	1155	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|C<4>,1|P<4>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	119.9225	0.210	2	120.3324	3.105	1155	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<2>,2|H<1>}	H(C[6]C[6]N[6])	144.4590	0.000	1	120.3324	3.105	1155	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,2|C<4>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	121.4801	2.170	15	120.3324	3.105	1155	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	120.8463	2.000	14	120.3324	3.105	1155	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	120.1564	1.139	580	120.3324	3.105	1155	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]N[6])	121.9785	2.097	4	120.3324	3.105	1155	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|P<4>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	119.9310	0.000	1	120.3324	3.105	1155	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){3|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	119.9930	0.000	1	120.3324	3.105	1155	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]Cl)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|Cl<1>,1|C<3>,1|H<1>}	C[6](C[6]C[6]Cl)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|S<4>}	H(C[6]C[6]N[6])	119.7770	0.000	1	120.0573	0.118	129	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]Cl)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|Cl<1>,1|C<3>,1|H<1>}	C[6](C[6]C[6]Cl)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	120.0595	0.344	128	120.0573	0.118	129	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	120.1836	0.219	5	120.5819	3.157	1685	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|Br<1>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	120.4827	1.198	11	120.5819	3.157	1685	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<2>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	119.6635	0.282	2	120.5819	3.157	1685	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<2>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	134.4540	0.000	1	120.5819	3.157	1685	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	120.8541	1.840	13	120.5819	3.157	1685	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]N[6])	120.5580	0.000	1	120.5819	3.157	1685	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	120.2530	1.125	143	120.5819	3.157	1685	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|C<5>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	129.1630	0.000	1	120.5819	3.157	1685	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|I<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	119.6150	0.681	7	120.5819	3.157	1685	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	124.5347	0.923	3	120.5819	3.157	1685	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	121.4434	2.423	20	120.5819	3.157	1685	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Br<1>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.6830	0.000	1	120.5819	3.157	1685	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	120.3084	1.185	23	120.5819	3.157	1685	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]N[6])	121.3066	2.728	35	120.5819	3.157	1685	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|N<4>}	H(C[6]C[6]N[6])	124.7550	5.397	4	120.5819	3.157	1685	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]N[6])	120.1954	0.258	5	120.5819	3.157	1685	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	120.6771	2.207	207	120.5819	3.157	1685	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]N[6])	120.6355	2.537	17	120.5819	3.157	1685	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]N[6])	120.1920	0.281	2	120.5819	3.157	1685	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	120.2282	1.157	17	120.5819	3.157	1685	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]N[6])	119.9406	0.134	5	120.5819	3.157	1685	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<4>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	119.7633	0.185	7	120.5819	3.157	1685	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<4>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]N[6])	120.1815	0.187	2	120.5819	3.157	1685	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	119.7280	0.000	1	120.5819	3.157	1685	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]N[6])	123.3930	0.000	1	120.5819	3.157	1685	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	H(C[6]C[6]N[6])	125.6200	3.051	6	120.5819	3.157	1685	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	119.8774	0.447	26	120.5819	3.157	1685	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]N[6])	120.8497	1.531	3	120.5819	3.157	1685	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	122.0755	2.584	4	120.5819	3.157	1685	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<4>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]N[6])	120.2240	0.000	2	120.5819	3.157	1685	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|As<3>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	120.2230	0.000	1	120.5819	3.157	1685	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<3>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	120.2328	0.294	13	120.5819	3.157	1685	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	120.2050	0.044	2	120.5819	3.157	1685	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Br<1>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	120.3776	0.567	25	120.5819	3.157	1685	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	121.4274	2.189	79	120.5819	3.157	1685	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|I<1>}	H(C[6]C[6]N[6])	120.4550	0.197	18	120.5819	3.157	1685	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|N<1>}	H(C[6]C[6]N[6])	120.3183	0.520	4	120.5819	3.157	1685	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]N[6])	112.9010	0.000	1	120.5819	3.157	1685	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]N[6])	121.4105	1.758	57	120.5819	3.157	1685	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|N<4>}	H(C[6]C[6]N[6])	121.1848	1.970	4	120.5819	3.157	1685	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]N[6])	120.8052	1.396	19	120.5819	3.157	1685	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|P<4>}	H(C[6]C[6]N[6])	119.9620	0.000	1	120.5819	3.157	1685	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|S<4>}	H(C[6]C[6]N[6])	121.4390	0.000	1	120.5819	3.157	1685	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	120.3430	1.426	483	120.5819	3.157	1685	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cl<1>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	120.4825	0.387	16	120.5819	3.157	1685	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]N[6])	120.4210	1.091	111	120.5819	3.157	1685	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Si<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	120.0740	0.000	1	120.5819	3.157	1685	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|Cl<1>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]N[6])	120.8347	0.426	4	120.5819	3.157	1685	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|Cl<1>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	120.1608	0.324	8	120.5819	3.157	1685	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	120.0395	0.158	2	120.5819	3.157	1685	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]N[6])	120.5340	0.206	3	120.5819	3.157	1685	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|P<4>}	H(C[6]C[6]N[6])	120.0440	0.000	1	120.5819	3.157	1685	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	H(C[6]C[6]N[6])	120.7050	0.000	1	120.5819	3.157	1685	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	120.5382	1.828	251	120.5819	3.157	1685	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.9950	0.000	1	120.5819	3.157	1685	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	120.1790	0.000	1	120.5819	3.157	1685	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|Se<1>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	119.9500	0.000	1	120.5819	3.157	1685	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|Se<1>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]N[6])	120.0910	0.000	1	120.5819	3.157	1685	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]I)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|I<1>}	C[6](C[6]C[6]I)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	120.0456	0.398	30	120.0456	0.158	30	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<1>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	119.6140	0.000	1	119.6745	1.399	603	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]N[6])	119.8870	0.000	1	119.6745	1.399	603	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	119.7372	0.933	32	119.6745	1.399	603	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Br<1>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.3580	0.000	1	119.6745	1.399	603	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]N[6])	122.2350	0.000	1	119.6745	1.399	603	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]N[6])	121.2019	2.103	8	119.6745	1.399	603	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|N<4>}	H(C[6]C[6]N[6])	120.0658	1.518	5	119.6745	1.399	603	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|S<4>}	H(C[6]C[6]N[6])	119.5130	0.185	4	119.6745	1.399	603	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	119.6444	1.172	545	119.6745	1.399	603	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Cl<1>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.5420	0.000	1	119.6745	1.399	603	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]N[6])	119.3195	0.100	4	119.6745	1.399	603	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]N[5])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[5])(C[6]N[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]N[6])	119.0410	0.587	2	119.0410	0.344	2	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]N[6])	120.5901	1.520	8	120.5963	2.022	9	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H){1|C<4>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	120.6460	0.000	1	120.5963	2.022	9	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]N[6])	119.0845	0.059	2	120.1027	1.237	52	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|S<4>}	H(C[6]C[6]N[6])	125.0010	0.000	1	120.1027	1.237	52	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	120.0797	0.893	46	120.1027	1.237	52	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|O<2>,2|C<3>}	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	119.5020	0.053	3	120.1027	1.237	52	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]P)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,2|P<4>}	C[6](C[6]C[6]P)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	119.9700	0.000	1	119.9700	0.000	1	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<1>}	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	121.1049	2.254	8	120.0416	1.249	60	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	119.9074	0.806	43	120.0416	1.249	60	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<3>}	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	119.7690	0.149	8	120.0416	1.249	60	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|S<1>,2|C<3>}	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	119.4910	0.000	1	120.0416	1.249	60	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){2|H<1>,3|C<3>}	H(C[6]C[6]N[6])	119.5760	0.000	1	119.9873	0.848	323	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|C<3>,2|H<1>,2|N<2>}	H(C[6]C[6]N[6])	120.0505	0.491	91	119.9873	0.848	323	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|H<1>,4|C<3>}	H(C[6]C[6]N[6])	119.8430	0.010	2	119.9873	0.848	323	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|N<2>,2|C<3>,2|H<1>}	H(C[6]C[6]N[6])	120.3022	0.875	40	119.9873	0.848	323	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){2|H<1>,3|C<3>}	H(C[6]C[6]N[6])	119.8940	1.070	189	119.9873	0.848	323	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]N[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<4>,1|N<2>,1|N<3>}	C[6](C[6]N[6]C)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	120.0838	0.052	5	119.9375	0.131	6	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]N[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<4>,2|N<3>}	C[6](C[6]N[6]C)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	119.2060	0.000	1	119.9375	0.131	6	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]N[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|Ca<10>,1|O<3>,2|N<3>}	C[6](C[6]N[6]H)(C[6]N[6]N)(H){1|Ca<10>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	120.0000	0.000	1	119.9254	2.678	71	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]N[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|Ca<8>,1|O<3>,2|N<3>}	C[6](C[6]N[6]H)(C[6]N[6]N)(H){1|Ca<8>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	119.6600	0.000	1	119.9254	2.678	71	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]N[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|N<2>,1|N<3>,1|O<1>}	C[6](C[6]N[6]H)(C[6]N[6]N)(H){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	123.0883	3.417	3	119.9254	2.678	71	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]N[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|N<2>,1|N<3>,1|O<2>}	C[6](C[6]N[6]H)(C[6]N[6]N)(H){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.6160	0.485	3	119.9254	2.678	71	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]N[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|N<2>,1|N<3>,1|S<1>}	C[6](C[6]N[6]H)(C[6]N[6]N)(H){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	124.0573	1.299	3	119.9254	2.678	71	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]N[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|N<2>,2|N<3>}	C[6](C[6]N[6]H)(C[6]N[6]N)(H){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	120.5564	1.559	7	119.9254	2.678	71	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]N[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|O<1>,2|N<3>}	C[6](C[6]N[6]H)(C[6]N[6]N)(H){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	119.4377	1.009	49	119.9254	2.678	71	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]N[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|O<1>,2|N<3>}	C[6](C[6]N[6]H)(C[6]N[6]N)(H){1|Co<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.3440	0.339	2	119.9254	2.678	71	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]N[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|O<1>,2|N<3>}	C[6](C[6]N[6]H)(C[6]N[6]N)(H){1|Zn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.8665	0.049	2	119.9254	2.678	71	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]N[6]H)(C[6]N[6]O)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|N<3>,1|O<1>,1|S<1>}	C[6](C[6]N[6]H)(C[6]N[6]O)(H){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	123.7542	3.330	4	122.0376	10.006	9	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]N[6]H)(C[6]N[6]O)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|N<3>,1|O<1>,1|S<2>}	C[6](C[6]N[6]H)(C[6]N[6]O)(H){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	119.4577	0.144	3	122.0376	10.006	9	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]N[6]H)(C[6]N[6]O)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|N<3>,1|O<1>,1|S<3>}	C[6](C[6]N[6]H)(C[6]N[6]O)(H){1|Cu<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.7710	0.000	1	122.0376	10.006	9	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]N[6]H)(C[6]N[6]O)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|O<1>,2|N<3>}	C[6](C[6]N[6]H)(C[6]N[6]O)(H){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	125.1770	0.000	1	122.0376	10.006	9	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]N[6]H)(C[6]N[6]S)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|N<3>,1|O<1>,1|S<1>}	C[6](C[6]N[6]H)(C[6]N[6]S)(H){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	125.1270	0.000	1	120.9348	6.395	5	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]N[6]H)(C[6]N[6]S)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|N<3>,2|S<1>}	C[6](C[6]N[6]H)(C[6]N[6]S)(H){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	119.8868	1.097	4	120.9348	6.395	5	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]N[6]H)2(H){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	120.3307	0.697	6	121.0550	4.978	85	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]N[6]H)2(H){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	121.3486	2.539	32	121.0550	4.978	85	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|H<1>,1|N<2>,1|S<1>}	C[6](C[6]N[6]H)2(H){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	124.8890	1.323	3	121.0550	4.978	85	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|H<1>,1|N<2>,1|S<2>}	C[6](C[6]N[6]H)2(H){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	120.3550	0.121	3	121.0550	4.978	85	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>}	C[6](C[6]N[6]H)2(H){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	119.6601	0.130	14	121.0550	4.978	85	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>}	C[6](C[6]N[6]H)2(H){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	120.1950	0.000	1	121.0550	4.978	85	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>}	C[6](C[6]N[6]H)2(H){1|Pt<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.1370	0.000	1	121.0550	4.978	85	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|H<1>,1|N<3>,1|S<1>}	C[6](C[6]N[6]H)2(H){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	121.8819	3.018	10	121.0550	4.978	85	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|H<1>,2|N<2>}	C[6](C[6]N[6]H)2(H){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	121.3713	1.664	12	121.0550	4.978	85	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|N<2>,2|H<1>}	C[6](C[6]N[6]H)2(H){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.6510	1.146	3	121.0550	4.978	85	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]N[6a]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6a]C[6])(C[6]N[6]H)(H){2|H<1>,3|C<3>}	H(C[6]C[6]N[6])	120.0892	0.422	10	120.0892	0.178	10	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]I)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]I)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|I<1>}	H(C[6]C[6]N[6])	119.1725	0.032	2	119.1725	0.001	2	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]I)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]I)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|I<3>}	H(C[6]C[6]N[6])	119.5740	0.091	2	119.6327	0.350	43	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]I)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]I)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|I<1>}	H(C[6]C[6]N[6])	119.4710	0.226	2	119.6327	0.350	43	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]I)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]I)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|I<2>}	H(C[6]C[6]N[6])	119.6265	0.631	37	119.6327	0.350	43	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]I)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]I)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|I<3>}	H(C[6]C[6]N[6])	119.9665	0.204	2	119.6327	0.350	43	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]I)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]I)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|I<1>}	H(C[6]C[6]N[6])	118.3882	0.146	4	118.4743	0.031	6	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]I)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]I)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|I<3>}	H(C[6]C[6]N[6])	118.6465	0.042	2	118.4743	0.031	6	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]N)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]N)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]N[6])	120.0660	0.064	2	120.0610	0.006	4	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]N)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]N)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]N[6])	120.0560	0.122	2	120.0610	0.006	4	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]N)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]N[6])	119.8560	0.000	1	120.4287	1.235	52	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]N)(H){1|C<3>,1|H<1>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]N[6])	119.4990	0.000	1	120.4287	1.235	52	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]N)(H){1|C<3>,1|H<1>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]N[6])	119.8960	0.000	1	120.4287	1.235	52	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|N<2>}	H(C[6]C[6]N[6])	124.0060	0.000	1	120.4287	1.235	52	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]N[6])	120.3965	1.017	48	120.4287	1.235	52	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]N)(H)	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]N[6])	120.0893	0.561	3	119.8766	0.309	5	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]N)(H)	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]N[6])	119.5575	0.518	2	119.8766	0.309	5	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	C[6](C[6]C[3,5]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[3,5]C[6])(C[6]N[6]H)(H){1|H<1>,1|O<1>,2|C<3>,2|C<4>}	H(C[6]C[6]N[6])	119.5815	0.269	2	119.5815	0.073	2	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|H<1>,2|C<3>}	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<1>,2|N<3>}	H(C[6]C[6]N[6])	125.0130	0.081	2	125.0130	0.006	2	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|H<1>,2|C<3>}	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|N<2>,1|O<1>,1|O<2>}	H(C[6]C[6]N[6])	119.6447	0.268	33	119.6689	0.065	42	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|H<1>,2|C<3>}	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<1>,2|N<2>}	H(C[6]C[6]N[6])	119.8173	0.134	7	119.6689	0.065	42	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|H<1>,2|C<3>}	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H){1|H<1>,1|N<3>,1|O<1>,2|C<3>}	H(C[6]C[6]N[6])	119.5490	0.243	2	119.6689	0.065	42	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|O<1>,2|H<1>,3|C<3>}	H(C[6]C[6]N[6])	119.8430	0.648	4	120.4551	3.509	219	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|H<1>,1|O<1>,3|C<3>}	H(C[6]C[6]N[6])	120.5022	1.975	177	120.4551	3.509	219	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|H<1>,1|O<2>,3|C<3>}	H(C[6]C[6]N[6])	120.2998	1.420	38	120.4551	3.509	219	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|C<2>,1|C<3>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]N[6])	121.8857	2.059	3	120.9618	4.473	160	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]N[6])	119.9389	1.190	47	120.9618	4.473	160	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]N[6])	120.0046	0.192	10	120.9618	4.473	160	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<3>}	H(C[6]C[6]N[6])	120.1305	0.364	2	120.9618	4.473	160	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]N[6])	122.6800	4.366	2	120.9618	4.473	160	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]N[6])	121.5918	2.380	91	120.9618	4.473	160	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<3>}	H(C[6]C[6]N[6])	120.2250	0.128	4	120.9618	4.473	160	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]O)(H){3|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]N[6])	119.6850	0.000	1	120.9618	4.473	160	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|Br<1>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|O<1>,1|O<2>}	H(C[6]C[6]N[6])	119.7770	0.000	1	120.1101	10.216	282	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]N[6])	119.7522	1.289	38	120.1101	10.216	282	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<3>}	H(C[6]C[6]N[6])	119.5110	0.000	1	120.1101	10.216	282	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|O<1>,1|O<2>}	H(C[6]C[6]N[6])	120.0070	0.000	1	120.1101	10.216	282	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|C<3>,1|H<1>,1|I<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]N[6])	119.4930	0.602	3	120.1101	10.216	282	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]N[6])	118.9660	0.000	1	120.1101	10.216	282	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]N[6])	119.4334	0.203	16	120.1101	10.216	282	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]N[6])	119.3554	0.331	8	120.1101	10.216	282	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|C<3>,1|H<1>,1|P<4>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]N[6])	119.8990	0.000	1	120.1101	10.216	282	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|C<3>,1|H<1>,1|S<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]N[6])	120.4450	0.000	1	120.1101	10.216	282	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|C<3>,1|H<1>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]N[6])	120.0884	1.619	21	120.1101	10.216	282	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|C<3>,1|H<1>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]N[6])	117.3727	11.853	15	120.1101	10.216	282	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Br<1>,1|C<3>,1|O<1>}	H(C[6]C[6]N[6])	122.8547	3.512	4	120.1101	10.216	282	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|O<1>}	H(C[6]C[6]N[6])	120.1814	0.213	8	120.1101	10.216	282	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|O<2>}	H(C[6]C[6]N[6])	120.4660	0.000	1	120.1101	10.216	282	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|O<3>}	H(C[6]C[6]N[6])	120.3110	0.153	2	120.1101	10.216	282	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]N[6])	120.7532	2.391	39	120.1101	10.216	282	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]N[6])	120.4223	1.442	42	120.1101	10.216	282	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<3>}	H(C[6]C[6]N[6])	120.0160	0.438	2	120.1101	10.216	282	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|N<3>,1|O<1>}	H(C[6]C[6]N[6])	120.3885	0.064	2	120.1101	10.216	282	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,2|O<2>}	H(C[6]C[6]N[6])	120.3510	0.000	1	120.1101	10.216	282	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|O<1>,2|C<3>}	H(C[6]C[6]N[6])	120.0305	0.126	4	120.1101	10.216	282	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|O<2>,2|C<3>}	H(C[6]C[6]N[6])	122.8460	3.236	2	120.1101	10.216	282	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|Cl<1>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|O<1>,1|O<2>}	H(C[6]C[6]N[6])	119.8220	0.000	1	120.1101	10.216	282	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|O<1>}	H(C[6]C[6]N[6])	119.3540	0.000	1	120.1101	10.216	282	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]N[6])	120.9997	2.423	23	120.1101	10.216	282	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]N[6])	119.7774	0.341	25	120.1101	10.216	282	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|N<3>,1|O<1>}	H(C[6]C[6]N[6])	125.1307	1.432	3	120.1101	10.216	282	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|O<1>}	H(C[6]C[6]N[6])	119.4945	0.272	11	120.1101	10.216	282	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<6>,1|C<3>,1|O<1>}	H(C[6]C[6]N[6])	119.8210	0.000	1	120.1101	10.216	282	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|Rh<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]N[6])	119.9140	0.132	2	120.1101	10.216	282	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|Se<2>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]N[6])	121.0200	0.000	1	120.1101	10.216	282	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]N[6])	123.2956	3.072	12	121.0412	5.861	86	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|O<1>}	H(C[6]C[6]N[6])	120.1433	0.481	30	121.0412	5.861	86	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]N[6])	121.7493	2.842	25	121.0412	5.861	86	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]N[6])	120.6562	2.494	12	121.0412	5.861	86	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|C<3>,1|I<1>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]N[6])	118.6570	0.000	2	121.0412	5.861	86	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|C<3>,2|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]N[6])	118.8300	0.000	1	121.0412	5.861	86	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|Cl<1>,1|C<3>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]N[6])	119.3730	0.000	1	121.0412	5.861	86	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]N[6])	119.5265	0.166	2	121.0412	5.861	86	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]N[6])	119.5230	0.000	1	121.0412	5.861	86	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]N[6])	121.0037	2.493	8	120.5069	4.510	12	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]N[6])	119.5132	0.237	4	120.5069	4.510	12	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|C<3>,1|H<1>,1|S<2>}	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]N[6])	119.4965	0.343	2	119.4965	0.118	2	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|H<1>,1|O<1>,3|C<3>}	H(C[6]C[6]N[6])	119.4648	0.411	53	119.4648	0.169	53	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]N[6]H)2(H){1|C<3>,1|O<1>}	H(C[6]C[6]N[6])	120.2380	0.000	1	120.2380	0.000	1	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]P)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]P)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|P<4>}	H(C[6]C[6]N[6])	119.4773	0.383	18	119.4773	0.146	18	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]P)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]P)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|P<3>}	H(C[6]C[6]N[6])	118.8812	0.527	12	118.8131	0.124	34	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]P)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]P)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|P<4>}	H(C[6]C[6]N[6])	118.7760	0.212	22	118.8131	0.124	34	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]S)(H)	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]S)(H){1|C<3>,1|C<4>,2|H<1>}	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|S<4>,3|C<4>}	H(C[6]C[6]N[6])	119.5635	0.088	2	119.5635	0.008	2	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]S)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]S)(H){1|C<3>,1|C<4>,1|N<2>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|S<4>}	H(C[6]C[6]N[6])	128.3170	0.000	1	128.3170	0.000	1	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]S)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]S)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	H(C[6]C[6]N[6])	119.0610	0.034	2	119.2652	0.070	4	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]S)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]S)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|S<4>}	H(C[6]C[6]N[6])	119.4695	0.203	2	119.2652	0.070	4	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]S)(H)	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]S)(H){1|C<3>,1|C<4>,1|H<1>,1|O<1>}	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|C<4>,1|S<4>,2|H<1>}	H(C[6]C[6]N[6])	123.6790	0.000	1	123.6790	0.000	1	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]S)(H)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]S)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|H<1>,1|S<2>,3|C<3>}	H(C[6]C[6]N[6])	119.7735	0.056	2	119.7735	0.003	2	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]U)(H)	C[6](C[6]C[6]Br)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]U)(H){1|Br<1>,2|C<3>}	C[6](C[6]C[6]Br)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|U<9>}	H(C[6]C[6]N[6])	118.0145	0.093	2	118.0145	0.009	2	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]U)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]U)(H){1|C<3>,1|H<1>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|U<13>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	118.9002	0.215	4	118.4580	0.651	14	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]U)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]U)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|U<11>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.8140	0.000	1	118.4580	0.651	14	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]U)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]U)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|U<8>}	H(C[6]C[6]N[6])	118.3310	0.401	8	118.4580	0.651	14	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]U)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]U)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|U<16>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	116.3490	0.000	1	118.4580	0.651	14	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]U)(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]U)(H){1|N<2>,2|H<1>}	C[6](C[6]N[6]H)2(H){1|U<16>,1|C<3>}	H(C[6]C[6]N[6])	119.0690	0.000	1	119.0690	0.000	1	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]V)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]V)(H){1|C<2>,1|C<3>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|V<11>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2770	0.074	2	118.2770	0.005	2	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]V)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]V)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|V<5>}	H(C[6]C[6]N[6])	120.8290	3.045	2	118.9052	0.883	83	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]V)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]V)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|V<6>}	H(C[6]C[6]N[6])	118.8574	0.269	14	118.9052	0.883	83	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]V)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]V)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|V<7>}	H(C[6]C[6]N[6])	118.8730	0.233	6	118.9052	0.883	83	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]V)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]V)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|V<5>}	H(C[6]C[6]N[6])	118.6928	0.249	9	118.9052	0.883	83	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]V)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]V)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|V<6>}	H(C[6]C[6]N[6])	118.4912	0.184	15	118.9052	0.883	83	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]V)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]V)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|V<11>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6610	0.401	4	118.9052	0.883	83	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]V)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]V)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|V<5>}	H(C[6]C[6]N[6])	120.1155	1.839	4	118.9052	0.883	83	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]V)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]V)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|V<6>}	H(C[6]C[6]N[6])	119.1056	1.251	21	118.9052	0.883	83	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]V)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]V)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|V<7>}	H(C[6]C[6]N[6])	118.5722	0.305	4	118.9052	0.883	83	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]V)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]V)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|V<8>}	H(C[6]C[6]N[6])	118.5040	0.291	4	118.9052	0.883	83	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]V)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]V)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|V<11>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.5660	0.264	2	117.5660	0.070	2	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]W)(H)	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]W)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|H<1>,1|W<6>,3|C<3>}	H(C[6]C[6]N[6])	118.3872	0.164	4	118.3872	0.027	4	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]W)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]W)(H){1|C<2>,1|C<3>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|W<6>}	H(C[6]C[6]N[6])	117.9865	0.240	6	118.3267	0.241	22	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]W)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]W)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|W<6>}	H(C[6]C[6]N[6])	119.1495	0.174	4	118.3267	0.241	22	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]W)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]W)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|W<6>}	H(C[6]C[6]N[6])	118.3985	0.176	4	118.3267	0.241	22	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]W)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]W)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|W<6>}	H(C[6]C[6]N[6])	118.1346	0.353	8	118.3267	0.241	22	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]W)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]W)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|W<6>}	H(C[6]C[6]N[6])	118.0260	0.000	1	118.7362	0.789	62	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]W)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]W)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<4>,1|H<1>,1|W<7>}	H(C[6]C[6]N[6])	119.4717	0.471	3	118.7362	0.789	62	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]W)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]W)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|W<9>}	H(C[6]C[6]N[6])	118.6560	0.000	1	118.7362	0.789	62	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]W)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]W)(H){1|C<3>,1|H<1>,1|P<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|W<6>}	H(C[6]C[6]N[6])	118.1890	0.052	2	118.7362	0.789	62	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]W)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]W)(H){1|C<3>,1|H<1>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<4>,1|H<1>,1|W<8>}	H(C[6]C[6]N[6])	119.4275	0.112	4	118.7362	0.789	62	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]W)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]W)(H){1|C<3>,1|H<1>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<4>,1|H<1>,1|W<9>}	H(C[6]C[6]N[6])	119.4025	0.210	2	118.7362	0.789	62	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]W)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]W)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|W<6>}	H(C[6]C[6]N[6])	118.8810	0.000	1	118.7362	0.789	62	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]W)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]W)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|W<6>}	H(C[6]C[6]N[6])	118.3694	0.382	19	118.7362	0.789	62	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]W)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]W)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|W<7>}	H(C[6]C[6]N[6])	119.8555	1.951	6	118.7362	0.789	62	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]W)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]W)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|W<8>}	H(C[6]C[6]N[6])	118.8082	0.074	6	118.7362	0.789	62	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]W)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]W)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|W<9>}	H(C[6]C[6]N[6])	117.0305	0.305	2	118.7362	0.789	62	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]W)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]W)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|W<6>}	H(C[6]C[6]N[6])	118.4681	0.367	11	118.7362	0.789	62	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]W)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]W)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|W<8>}	H(C[6]C[6]N[6])	118.6455	0.771	2	118.7362	0.789	62	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]W)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]W)(H){1|Se<2>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<4>,1|H<1>,1|W<9>}	H(C[6]C[6]N[6])	119.6350	0.112	2	118.7362	0.789	62	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]W)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]W)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|W<5>}	H(C[6]C[6]N[6])	117.9442	0.405	6	117.7994	0.141	14	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]W)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]W)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|W<9>}	H(C[6]C[6]N[6])	117.6909	0.338	8	117.7994	0.141	14	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]W)(H)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]W)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|H<1>,1|W<6>,3|C<3>}	H(C[6]C[6]N[6])	118.1050	0.000	1	118.1050	0.000	1	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]W)(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]W)(H){1|N<2>,2|H<1>}	C[6](C[6]N[6]H)2(H){1|C<3>,1|W<7>}	H(C[6]C[6]N[6])	118.8730	0.000	1	118.8730	0.000	1	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]Y)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]Y)(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Y<15>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	118.2200	0.000	1	118.2200	0.000	1	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]N[6]B)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]N[6]B)(H){1|B<3>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<3>,1|H<1>,1|N<3>}	H(C[6]C[6]N[6])	120.0490	0.000	1	120.0490	0.000	1	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]N[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]N[6]C)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|N<2>}	H(C[6]C[6]N[6])	132.4700	0.000	1	132.4700	0.000	1	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]N[6]H)(H){2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|N<2>,2|H<1>}	H(C[6]C[6]N[6])	120.3950	0.000	1	120.3950	0.000	1	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]N[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|N<2>,2|H<1>}	H(C[6]C[6]N[6])	120.0473	0.249	6	120.0473	0.062	6	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]N[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]N[6]O)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,1|N<3>,1|O<1>}	H(C[6]C[6]N[6])	119.2350	0.007	2	119.2350	0.000	2	120.0681	2.542	9320	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:I-1:	C[6]-3:	C[6](C[6]C[6]I)(N[6]C[6]C)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(I)	H(C[6]C[6]N[6])	C[6](C[6]C[6]I)(N[6]C[6]C)(H){1|C<2>,1|C<3>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(I){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	119.6282	0.229	11	119.6282	0.052	11	119.9312	0.222	77	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:I-1:	C[6]-3:	C[6](C[6]C[6]I)(N[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(I)	H(C[6]C[6]N[6])	C[6](C[6]C[6]I)(N[6]C[6]C)(H){1|Br<1>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(I){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	118.3560	0.000	1	119.9148	0.203	42	119.9312	0.222	77	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:I-1:	C[6]-3:	C[6](C[6]C[6]I)(N[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(I)	H(C[6]C[6]N[6])	C[6](C[6]C[6]I)(N[6]C[6]C)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(I){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	119.4050	0.000	1	119.9148	0.203	42	119.9312	0.222	77	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:I-1:	C[6]-3:	C[6](C[6]C[6]I)(N[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(I)	H(C[6]C[6]N[6])	C[6](C[6]C[6]I)(N[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(I){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	119.9400	0.335	24	119.9148	0.203	42	119.9312	0.222	77	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:I-1:	C[6]-3:	C[6](C[6]C[6]I)(N[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(I)	H(C[6]C[6]N[6])	C[6](C[6]C[6]I)(N[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(I){1|C<3>,1|C<4>,1|I<1>}	H(C[6]C[6]N[6])	120.0062	0.441	16	119.9148	0.203	42	119.9312	0.222	77	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:I-1:	C[6]-3:	C[6](C[6]C[6]I)(N[6]C[6]C)(H)	C[6](C[6]C[6]O)(C[6]N[6]H)(I)	H(C[6]C[6]N[6])	C[6](C[6]C[6]I)(N[6]C[6]C)(H){1|H<1>,1|O<1>,2|C<4>}	C[6](C[6]C[6]O)(C[6]N[6]H)(I){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6]N[6])	118.6495	0.107	2	118.6495	0.011	2	119.9312	0.222	77	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:I-1:	C[6]-3:	C[6](C[6]C[6]I)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(I)	H(C[6]C[6]N[6])	C[6](C[6]C[6]I)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(I){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	120.1992	0.306	5	120.2307	0.080	22	119.9312	0.222	77	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:I-1:	C[6]-3:	C[6](C[6]C[6]I)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(I)	H(C[6]C[6]N[6])	C[6](C[6]C[6]I)(N[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(I){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	120.2399	0.285	17	120.2307	0.080	22	119.9312	0.222	77	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:N-1:	C[6]-3:	C[6](C[6]C[6]N)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(N)	H(C[6]C[6]N[6])	C[6](C[6]C[6]N)(N[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(N){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	119.6210	0.302	4	119.6210	0.091	4	119.6210	0.091	4	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6]B)(H)	C[6](C[6]N[6]H)(N[6]C[6]B)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6]B)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6]B)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	120.8245	0.226	2	120.8245	0.051	2	120.1748	3.613	98	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6]C)(H)	C[6](C[6]N[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	120.1505	0.250	4	119.5250	0.484	23	120.1748	3.613	98	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6]C)(H)	C[6](C[6]N[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6]C)(H){1|C<3>,1|C<4>,1|O<1>}	C[6](C[6]N[6]H)(N[6]C[6]C)(H){1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6]N[6])	119.2265	0.260	2	119.5250	0.484	23	120.1748	3.613	98	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6]C)(H)	C[6](C[6]N[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6]C)(H){1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]N[6]H)(N[6]C[6]C)(H){1|C<3>,1|C<4>,1|O<1>}	H(C[6]C[6]N[6])	120.2275	0.216	2	119.5250	0.484	23	120.1748	3.613	98	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6]C)(H)	C[6](C[6]N[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6]C)(H){1|C<4>,2|C<3>}	C[6](C[6]N[6]H)(N[6]C[6]C)(H){1|C<4>,2|C<3>}	H(C[6]C[6]N[6])	120.4002	0.150	4	119.5250	0.484	23	120.1748	3.613	98	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6]C)(H)	C[6](C[6]N[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]N[6]H)(N[6]C[6]C)(H){1|H<1>,2|C<3>}	H(C[6]C[6]N[6])	118.9059	0.165	11	119.5250	0.484	23	120.1748	3.613	98	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6]C)(H)	C[6](C[6]N[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6]H)(H){1|C<3>,2|C<4>}	H(C[6]C[6]N[6])	120.1090	0.000	1	120.3487	0.070	3	120.1748	3.613	98	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6]C)(H)	C[6](C[6]N[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6]C)(H){1|C<3>,1|C<4>,2|H<1>}	C[6](C[6]N[6]H)(N[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<1>}	H(C[6]C[6]N[6])	120.6340	0.000	1	120.3487	0.070	3	120.1748	3.613	98	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6]C)(H)	C[6](C[6]N[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]N[6]H)(N[6]C[6]H)(H){1|C<3>,2|C<4>}	H(C[6]C[6]N[6])	120.3030	0.000	1	120.3487	0.070	3	120.1748	3.613	98	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<1>}	C[6](C[6]N[6]H)(N[6]C[6]C)(H){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6]N[6])	119.2710	0.000	1	120.2380	0.744	3	120.1748	3.613	98	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6]H)(H){1|C<3>,2|C<4>}	C[6](C[6]N[6]H)(N[6]C[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	120.9270	0.000	1	120.2380	0.744	3	120.1748	3.613	98	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6]H)(H){1|C<3>,2|C<4>}	C[6](C[6]N[6]H)(N[6]C[6]C)(H){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	120.5160	0.000	1	120.2380	0.744	3	120.1748	3.613	98	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	C[6](C[6]N[6]H)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	H(C[6]C[6]N[6])	120.4620	0.000	1	120.8001	12.527	15	120.1748	3.613	98	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]N[6]H)(N[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	121.7581	3.950	10	120.8001	12.527	15	120.1748	3.613	98	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]N[6]H)(N[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]N[6])	118.9255	0.513	2	120.8001	12.527	15	120.1748	3.613	98	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]N[6]H)(N[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	118.0535	1.817	2	120.8001	12.527	15	120.1748	3.613	98	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6]O)(H)	C[6](C[6]N[6]H)(N[6]C[6]O)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6]O)(H){1|C<3>,1|C<4>,1|O<1>}	C[6](C[6]N[6]H)(N[6]C[6]O)(H){1|C<3>,1|C<4>,1|O<2>}	H(C[6]C[6]N[6])	120.0770	0.000	1	120.2432	2.863	52	120.1748	3.613	98	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6]O)(H)	C[6](C[6]N[6]H)(N[6]C[6]O)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6]O)(H){1|C<3>,1|C<4>,1|O<1>}	C[6](C[6]N[6]H)(N[6]C[6]O)(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]N[6])	119.4083	0.156	4	120.2432	2.863	52	120.1748	3.613	98	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6]O)(H)	C[6](C[6]N[6]H)(N[6]C[6]O)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6]O)(H){1|C<3>,1|C<4>,1|O<2>}	C[6](C[6]N[6]H)(N[6]C[6]O)(H){1|C<3>,1|C<4>,1|O<1>}	H(C[6]C[6]N[6])	119.8500	0.000	1	120.2432	2.863	52	120.1748	3.613	98	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6]O)(H)	C[6](C[6]N[6]H)(N[6]C[6]O)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6]O)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]N[6]H)(N[6]C[6]O)(H){1|C<3>,1|C<4>,1|O<1>}	H(C[6]C[6]N[6])	120.2325	0.404	4	120.2432	2.863	52	120.1748	3.613	98	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6]O)(H)	C[6](C[6]N[6]H)(N[6]C[6]O)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6]O)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]N[6]H)(N[6]C[6]O)(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]N[6])	120.3370	1.862	42	120.2432	2.863	52	120.1748	3.613	98	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	N[4,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[4,6]H)(N[6]C[6]C)(H)	C[6](N[4,6]C[4,6]C[4])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[4,6]H)(N[6]C[6]C)(H){1|C<3>,1|C<4>,1|O<1>}	C[6](N[4,6]C[4,6]C[4])(C[6]N[6]H)(H){1|C<4>,1|O<1>,3|C<3>}	H(C[6]C[6]N[6])	118.8040	0.000	1	118.8040	0.000	1	118.8040	0.000	1	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(N[6]C[6]C)(H)	C[6](N[5,6]C[5,6]C[5])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[5,6]H)(N[6]C[6]C)(H){1|C<3>,1|C<4>,1|O<1>}	C[6](N[5,6]C[5,6]C[5])(C[6]N[6]H)(H){1|C<4>,1|O<1>,4|C<3>}	H(C[6]C[6]N[6])	119.5110	0.000	1	119.5110	0.000	1	119.5110	0.000	1	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	N[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5a,6]H)(N[6]C[6]H)(H)	C[6](N[5a,6]C[5a,6]C[5a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[5a,6]H)(N[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](N[5a,6]C[5a,6]C[5a])(C[6]N[6]H)(H){1|H<1>,1|N<2>,1|O<2>,2|C<3>}	H(C[6]C[6]N[6])	122.4700	0.000	1	122.4700	0.000	1	122.4700	0.000	1	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6]B)(H)	C[6](N[6]B[5]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6]B)(H){1|B<3>,2|C<3>}	C[6](N[6]B[5]C[6])(C[6]N[6]H)(H){1|B<3>,1|C<3>,1|H<1>,2|O<2>}	H(C[6]C[6]N[6])	119.2770	0.000	1	119.2770	0.000	1	119.7152	0.183	5	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6]C)(H)	C[6](N[6]B[5,6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6]C)(H){1|C<4>,2|B<4>}	C[6](N[6]B[5,6]C)(C[6]N[6]H)(H){1|C<3>,1|C<4>,2|O<2>}	H(C[6]C[6]N[6])	119.5140	0.318	2	119.5140	0.101	2	119.7152	0.183	5	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6]H)(H)	C[6](N[6]C[6]Fe)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6]H)(H){1|Fe<6>,1|C<3>,1|N<3>}	C[6](N[6]C[6]Fe)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	120.1740	0.000	1	120.1740	0.000	1	119.7152	0.183	5	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:N[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]H)(N[6]C[6]O)(H)	C[6](N[6]C[6]Ni)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]N[6]H)(N[6]C[6]O)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]N[6]H)(H){1|O<1>,2|C<3>}	H(C[6]C[6]N[6])	120.0970	0.000	1	120.0970	0.000	1	119.7152	0.183	5	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	C[6]-3:O[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(O[6]C[6]P)(H)	C[6](C[6]C[6]H)(C[6]O[6]H)(H)	H(C[6]C[6]O[6])	C[6](C[6]C[6]H)(O[6]C[6]P)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]O[6]H)(H){1|C<3>,1|H<1>,1|P<4>}	H(C[6]C[6]O[6])	120.3150	0.525	2	120.3150	0.275	2	120.3150	0.275	2	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	Ge[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](Ge[6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]Ge[6]H)(C[6]C[6]H)(H)	H(C[6]Ge[6]C[6])	C[6](Ge[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]Ge[6]H)(C[6]C[6]H)(H){1|Ru<8>,1|C<3>,1|H<1>}	H(C[6]Ge[6]C[6])	118.0020	0.000	1	118.0020	0.000	1	118.0300	3.545	4	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	Ge[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](Ge[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]Ge[6]H)(C[6]C[6]H)(H)	H(C[6]Ge[6]C[6])	C[6](Ge[6]C[6a]C[6])(C[6]C[6]H)(H){2|H<1>,3|C<3>}	C[6](C[6]Ge[6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]Ge[6]C[6])	119.3700	0.092	2	119.3700	0.008	2	118.0300	3.545	4	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	Ge[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](Ge[6]C[6a]Ge[6])(C[6]C[6]H)(H)	C[6](C[6]Ge[6]H)(C[6]C[6]H)(H)	H(C[6]Ge[6]C[6])	C[6](Ge[6]C[6a]Ge[6])(C[6]C[6]H)(H){1|H<1>,4|C<3>}	C[6](C[6]Ge[6]H)(C[6]C[6]H)(H){1|Ge<3>,1|C<3>,1|H<1>}	H(C[6]Ge[6]C[6])	115.3780	0.000	1	115.3780	0.000	1	118.0300	3.545	4	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[3x6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[3x6]As[3x6]C[3x6])(C[6]C[6]H)(H)	C[6](C[6]N[3x6]H)(C[6]C[6]H)(H)	H(C[6]N[3x6]C[6])	C[6](N[3x6]As[3x6]C[3x6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<3>,2|N<3>}	C[6](C[6]N[3x6]H)(C[6]C[6]H)(H){1|As<3>,1|C<3>,1|H<1>}	H(C[6]N[3x6]C[6])	119.9230	0.144	3	119.9230	0.021	3	118.8317	0.758	9	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[3x6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[3x6]Nb[3,3,3x6]C[3x6])(C[6]C[6]H)(H)	C[6](C[6]N[3x6]H)(C[6]C[6]H)(H)	H(C[6]N[3x6]C[6])	C[6](N[3x6]Nb[3,3,3x6]C[3x6])(C[6]C[6]H)(H){1|Cl<1>,1|C<3>,1|H<1>,1|N<2>,2|C<4>,3|N<3>}	C[6](C[6]N[3x6]H)(C[6]C[6]H)(H){1|Nb<7>,1|C<3>,1|H<1>}	H(C[6]N[3x6]C[6])	118.0760	0.211	4	118.0760	0.044	4	118.8317	0.758	9	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[3x6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[3x6]Nb[3x6]C[3x6])(C[6]C[6]H)(H)	C[6](C[6]N[3x6]H)(C[6]C[6]H)(H)	H(C[6]N[3x6]C[6])	C[6](N[3x6]Nb[3x6]C[3x6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|N<2>,1|O<2>,2|N<3>}	C[6](C[6]N[3x6]H)(C[6]C[6]H)(H){1|Nb<5>,1|C<3>,1|H<1>}	H(C[6]N[3x6]C[6])	118.6920	0.000	1	118.7060	0.000	2	118.8317	0.758	9	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[3x6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[3x6]Nb[3x6]C[3x6])(C[6]C[6]H)(H)	C[6](C[6]N[3x6]H)(C[6]C[6]H)(H)	H(C[6]N[3x6]C[6])	C[6](N[3x6]Nb[3x6]C[3x6])(C[6]C[6]H)(H){1|Cl<1>,1|C<3>,1|C<4>,1|H<1>,1|N<2>,3|N<3>}	C[6](C[6]N[3x6]H)(C[6]C[6]H)(H){1|Nb<6>,1|C<3>,1|H<1>}	H(C[6]N[3x6]C[6])	118.7200	0.000	1	118.7060	0.000	2	118.8317	0.758	9	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[4,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[4,6]C[4,6]Si[4])(C[6]C[6]H)(H)	C[6](C[6]N[4,6]H)(C[6]C[6]H)(H)	H(C[6]N[4,6]C[6])	C[6](N[4,6]C[4,6]Si[4])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,1|S<2>,2|C<3>}	C[6](C[6]N[4,6]H)(C[6]C[6]H)(H){1|Si<5>,1|C<3>,1|H<1>}	H(C[6]N[4,6]C[6])	119.9880	0.074	3	119.9880	0.006	3	119.8661	0.086	7	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[4,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[4,6]C[4,6]Si[4])(C[6]C[6]H)(H)	C[6](C[6]N[4,6]H)(C[6]C[6]N)(H)	H(C[6]N[4,6]C[6])	C[6](N[4,6]C[4,6]Si[4])(C[6]C[6]H)(H){1|Si<3>,1|Si<4>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[4,6]H)(C[6]C[6]N)(H){1|Si<4>,1|C<3>,1|H<1>}	H(C[6]N[4,6]C[6])	119.2340	0.000	1	119.2340	0.000	1	119.8661	0.086	7	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[4,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[4,6]Si[4,4]C[4,6])(C[6]C[6]H)(H)	C[6](C[6]N[4,6]H)(C[6]C[6]H)(H)	H(C[6]N[4,6]C[6])	C[6](N[4,6]Si[4,4]C[4,6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>,2|S<2>}	C[6](C[6]N[4,6]H)(C[6]C[6]H)(H){1|Si<5>,1|C<3>,1|H<1>}	H(C[6]N[4,6]C[6])	120.0480	0.000	1	119.9550	0.018	3	119.8661	0.086	7	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[4,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[4,6]Si[4,4]C[4,6])(C[6]C[6]H)(H)	C[6](C[6]N[4,6]H)(C[6]C[6]H)(H)	H(C[6]N[4,6]C[6])	C[6](N[4,6]Si[4,4]C[4,6])(C[6]C[6]H)(H){2|Cl<1>,1|C<3>,1|H<1>,1|N<3>,2|S<2>}	C[6](C[6]N[4,6]H)(C[6]C[6]H)(H){1|Si<6>,1|C<3>,1|H<1>}	H(C[6]N[4,6]C[6])	119.9085	0.153	2	119.9550	0.018	3	119.8661	0.086	7	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[4,6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](N[4,6]C[4,6]C[4])(C[6]N[6]H)(H)	C[6](C[6]N[4,6]H)(N[6]C[6]C)(H)	H(C[6]N[4,6]C[6])	C[6](N[4,6]C[4,6]C[4])(C[6]N[6]H)(H){1|C<4>,1|O<1>,3|C<3>}	C[6](C[6]N[4,6]H)(N[6]C[6]C)(H){1|C<3>,1|C<4>,1|O<1>}	H(C[6]N[4,6]C[6])	121.5030	0.000	1	121.5030	0.000	1	121.5030	0.000	1	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[4,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,6]Si[5])(C[6]C[4,6]H)(H)	C[6](C[4,6]C[4,6]Si[4])(C[6]N[5,6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]Si[5])(C[6]C[4,6]H)(H){1|Si<4>,1|N<3>,2|C<3>,2|C<4>}	C[6](C[4,6]C[4,6]Si[4])(C[6]N[5,6]H)(H){2|Si<4>,1|C<3>,2|C<4>}	H(C[6]N[5,6]C[6])	117.6910	0.000	1	117.6910	0.000	1	117.6910	0.000	1	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[5,6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]C[6,6a]H)(H){1|C<2>,1|O<1>,2|C<3>,2|C<4>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[5,6]H)(H){1|C<4>,1|H<1>,3|C<3>}	H(C[6]N[5,6]C[6])	120.1710	0.000	1	120.7621	3.803	8	121.1454	4.650	9	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[5,6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]C[6,6a]H)(H){1|C<4>,1|H<1>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[5,6]H)(H){1|C<4>,1|H<1>,3|C<3>}	H(C[6]N[5,6]C[6])	123.0325	0.216	2	120.7621	3.803	8	121.1454	4.650	9	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[5,6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]C[6,6a]H)(H){1|H<1>,2|C<2>,2|C<3>,2|C<4>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[5,6]H)(H){1|H<1>,2|C<3>,2|C<4>}	H(C[6]N[5,6]C[6])	120.4280	0.260	2	120.7621	3.803	8	121.1454	4.650	9	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[5,6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]C[6,6a]H)(H){2|C<4>,2|H<1>,3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[5,6]H)(H){1|H<1>,2|C<3>,2|C<4>}	H(C[6]N[5,6]C[6])	119.6683	2.453	3	120.7621	3.803	8	121.1454	4.650	9	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,6]N[5])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[5,6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]N[5])(C[6]C[6,6a]H)(H){1|H<1>,2|N<3>,3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[5,6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]N[5,6]C[6])	124.2120	0.000	1	124.2120	0.000	1	121.1454	4.650	9	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]Cl)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(Cl)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]Cl)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(Cl){1|Cl<1>,2|C<3>}	H(C[6]N[5,6]C[6])	121.4700	0.000	1	121.4700	0.000	1	121.4700	0.000	1	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:F-1:	C[6]-3:	C[6](N[5,6]B[5,6,6]C[5,6])(C[6]C[6]F)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(F)	H(C[6]N[5,6]C[6])	C[6](N[5,6]B[5,6,6]C[5,6])(C[6]C[6]F)(H){1|C<3>,1|H<1>,1|N<3>,3|C<4>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(F){1|B<4>,1|C<3>,1|H<1>}	H(C[6]N[5,6]C[6])	119.4590	0.000	1	119.4590	0.000	1	119.4590	0.000	1	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]B[4,5]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]B[4,5]C[5,6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<2>,3|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]N[5,6]C[6])	118.7670	0.000	1	118.7670	0.000	1	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]B[4x3,4x5,12x6]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]B[4x3,4x5,12x6]C[5,6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|C<5>,1|H<1>,1|H<2>,3|B<6>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|B<6>,1|C<3>,1|H<1>}	H(C[6]N[5,6]C[6])	120.2060	0.000	1	120.2060	0.000	1	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]B[5,5]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]B[5,5]C[5,6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,3|O<2>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]N[5,6]C[6])	119.5920	0.104	4	119.4717	0.061	6	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]B[5,5]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]B[5,5]C[5,6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,2|C<4>,2|O<2>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]N[5,6]C[6])	119.4510	0.000	1	119.4717	0.061	6	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]B[5,5]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]B[5,5]C[5,6])(C[6]C[6]H)(H){1|H<1>,5|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]N[5,6]C[6])	119.0110	0.000	1	119.4717	0.061	6	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]B[5,6,6]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]B[5,6,6]C[5,6])(C[6]C[6]H)(H){1|H<1>,2|C<4>,3|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]N[5,6]C[6])	118.7870	0.119	5	118.7870	0.014	5	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]B[5,6a]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]B[5,6a]C[5,6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<2>,3|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]N[5,6]C[6])	119.9910	0.000	1	119.7017	0.064	3	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]B[5,6a]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]B[5,6a]C[5,6])(C[6]C[6]H)(H){1|H<1>,5|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]N[5,6]C[6])	119.5570	0.040	2	119.7017	0.064	3	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]B[5x3,6x5,20x6]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]B[5x3,6x5,20x6]C[5,6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|C<6>,1|H<1>,4|B<6>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|B<6>,1|C<3>,1|H<1>}	H(C[6]N[5,6]C[6])	119.9820	0.000	1	119.9820	0.000	1	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]N[5,6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,5,6]C[5])(C[6]C[6]H)(H){1|H<1>,2|C<4>,3|C<3>}	C[6](C[6]C[5,6]H)(C[6]N[5,6]H)(H){1|C<4>,2|C<3>}	H(C[6]N[5,6]C[6])	119.5290	0.000	1	119.5290	0.000	1	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,5]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,5]C[5,6])(C[6]C[6]H)(H){1|Se<2>,1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]N[5,6]C[6])	119.6300	0.000	1	119.6300	0.000	1	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,6,6]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]O)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6,6]C[5,6])(C[6]C[6]H)(H){1|C<3>,2|O<2>,3|C<4>}	C[6](C[6]N[5,6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]N[5,6]C[6])	124.7750	0.000	1	124.7750	0.000	1	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,6,6a]Ga[3x5])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6,6a]Ga[3x5])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>,3|O<2>}	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H){1|Ga<6>,2|C<3>}	H(C[6]N[5,6]C[6])	118.7170	0.161	3	118.7170	0.026	3	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,6,6a]Ga[5,5])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6,6a]Ga[5,5])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>,2|O<2>}	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H){1|Ga<5>,2|C<3>}	H(C[6]N[5,6]C[6])	118.6720	0.000	1	118.7590	0.009	3	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,6,6a]Ga[5,5])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6,6a]Ga[5,5])(C[6]C[6]H)(H){2|Cl<1>,1|H<1>,2|C<3>,3|N<3>}	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H){1|Ga<6>,2|C<3>}	H(C[6]N[5,6]C[6])	118.8025	0.083	2	118.7590	0.009	3	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,6,6a]Ga[5,6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6,6a]Ga[5,6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<3>,2|C<3>,3|O<2>}	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H){1|Ga<6>,2|C<3>}	H(C[6]N[5,6]C[6])	119.5645	0.233	4	119.5645	0.054	4	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,6,6a]Ga[5])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6,6a]Ga[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<3>,2|C<3>,3|F<1>}	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H){1|Ga<6>,2|C<3>}	H(C[6]N[5,6]C[6])	119.1970	0.000	1	119.3565	0.051	2	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,6,6a]Ga[5])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6,6a]Ga[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>,2|O<2>}	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H){1|Ga<4>,2|C<3>}	H(C[6]N[5,6]C[6])	119.5160	0.000	1	119.3565	0.051	2	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,6,6a]Ge[3x5])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6,6a]Ge[3x5])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>,3|O<2>}	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H){1|Ge<6>,2|C<3>}	H(C[6]N[5,6]C[6])	119.2565	0.357	2	119.2565	0.128	2	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,6,6a]Ge[5])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6,6a]Ge[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H){1|Ge<2>,2|C<3>}	H(C[6]N[5,6]C[6])	119.2260	0.000	1	119.2260	0.000	1	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,6,6a]In[3x5])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6,6a]In[3x5])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>,3|O<2>}	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H){1|In<6>,2|C<3>}	H(C[6]N[5,6]C[6])	118.8795	0.271	6	118.8795	0.074	6	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,6,6a]In[4,5,6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6,6a]In[4,5,6])(C[6]C[6]H)(H){1|Cl<1>,1|Se<3>,2|Se<2>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H){1|In<6>,2|C<3>}	H(C[6]N[5,6]C[6])	118.0310	0.000	1	118.0310	0.000	1	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,6,6a]In[5,5])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6,6a]In[5,5])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|I<1>,3|N<3>}	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H){1|In<6>,2|C<3>}	H(C[6]N[5,6]C[6])	118.8547	0.084	3	118.8547	0.007	3	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,6,6a]In[5,6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6,6a]In[5,6])(C[6]C[6]H)(H){1|Cl<1>,2|Se<2>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H){1|In<5>,2|C<3>}	H(C[6]N[5,6]C[6])	118.9955	0.954	2	118.9955	0.910	2	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,6,6a]In[5])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6,6a]In[5])(C[6]C[6]H)(H){1|Cl<1>,1|H<1>,1|N<3>,2|C<3>,3|O<2>}	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H){1|In<6>,2|C<3>}	H(C[6]N[5,6]C[6])	118.5870	0.000	1	118.6406	0.762	5	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,6,6a]In[5])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6,6a]In[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<3>,2|C<3>,3|O<2>}	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H){1|In<6>,2|C<3>}	H(C[6]N[5,6]C[6])	118.6540	1.007	4	118.6406	0.762	5	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,6,6a]Nb[3x5])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6,6a]Nb[3x5])(C[6]C[6]H)(H){1|H<1>,1|O<1>,2|C<3>,2|N<3>,3|O<2>}	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H){1|Nb<7>,2|C<3>}	H(C[6]N[5,6]C[6])	118.8810	0.332	2	118.8810	0.110	2	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,6,6a]Si[3x5])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6,6a]Si[3x5])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|O<2>,3|N<3>}	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H){1|Si<6>,2|C<3>}	H(C[6]N[5,6]C[6])	118.9515	0.045	2	118.9515	0.002	2	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,6,6a]Si[4,5,5])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6,6a]Si[4,5,5])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>,3|O<2>}	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H){1|Si<6>,2|C<3>}	H(C[6]N[5,6]C[6])	119.3580	0.000	1	119.3580	0.000	1	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,6,6a]Si[4,5])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6,6a]Si[4,5])(C[6]C[6]H)(H){1|H<1>,1|O<2>,2|C<3>,2|N<2>,2|N<3>}	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H){1|Si<6>,2|C<3>}	H(C[6]N[5,6]C[6])	119.1473	0.117	3	119.1706	0.009	5	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,6,6a]Si[4,5])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6,6a]Si[4,5])(C[6]C[6]H)(H){2|Br<1>,1|H<1>,1|O<2>,2|C<3>,2|N<3>}	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H){1|Si<6>,2|C<3>}	H(C[6]N[5,6]C[6])	119.1660	0.000	1	119.1706	0.009	5	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,6,6a]Si[4,5])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6,6a]Si[4,5])(C[6]C[6]H)(H){2|Cl<1>,1|H<1>,1|O<2>,2|C<3>,2|N<3>}	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H){1|Si<6>,2|C<3>}	H(C[6]N[5,6]C[6])	119.2450	0.000	1	119.1706	0.009	5	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,6,6a]Si[5])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6,6a]Si[5])(C[6]C[6]H)(H){1|C<2>,1|H<1>,1|N<3>,2|C<3>,3|F<1>}	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H){1|Si<6>,2|C<3>}	H(C[6]N[5,6]C[6])	118.9600	0.201	2	119.2581	0.095	10	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,6,6a]Si[5])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6,6a]Si[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>,4|N<2>}	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H){1|Si<6>,2|C<3>}	H(C[6]N[5,6]C[6])	119.0750	0.103	2	119.2581	0.095	10	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,6,6a]Si[5])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6,6a]Si[5])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<2>,3|N<3>}	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H){1|Si<6>,2|C<3>}	H(C[6]N[5,6]C[6])	119.4893	0.395	3	119.2581	0.095	10	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,6,6a]Si[5])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6,6a]Si[5])(C[6]C[6]H)(H){4|Cl<1>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H){1|Si<6>,2|C<3>}	H(C[6]N[5,6]C[6])	119.3477	0.171	3	119.2581	0.095	10	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,6]2)(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]2)(C[6]C[6]H)(H){1|C<2>,1|C<4>,1|H<1>,1|N<2>,2|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]N[5,6]C[6])	120.3790	0.000	1	120.5910	0.016	5	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,6]2)(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]2)(C[6]C[6]H)(H){1|C<3>,2|H<1>,3|C<4>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]N[5,6]C[6])	120.7240	0.000	1	120.5910	0.016	5	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,6]2)(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]2)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|P<2>,2|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]N[5,6]C[6])	120.6090	0.000	2	120.5910	0.016	5	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,6]2)(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]2)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|P<6>,2|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]N[5,6]C[6])	120.6340	0.000	1	120.5910	0.016	5	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,6]B[5])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]B[5])(C[6]C[6]H)(H){1|C<4>,1|H<1>,4|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]N[5,6]C[6])	119.2980	0.000	1	119.3098	0.057	11	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,6]B[5])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]B[5])(C[6]C[6]H)(H){1|Cl<1>,1|H<1>,4|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]N[5,6]C[6])	119.5610	0.000	1	119.3098	0.057	11	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,6]B[5])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]B[5])(C[6]C[6]H)(H){1|H<1>,4|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|B<3>,1|C<3>,1|H<1>}	H(C[6]N[5,6]C[6])	119.3100	0.000	1	119.3098	0.057	11	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,6]B[5])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]B[5])(C[6]C[6]H)(H){1|H<1>,5|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]N[5,6]C[6])	119.2799	0.268	8	119.3098	0.057	11	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<2>,1|N<3>,2|H<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Cl<1>,1|C<3>,1|C<4>}	H(C[6]N[5,6]C[6])	120.3500	0.000	1	120.5141	1.984	64	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>,1|P<2>,1|P<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]N[5,6]C[6])	119.7010	0.182	3	120.5141	1.984	64	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>,2|P<2>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]N[5,6]C[6])	119.6430	0.000	1	120.5141	1.984	64	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|C<3>,2|H<1>,3|C<4>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]N[5,6]C[6])	120.7920	0.000	1	120.5141	1.984	64	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<2>,3|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]N[5,6]C[6])	120.4310	0.000	1	120.5141	1.984	64	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]N[5,6]C[6])	120.4650	0.288	2	120.5141	1.984	64	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|C<4>,1|H<1>,3|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]N[5,6]C[6])	120.7040	0.000	1	120.5141	1.984	64	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|C<4>,1|H<1>,4|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]N[5,6]C[6])	121.3430	0.000	1	120.5141	1.984	64	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]N[5,6]C[6])	125.9405	7.176	2	120.5141	1.984	64	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]N[5,6]C[6])	120.6990	0.000	1	120.5141	1.984	64	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|C<4>,2|H<1>,3|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]N[5,6]C[6])	120.1050	0.000	1	120.5141	1.984	64	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]N[5,6]C[6])	120.1010	0.000	1	120.5141	1.984	64	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>,2|C<4>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]N[5,6]C[6])	120.5290	0.000	1	120.5141	1.984	64	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]N[5,6]C[6])	120.5201	0.384	26	120.5141	1.984	64	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,4|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]N[5,6]C[6])	120.2023	0.262	3	120.5141	1.984	64	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,5|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]N[5,6]C[6])	120.0150	0.000	1	120.5141	1.984	64	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]N[5,6]C[6])	120.2946	0.533	5	120.5141	1.984	64	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|N<3>,2|C<3>,3|H<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]N[5,6]C[6])	120.6120	0.000	1	120.5141	1.984	64	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|Os<6>,1|C<4>,1|H<1>,2|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]N[5,6]C[6])	120.1015	0.025	2	120.5141	1.984	64	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|Os<6>,1|H<1>,2|C<3>,2|C<4>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]N[5,6]C[6])	119.8410	0.000	1	120.5141	1.984	64	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|Si<4>,1|C<3>,1|N<3>,1|O<2>,2|H<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]N[5,6]C[6])	120.0350	0.000	1	120.5141	1.984	64	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|Si<5>,1|C<3>,1|O<2>,3|H<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]N[5,6]C[6])	119.9433	0.197	3	120.5141	1.984	64	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){2|C<3>,2|C<4>,3|H<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Br<1>,2|C<4>}	H(C[6]N[5,6]C[6])	119.3850	0.017	2	120.5141	1.984	64	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){2|H<1>,3|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]N[5,6]C[6])	120.6920	0.182	2	120.5141	1.984	64	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]N[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,1|O<2>,2|C<3>}	C[6](C[6]N[5,6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>}	H(C[6]N[5,6]C[6])	121.1340	0.000	1	121.1340	0.000	1	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,6]Ga[5])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]Ga[5])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|N<3>,2|I<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ga<4>,1|C<3>,1|H<1>}	H(C[6]N[5,6]C[6])	119.3280	0.354	2	119.0587	0.130	11	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,6]Ga[5])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]Ga[5])(C[6]C[6]H)(H){1|Fe<11>,1|Si<4>,1|C<3>,1|H<1>,3|C<4>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ga<5>,1|C<3>,1|H<1>}	H(C[6]N[5,6]C[6])	118.7305	0.086	2	119.0587	0.130	11	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,6]Ga[5])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]Ga[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<3>,2|C<3>,3|F<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ga<6>,1|C<3>,1|H<1>}	H(C[6]N[5,6]C[6])	119.0210	0.464	2	119.0587	0.130	11	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,6]Ga[5])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]Ga[5])(C[6]C[6]H)(H){1|Si<4>,1|C<3>,1|H<1>,3|C<4>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ga<4>,1|C<3>,1|H<1>}	H(C[6]N[5,6]C[6])	119.1570	0.000	1	119.0587	0.130	11	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,6]Ga[5])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]Ga[5])(C[6]C[6]H)(H){1|Si<4>,2|Cl<1>,1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ga<4>,1|C<3>,1|H<1>}	H(C[6]N[5,6]C[6])	119.2340	0.420	2	119.0587	0.130	11	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,6]Ga[5])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]Ga[5])(C[6]C[6]H)(H){2|Fe<8>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ga<4>,1|C<3>,1|H<1>}	H(C[6]N[5,6]C[6])	118.9310	0.552	2	119.0587	0.130	11	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,6]Ge[5])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]Ge[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>,2|C<4>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ge<4>,1|C<3>,1|H<1>}	H(C[6]N[5,6]C[6])	119.5510	0.212	2	119.4535	0.030	4	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,6]Ge[5])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]Ge[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ge<2>,1|C<3>,1|H<1>}	H(C[6]N[5,6]C[6])	119.3560	0.091	2	119.4535	0.030	4	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,6]In[5])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]C)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]In[5])(C[6]C[6]H)(H){3|Cl<1>,1|C<4>,1|N<3>,1|O<2>,2|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]C)(H){1|In<6>,1|C<3>,1|H<1>}	H(C[6]N[5,6]C[6])	118.8060	0.149	4	118.7401	0.032	8	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,6]In[5])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]C)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]In[5])(C[6]C[6]H)(H){3|Cl<1>,1|C<4>,1|N<3>,1|O<3>,2|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]C)(H){1|In<6>,1|C<3>,1|H<1>}	H(C[6]N[5,6]C[6])	118.6743	0.201	4	118.7401	0.032	8	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,6]In[5])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]In[5])(C[6]C[6]H)(H){1|Si<4>,1|C<3>,1|C<4>,1|H<1>,2|I<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|In<4>,1|C<3>,1|H<1>}	H(C[6]N[5,6]C[6])	119.0630	0.000	1	118.9637	0.026	3	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,6]In[5])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]In[5])(C[6]C[6]H)(H){1|Si<4>,2|Cl<1>,1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|In<4>,1|C<3>,1|H<1>}	H(C[6]N[5,6]C[6])	119.0500	0.000	1	118.9637	0.026	3	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,6]In[5])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]In[5])(C[6]C[6]H)(H){3|Cl<1>,1|H<1>,1|N<3>,1|O<3>,2|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|In<6>,1|C<3>,1|H<1>}	H(C[6]N[5,6]C[6])	118.7780	0.000	1	118.9637	0.026	3	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|N<2>,2|C<3>}	H(C[6]N[5,6]C[6])	121.6720	0.140	2	121.3463	0.108	6	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]N[5,6]C[6])	121.1835	0.259	4	121.3463	0.108	6	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]N[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]N[5,6]H)(C[6]N[6]H)(H){1|C<3>,1|N<2>}	H(C[6]N[5,6]C[6])	121.6722	0.071	9	121.7125	0.012	11	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]N[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(H){1|C<3>,1|H<1>,2|N<3>}	C[6](C[6]N[5,6]H)(C[6]N[6]H)(H){1|Ag<5>,1|C<3>,1|N<2>}	H(C[6]N[5,6]C[6])	121.8940	0.010	2	121.7125	0.012	11	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,6]Nb[5])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]Nb[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>,2|C<3>,3|N<2>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Nb<6>,1|C<3>,1|H<1>}	H(C[6]N[5,6]C[6])	118.8595	0.054	2	118.8595	0.003	2	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,6]O[5])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]O[5])(C[6]C[6]H)(H){1|Ge<2>,1|C<3>,1|H<1>,1|S<2>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]N[5,6]C[6])	119.7600	0.000	1	121.6993	9.594	4	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,6]O[5])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]O[5])(C[6]C[6]H)(H){1|In<6>,1|C<3>,1|H<1>,1|S<2>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]N[5,6]C[6])	119.6080	0.000	1	121.6993	9.594	4	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,6]O[5])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]O[5])(C[6]C[6]H)(H){1|Si<5>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]N[5,6]C[6])	123.7145	3.539	2	121.6993	9.594	4	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,6]P[3x5])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]P[3x5])(C[6]C[6]H)(H){1|H<1>,2|N<3>,2|O<2>,3|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<6>}	H(C[6]N[5,6]C[6])	119.9580	0.062	2	119.9580	0.004	2	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,6]P[5])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]P[5])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<2>,1|W<6>,2|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<4>}	H(C[6]N[5,6]C[6])	119.8610	0.045	2	119.9359	0.128	7	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,6]P[5])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]P[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>,4|F<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<6>}	H(C[6]N[5,6]C[6])	119.9400	0.000	1	119.9359	0.128	7	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,6]P[5])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]P[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<2>}	H(C[6]N[5,6]C[6])	120.1520	0.424	3	119.9359	0.128	7	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,6]P[5])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]P[5])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<3>}	H(C[6]N[5,6]C[6])	119.4330	0.000	1	119.9359	0.128	7	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,6]S[5])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]C)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]S[5])(C[6]C[6]H)(H){1|C<4>,1|N<3>,2|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|S<2>}	H(C[6]N[5,6]C[6])	120.2880	0.000	1	120.2880	0.000	1	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,6]Se[5])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]Se[5])(C[6]C[6]H)(H){1|H<1>,1|N<2>,2|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Se<2>,1|C<3>,1|H<1>}	H(C[6]N[5,6]C[6])	119.5390	0.000	1	119.5390	0.000	1	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,6]Si[5])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]Si[5])(C[6]C[6]H)(H){1|C<2>,1|H<1>,1|N<3>,2|C<3>,3|F<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Si<6>,1|C<3>,1|H<1>}	H(C[6]N[5,6]C[6])	119.1605	0.054	2	119.1547	0.162	19	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,6]Si[5])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]Si[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<2>,2|C<3>,2|C<4>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Si<5>,1|C<3>,1|H<1>}	H(C[6]N[5,6]C[6])	119.2155	0.252	2	119.1547	0.162	19	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,6]Si[5])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]Si[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,4|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Si<4>,1|C<3>,1|H<1>}	H(C[6]N[5,6]C[6])	118.3657	0.397	3	119.1547	0.162	19	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,6]Si[5])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]Si[5])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<2>,3|N<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Si<6>,1|C<3>,1|H<1>}	H(C[6]N[5,6]C[6])	119.3834	0.139	5	119.1547	0.162	19	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,6]Si[5])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]Si[5])(C[6]C[6]H)(H){2|Cl<1>,1|N<3>,2|C<3>,3|H<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Si<6>,1|C<3>,1|H<1>}	H(C[6]N[5,6]C[6])	119.4630	0.190	2	119.1547	0.162	19	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,6]Si[5])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]Si[5])(C[6]C[6]H)(H){3|Cl<1>,1|C<3>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Si<5>,1|C<3>,1|H<1>}	H(C[6]N[5,6]C[6])	119.2140	0.116	3	119.1547	0.162	19	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,6]Si[5])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]Si[5])(C[6]C[6]H)(H){3|Cl<1>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Si<5>,1|C<3>,1|H<1>}	H(C[6]N[5,6]C[6])	119.3030	0.124	2	119.1547	0.162	19	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,6a]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6a]C[5,6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]N[5,6]C[6])	121.5220	0.000	1	121.1675	0.251	2	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,6a]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6a]C[5,6])(C[6]C[6]H)(H){1|H<1>,4|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]N[5,6]C[6])	120.8130	0.000	1	121.1675	0.251	2	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]Ga[3x5,6,6]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]Ga[3x5,6,6]C[5,6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,2|O<2>,3|N<4>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ga<6>,1|C<3>,1|H<1>}	H(C[6]N[5,6]C[6])	118.9100	0.069	2	118.9100	0.005	2	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]Ga[3x5]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]Ga[3x5]C[5,6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,5|N<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ga<6>,1|C<3>,1|H<1>}	H(C[6]N[5,6]C[6])	119.2136	0.276	5	119.1803	0.067	6	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]Ga[3x5]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]Ga[3x5]C[5,6])(C[6]C[6]H)(H){2|Cl<1>,1|C<3>,1|C<4>,1|H<1>,1|N<3>,2|N<4>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ga<6>,1|C<3>,1|H<1>}	H(C[6]N[5,6]C[6])	119.0140	0.000	1	119.1803	0.067	6	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]Ga[4,5,5]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]Ga[4,5,5]C[5,6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|O<2>,3|N<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ga<6>,1|C<3>,1|H<1>}	H(C[6]N[5,6]C[6])	119.0744	0.384	15	119.0744	0.148	15	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]Ga[4x5]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]Ga[4x5]C[5,6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|S<2>,3|N<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ga<6>,1|C<3>,1|H<1>}	H(C[6]N[5,6]C[6])	119.3015	0.694	4	119.3015	0.482	4	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]Ga[5,5,6,6]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]Ga[5,5,6,6]C[5,6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,2|O<2>,3|N<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ga<6>,1|C<3>,1|H<1>}	H(C[6]N[5,6]C[6])	119.1675	0.050	2	119.1675	0.003	2	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]Ga[5,5,6]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]Ga[5,5,6]C[5,6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|O<2>,3|N<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ga<6>,1|C<3>,1|H<1>}	H(C[6]N[5,6]C[6])	118.8100	0.786	4	118.8100	0.617	4	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]Ga[5,5]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]C)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]Ga[5,5]C[5,6])(C[6]C[6]H)(H){2|Cl<1>,1|C<4>,2|C<3>,2|N<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]C)(H){1|Ga<5>,1|C<3>,1|H<1>}	H(C[6]N[5,6]C[6])	118.9900	0.356	2	118.9900	0.127	2	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]Ga[5,5]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]Ga[5,5]C[5,6])(C[6]C[6]H)(H){1|Cl<1>,1|H<1>,2|C<3>,3|N<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ga<5>,1|C<3>,1|H<1>}	H(C[6]N[5,6]C[6])	118.4380	0.000	1	118.8995	0.121	17	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]Ga[5,5]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]Ga[5,5]C[5,6])(C[6]C[6]H)(H){1|H<1>,1|O<3>,2|C<3>,3|N<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ga<5>,1|C<3>,1|H<1>}	H(C[6]N[5,6]C[6])	118.3790	0.000	1	118.8995	0.121	17	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]Ga[5,5]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]Ga[5,5]C[5,6])(C[6]C[6]H)(H){1|H<1>,1|S<2>,2|C<3>,3|N<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ga<5>,1|C<3>,1|H<1>}	H(C[6]N[5,6]C[6])	118.4095	0.073	2	118.8995	0.121	17	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]Ga[5,5]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]Ga[5,5]C[5,6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|F<1>,2|N<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ga<5>,1|C<3>,1|H<1>}	H(C[6]N[5,6]C[6])	119.1055	0.200	2	118.8995	0.121	17	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]Ga[5,5]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]Ga[5,5]C[5,6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|I<1>,2|N<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ga<5>,1|C<3>,1|H<1>}	H(C[6]N[5,6]C[6])	119.4120	0.204	2	118.8995	0.121	17	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]Ga[5,5]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]Ga[5,5]C[5,6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>,3|F<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ga<6>,1|C<3>,1|H<1>}	H(C[6]N[5,6]C[6])	118.8025	0.059	2	118.8995	0.121	17	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]Ga[5,5]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]Ga[5,5]C[5,6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,3|N<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ga<4>,1|C<3>,1|H<1>}	H(C[6]N[5,6]C[6])	119.2800	0.000	1	118.8995	0.121	17	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]Ga[5,5]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]Ga[5,5]C[5,6])(C[6]C[6]H)(H){2|Cl<1>,1|H<1>,1|N<3>,1|S<2>,2|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ga<5>,1|C<3>,1|H<1>}	H(C[6]N[5,6]C[6])	118.8990	0.164	2	118.8995	0.121	17	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]Ga[5,5]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]Ga[5,5]C[5,6])(C[6]C[6]H)(H){3|Br<1>,1|H<1>,2|C<3>,2|N<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ga<6>,1|C<3>,1|H<1>}	H(C[6]N[5,6]C[6])	118.9700	0.170	2	118.8995	0.121	17	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]Ga[5,5]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]Ga[5,5]C[5,6])(C[6]C[6]H)(H){3|Cl<1>,1|H<1>,2|C<3>,2|N<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ga<6>,1|C<3>,1|H<1>}	H(C[6]N[5,6]C[6])	118.9990	0.157	2	118.8995	0.121	17	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]Ga[5x5]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]Ga[5x5]C[5,6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|N<3>,2|N<4>,2|O<2>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ga<6>,1|C<3>,1|H<1>}	H(C[6]N[5,6]C[6])	119.2140	0.000	1	119.2140	0.000	1	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]Ge[5,6]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]Ge[5,6]C[5,6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|N<3>,1|N<4>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ge<3>,1|C<3>,1|H<1>}	H(C[6]N[5,6]C[6])	119.6410	0.000	1	119.6375	0.000	2	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]Ge[5,6]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]Ge[5,6]C[5,6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,2|N<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Ge<3>,1|C<3>,1|H<1>}	H(C[6]N[5,6]C[6])	119.6340	0.000	1	119.6375	0.000	2	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]In[3x4,5,3x6]C[5,6,6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]In[3x4,5,3x6]C[5,6,6a])(C[6]C[6]H)(H){1|Cl<1>,1|H<1>,1|N<3>,2|C<3>,3|S<3>}	C[6](C[6]C[6,6a]H)(C[6]N[5,6]H)(H){1|In<6>,2|C<3>}	H(C[6]N[5,6]C[6])	118.6446	0.803	14	118.6446	0.645	14	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]In[3x5]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]In[3x5]C[5,6])(C[6]C[6]H)(H){1|Cl<1>,1|C<3>,1|C<4>,1|H<1>,1|N<4>,3|N<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|In<6>,1|C<3>,1|H<1>}	H(C[6]N[5,6]C[6])	119.2560	0.000	1	118.9205	0.072	4	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]In[3x5]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]In[3x5]C[5,6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>,2|O<3>,3|O<2>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|In<7>,1|C<3>,1|H<1>}	H(C[6]N[5,6]C[6])	118.6040	0.000	1	118.9205	0.072	4	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]In[3x5]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]In[3x5]C[5,6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>,4|O<2>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|In<6>,1|C<3>,1|H<1>}	H(C[6]N[5,6]C[6])	118.9110	0.047	2	118.9205	0.072	4	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]In[4x5]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]In[4x5]C[5,6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|S<2>,3|N<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|In<6>,1|C<3>,1|H<1>}	H(C[6]N[5,6]C[6])	118.6963	0.205	3	118.6963	0.042	3	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]In[5,5,6,6]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]In[5,5,6,6]C[5,6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,2|N<3>,3|O<2>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|In<6>,1|C<3>,1|H<1>}	H(C[6]N[5,6]C[6])	118.8660	0.165	2	118.8660	0.027	2	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]In[5,5]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]In[5,5]C[5,6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<3>,2|C<3>,3|O<2>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|In<6>,2|C<3>}	H(C[6]N[5,6]C[6])	119.2470	0.281	2	118.9645	0.060	11	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]In[5,5]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]In[5,5]C[5,6])(C[6]C[6]H)(H){1|Se<2>,2|Br<1>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|In<5>,1|C<3>,1|H<1>}	H(C[6]N[5,6]C[6])	118.8810	0.000	1	118.9645	0.060	11	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]In[5,5]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]In[5,5]C[5,6])(C[6]C[6]H)(H){2|Br<1>,1|H<1>,1|N<3>,1|O<3>,1|S<2>,2|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|In<6>,1|C<3>,1|H<1>}	H(C[6]N[5,6]C[6])	119.0120	0.000	1	118.9645	0.060	11	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]In[5,5]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]In[5,5]C[5,6])(C[6]C[6]H)(H){2|Cl<1>,1|H<1>,1|N<3>,1|O<2>,1|S<2>,2|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|In<6>,1|C<3>,1|H<1>}	H(C[6]N[5,6]C[6])	118.8720	0.000	1	118.9645	0.060	11	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]In[5,5]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]In[5,5]C[5,6])(C[6]C[6]H)(H){2|Cl<1>,1|H<1>,1|N<3>,1|O<3>,1|S<2>,2|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|In<6>,1|C<3>,1|H<1>}	H(C[6]N[5,6]C[6])	118.7940	0.000	1	118.9645	0.060	11	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]In[5,5]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]In[5,5]C[5,6])(C[6]C[6]H)(H){3|Br<1>,1|C<3>,1|C<4>,1|H<1>,1|N<3>,1|N<4>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|In<6>,1|C<3>,1|H<1>}	H(C[6]N[5,6]C[6])	119.0150	0.000	1	118.9645	0.060	11	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]In[5,5]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]In[5,5]C[5,6])(C[6]C[6]H)(H){3|Cl<1>,1|C<3>,1|H<1>,1|N<2>,2|N<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|In<6>,1|C<3>,1|H<1>}	H(C[6]N[5,6]C[6])	118.6650	0.000	1	118.9645	0.060	11	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]In[5,5]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]In[5,5]C[5,6])(C[6]C[6]H)(H){3|Cl<1>,1|H<1>,1|N<3>,1|S<2>,2|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|In<6>,1|C<3>,1|H<1>}	H(C[6]N[5,6]C[6])	119.2880	0.000	1	118.9645	0.060	11	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]In[5,5]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]In[5,5]C[5,6])(C[6]C[6]H)(H){3|Cl<1>,1|H<1>,2|C<3>,2|N<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|In<6>,1|C<3>,1|H<1>}	H(C[6]N[5,6]C[6])	118.7945	0.252	2	118.9645	0.060	11	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]In[5,6]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]In[5,6]C[5,6])(C[6]C[6]H)(H){2|Cl<1>,1|H<1>,1|O<2>,2|C<3>,2|N<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|In<6>,1|C<3>,1|H<1>}	H(C[6]N[5,6]C[6])	118.5110	0.000	1	118.5110	0.000	1	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]Si[5,5]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]Si[5,5]C[5,6])(C[6]C[6]H)(H){1|Br<1>,1|C<4>,1|H<1>,1|N<3>,1|S<2>,2|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Si<5>,1|C<3>,1|H<1>}	H(C[6]N[5,6]C[6])	119.1810	0.000	1	119.2451	0.065	14	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]Si[5,5]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]Si[5,5]C[5,6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>,1|O<2>,1|S<2>,2|C<4>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Si<5>,1|C<3>,1|H<1>}	H(C[6]N[5,6]C[6])	119.3350	0.000	1	119.2451	0.065	14	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]Si[5,5]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]Si[5,5]C[5,6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<2>,1|N<3>,1|S<2>,2|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Si<5>,1|C<3>,1|H<1>}	H(C[6]N[5,6]C[6])	119.5020	0.327	3	119.2451	0.065	14	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]Si[5,5]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]Si[5,5]C[5,6])(C[6]C[6]H)(H){1|Cl<1>,1|C<4>,1|H<1>,1|N<3>,1|S<2>,2|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Si<5>,1|C<3>,1|H<1>}	H(C[6]N[5,6]C[6])	119.1990	0.027	2	119.2451	0.065	14	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]Si[5,5]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]Si[5,5]C[5,6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<2>,3|N<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Si<6>,1|C<3>,1|H<1>}	H(C[6]N[5,6]C[6])	119.1160	0.000	1	119.2451	0.065	14	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]Si[5,5]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]Si[5,5]C[5,6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,3|N<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Si<4>,1|C<3>,1|H<1>}	H(C[6]N[5,6]C[6])	118.8600	0.072	2	119.2451	0.065	14	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]Si[5,5]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]Si[5,5]C[5,6])(C[6]C[6]H)(H){2|Cl<1>,1|H<1>,2|C<3>,3|N<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Si<6>,1|C<3>,1|H<1>}	H(C[6]N[5,6]C[6])	119.2938	0.167	4	119.2451	0.065	14	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5,6]Si[5,6]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]Si[5,6]C[5,6])(C[6]C[6]H)(H){1|H<1>,1|O<2>,2|C<3>,2|N<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(H){1|Si<4>,1|C<3>,1|H<1>}	H(C[6]N[5,6]C[6])	118.8030	0.000	1	118.8030	0.000	1	119.5768	1.334	339	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]N[6]H)(H)	C[6](C[6]N[5,6]H)(N[6]C[6]C)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]N[6]H)(H){1|C<4>,1|O<1>,4|C<3>}	C[6](C[6]N[5,6]H)(N[6]C[6]C)(H){1|C<3>,1|C<4>,1|O<1>}	H(C[6]N[5,6]C[6])	120.9760	0.000	1	120.9760	0.000	1	120.9760	0.000	1	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5a,6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5a,6]C[5a,6]C[5a])(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]N[5a,6]H)(H)	H(C[6]N[5a,6]C[6])	C[6](N[5a,6]C[5a,6]C[5a])(C[6]C[6,6]H)(H){1|C<4>,1|N<2>,3|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]N[5a,6]H)(H){1|O<1>,4|C<3>}	H(C[6]N[5a,6]C[6])	119.9770	0.000	1	119.9770	0.000	1	119.9770	0.000	1	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5a,6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5a,6]C[5a,6]2)(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[5a,6]H)(H)	H(C[6]N[5a,6]C[6])	C[6](N[5a,6]C[5a,6]2)(C[6]C[6,6a]H)(H){5|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[5a,6]H)(H){1|H<1>,4|C<3>}	H(C[6]N[5a,6]C[6])	120.4250	0.000	1	120.4250	0.000	1	122.0250	7.457	3	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5a,6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5a,6]C[5a,6]C[5a])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[5a,6]H)(H)	H(C[6]N[5a,6]C[6])	C[6](N[5a,6]C[5a,6]C[5a])(C[6]C[6,6a]H)(H){5|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[5a,6]H)(H){1|H<1>,4|C<3>}	H(C[6]N[5a,6]C[6])	125.1780	0.000	1	125.1780	0.000	1	122.0250	7.457	3	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5a,6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5a,6]C[5a,6a]C[5a,6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[5a,6]H)(H)	H(C[6]N[5a,6]C[6])	C[6](N[5a,6]C[5a,6a]C[5a,6])(C[6]C[6,6a]H)(H){1|N<2>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[5a,6]H)(H){1|H<1>,4|C<3>}	H(C[6]N[5a,6]C[6])	120.4720	0.000	1	120.4720	0.000	1	122.0250	7.457	3	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:F-1:	C[6]-3:	C[6](N[5a,6]C[5a,6]2)(C[6]C[6]F)(H)	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(F)	H(C[6]N[5a,6]C[6])	C[6](N[5a,6]C[5a,6]2)(C[6]C[6]F)(H){1|H<1>,4|C<3>}	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(F){1|H<1>,2|C<3>}	H(C[6]N[5a,6]C[6])	125.7510	0.000	1	125.7510	0.000	1	125.7510	0.000	1	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5a,6]B[5,5a]C[5a,6])(C[6]C[6]H)(H)	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H)	H(C[6]N[5a,6]C[6])	C[6](N[5a,6]B[5,5a]C[5a,6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>,2|O<2>}	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]N[5a,6]C[6])	119.3170	0.137	2	119.3170	0.019	2	120.5393	2.688	93	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5a,6]C[5a,5a]C[5a,6])(C[6]C[6]H)(H)	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H)	H(C[6]N[5a,6]C[6])	C[6](N[5a,6]C[5a,5a]C[5a,6])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]N[5a,6]C[6])	120.4980	0.000	1	120.4980	0.000	1	120.5393	2.688	93	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5a,6]C[5a,6,6a]B[5,5a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[5a,6]H)(H)	H(C[6]N[5a,6]C[6])	C[6](N[5a,6]C[5a,6,6a]B[5,5a])(C[6]C[6]H)(H){1|H<1>,1|O<2>,4|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[5a,6]H)(H){1|B<4>,2|C<3>}	H(C[6]N[5a,6]C[6])	119.9827	0.128	3	120.9753	3.952	4	120.5393	2.688	93	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5a,6]C[5a,6,6a]B[5,5a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[5a,6]H)(H)	H(C[6]N[5a,6]C[6])	C[6](N[5a,6]C[5a,6,6a]B[5,5a])(C[6]C[6]H)(H){1|H<1>,2|O<2>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[5a,6]H)(H){1|B<4>,2|C<3>}	H(C[6]N[5a,6]C[6])	123.9530	0.000	1	120.9753	3.952	4	120.5393	2.688	93	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5a,6]C[5a,6,6a]B[5a,6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[5a,6]H)(H)	H(C[6]N[5a,6]C[6])	C[6](N[5a,6]C[5a,6,6a]B[5a,6])(C[6]C[6]H)(H){1|H<1>,1|O<2>,4|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[5a,6]H)(H){1|B<4>,2|C<3>}	H(C[6]N[5a,6]C[6])	120.0530	0.164	7	120.0530	0.027	7	120.5393	2.688	93	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5a,6]C[5a,6,6a]B[5a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]C)(C[6]N[5a,6]H)(H)	H(C[6]N[5a,6]C[6])	C[6](N[5a,6]C[5a,6,6a]B[5a])(C[6]C[6]H)(H){1|C<4>,1|O<2>,4|C<3>}	C[6](C[6]C[6,6a]C)(C[6]N[5a,6]H)(H){1|B<4>,2|C<3>}	H(C[6]N[5a,6]C[6])	119.7505	0.151	2	119.7505	0.023	2	120.5393	2.688	93	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5a,6]C[5a,6,6a]B[5a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[5a,6]H)(H)	H(C[6]N[5a,6]C[6])	C[6](N[5a,6]C[5a,6,6a]B[5a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,4|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[5a,6]H)(H){1|B<4>,2|C<3>}	H(C[6]N[5a,6]C[6])	119.7558	0.203	6	119.9408	0.595	35	120.5393	2.688	93	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5a,6]C[5a,6,6a]B[5a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[5a,6]H)(H)	H(C[6]N[5a,6]C[6])	C[6](N[5a,6]C[5a,6,6a]B[5a])(C[6]C[6]H)(H){1|H<1>,1|O<2>,4|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[5a,6]H)(H){1|B<4>,2|C<3>}	H(C[6]N[5a,6]C[6])	119.9880	0.871	27	119.9408	0.595	35	120.5393	2.688	93	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5a,6]C[5a,6,6a]B[5a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[5a,6]H)(H)	H(C[6]N[5a,6]C[6])	C[6](N[5a,6]C[5a,6,6a]B[5a])(C[6]C[6]H)(H){1|H<1>,2|O<2>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[5a,6]H)(H){1|B<4>,2|C<3>}	H(C[6]N[5a,6]C[6])	119.8595	0.025	2	119.9408	0.595	35	120.5393	2.688	93	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5a,6]C[5a,6]2)(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6])(C[6]N[5a,6]H)(H)	H(C[6]N[5a,6]C[6])	C[6](N[5a,6]C[5a,6]2)(C[6]C[6]H)(H){1|N<3>,4|C<3>}	C[6](C[6]C[6a]C[6])(C[6]N[5a,6]H)(H){5|C<3>}	H(C[6]N[5a,6]C[6])	120.7250	0.000	1	120.7250	0.000	1	120.5393	2.688	93	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5a,6]C[5a,6]2)(C[6]C[6]H)(H)	C[6](C[6]N[5a,6]H)(C[6]C[6]C)(H)	H(C[6]N[5a,6]C[6])	C[6](N[5a,6]C[5a,6]2)(C[6]C[6]H)(H){1|C<4>,4|C<3>}	C[6](C[6]N[5a,6]H)(C[6]C[6]C)(H){1|H<1>,2|C<3>}	H(C[6]N[5a,6]C[6])	120.3965	0.156	2	120.3965	0.024	2	120.5393	2.688	93	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5a,6]C[5a,6]2)(C[6]C[6]H)(H)	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H)	H(C[6]N[5a,6]C[6])	C[6](N[5a,6]C[5a,6]2)(C[6]C[6]H)(H){1|H<1>,4|C<3>}	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]N[5a,6]C[6])	120.3370	0.000	1	120.3370	0.000	1	120.5393	2.688	93	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5a,6]C[5a,6]B[5a])(C[6]C[6]H)(H)	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H)	H(C[6]N[5a,6]C[6])	C[6](N[5a,6]C[5a,6]B[5a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,2|C<3>,2|N<3>}	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]N[5a,6]C[6])	122.8240	0.000	1	120.8089	2.964	13	120.5393	2.688	93	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5a,6]C[5a,6]B[5a])(C[6]C[6]H)(H)	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H)	H(C[6]N[5a,6]C[6])	C[6](N[5a,6]C[5a,6]B[5a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>,2|C<4>}	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]N[5a,6]C[6])	119.7010	0.000	1	120.8089	2.964	13	120.5393	2.688	93	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5a,6]C[5a,6]B[5a])(C[6]C[6]H)(H)	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H)	H(C[6]N[5a,6]C[6])	C[6](N[5a,6]C[5a,6]B[5a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>,2|F<1>}	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]N[5a,6]C[6])	119.9827	0.124	3	120.8089	2.964	13	120.5393	2.688	93	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5a,6]C[5a,6]B[5a])(C[6]C[6]H)(H)	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H)	H(C[6]N[5a,6]C[6])	C[6](N[5a,6]C[5a,6]B[5a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,4|C<3>}	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]N[5a,6]C[6])	121.2033	2.069	7	120.8089	2.964	13	120.5393	2.688	93	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5a,6]C[5a,6]B[5a])(C[6]C[6]H)(H)	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H)	H(C[6]N[5a,6]C[6])	C[6](N[5a,6]C[5a,6]B[5a])(C[6]C[6]H)(H){2|Cl<1>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]N[5a,6]C[6])	119.6200	0.000	1	120.8089	2.964	13	120.5393	2.688	93	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H)	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H)	H(C[6]N[5a,6]C[6])	C[6](N[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<2>,2|N<2>}	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]N[5a,6]C[6])	120.2710	0.000	1	121.4955	5.989	20	120.5393	2.688	93	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H)	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H)	H(C[6]N[5a,6]C[6])	C[6](N[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H){1|C<3>,1|N<2>,1|N<3>,2|H<1>}	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]N[5a,6]C[6])	121.2370	0.000	1	121.4955	5.989	20	120.5393	2.688	93	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H)	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H)	H(C[6]N[5a,6]C[6])	C[6](N[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]N[5a,6]C[6])	120.3440	0.482	2	121.4955	5.989	20	120.5393	2.688	93	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H)	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H)	H(C[6]N[5a,6]C[6])	C[6](N[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]N[5a,6]C[6])	120.2340	0.000	1	121.4955	5.989	20	120.5393	2.688	93	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H)	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H)	H(C[6]N[5a,6]C[6])	C[6](N[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]N[5a,6]C[6])	124.5160	0.000	1	121.4955	5.989	20	120.5393	2.688	93	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H)	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H)	H(C[6]N[5a,6]C[6])	C[6](N[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H){1|Ir<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]N[5a,6]C[6])	120.3930	0.238	5	121.4955	5.989	20	120.5393	2.688	93	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H)	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H)	H(C[6]N[5a,6]C[6])	C[6](N[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]N[5a,6]C[6])	124.1488	4.523	4	121.4955	5.989	20	120.5393	2.688	93	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H)	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H)	H(C[6]N[5a,6]C[6])	C[6](N[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	H(C[6]N[5a,6]C[6])	120.6920	0.000	1	121.4955	5.989	20	120.5393	2.688	93	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H)	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H)	H(C[6]N[5a,6]C[6])	C[6](N[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]N[5a,6]C[6])	121.2565	0.631	2	121.4955	5.989	20	120.5393	2.688	93	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H)	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H)	H(C[6]N[5a,6]C[6])	C[6](N[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H){1|Re<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]N[5a,6]C[6])	120.5995	0.158	2	121.4955	5.989	20	120.5393	2.688	93	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5a,6]C[5a,6]N[5a])(C[6]C[6]H)(H)	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H)	H(C[6]N[5a,6]C[6])	C[6](N[5a,6]C[5a,6]N[5a])(C[6]C[6]H)(H){1|H<1>,3|C<3>}	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]N[5a,6]C[6])	125.6900	0.000	1	125.6900	0.000	1	120.5393	2.688	93	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5a,6]C[5a,6]S[5a])(C[6]C[6]H)(H)	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H)	H(C[6]N[5a,6]C[6])	C[6](N[5a,6]C[5a,6]S[5a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,2|C<3>}	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	H(C[6]N[5a,6]C[6])	120.8130	0.000	1	120.8130	0.000	1	120.5393	2.688	93	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5a,6]C[5a,6a]C[5a,6])(C[6]C[6]H)(H)	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H)	H(C[6]N[5a,6]C[6])	C[6](N[5a,6]C[5a,6a]C[5a,6])(C[6]C[6]H)(H){1|H<1>,1|N<2>,3|C<3>}	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	H(C[6]N[5a,6]C[6])	120.4480	0.000	1	120.1783	0.056	3	120.5393	2.688	93	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[5a,6]C[5a,6a]C[5a,6])(C[6]C[6]H)(H)	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H)	H(C[6]N[5a,6]C[6])	C[6](N[5a,6]C[5a,6a]C[5a,6])(C[6]C[6]H)(H){1|H<1>,4|C<3>}	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]N[5a,6]C[6])	120.0435	0.056	2	120.1783	0.056	3	120.5393	2.688	93	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[5a,6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](N[5a,6]C[5a,6]C[5a])(C[6]N[6]H)(H)	C[6](C[6]N[5a,6]H)(N[6]C[6]H)(H)	H(C[6]N[5a,6]C[6])	C[6](N[5a,6]C[5a,6]C[5a])(C[6]N[6]H)(H){1|H<1>,1|N<2>,1|O<2>,2|C<3>}	C[6](C[6]N[5a,6]H)(N[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]N[5a,6]C[6])	120.9840	0.000	1	120.9840	0.000	1	120.9840	0.000	1	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6,6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6,6]C[6,6]B[6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6,6]H)(H)	H(C[6]N[6,6]C[6])	C[6](N[6,6]C[6,6]B[6])(C[6]C[6,6a]H)(H){1|N<2>,1|O<2>,2|C<3>,2|F<1>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6,6]H)(H){1|B<4>,1|H<1>,3|C<3>}	H(C[6]N[6,6]C[6])	118.8965	0.022	2	118.8287	0.014	3	119.8815	0.725	37	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6,6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6,6]C[6,6]B[6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6,6]H)(H)	H(C[6]N[6,6]C[6])	C[6](N[6,6]C[6,6]B[6])(C[6]C[6,6a]H)(H){1|O<2>,2|F<1>,3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6,6]H)(H){1|B<4>,1|H<1>,3|C<3>}	H(C[6]N[6,6]C[6])	118.6930	0.000	1	118.8287	0.014	3	119.8815	0.725	37	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6,6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6,6]C[6,6]C[6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6,6]H)(H)	H(C[6]N[6,6]C[6])	C[6](N[6,6]C[6,6]C[6])(C[6]C[6,6a]H)(H){1|C<4>,1|H<1>,2|C<2>,3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6,6]H)(H){1|H<1>,2|C<3>,2|C<4>}	H(C[6]N[6,6]C[6])	119.0880	0.028	2	119.9744	0.680	34	119.8815	0.725	37	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6,6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6,6]C[6,6]C[6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6,6]H)(H)	H(C[6]N[6,6]C[6])	C[6](N[6,6]C[6,6]C[6])(C[6]C[6,6a]H)(H){1|C<4>,2|H<1>,3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6,6]H)(H){1|C<4>,1|H<1>,3|C<3>}	H(C[6]N[6,6]C[6])	120.1077	0.775	29	119.9744	0.680	34	119.8815	0.725	37	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6,6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6,6]C[6,6]C[6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6,6]H)(H)	H(C[6]N[6,6]C[6])	C[6](N[6,6]C[6,6]C[6])(C[6]C[6,6a]H)(H){1|H<1>,1|N<2>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6,6]H)(H){1|C<4>,1|H<1>,3|C<3>}	H(C[6]N[6,6]C[6])	120.4050	0.000	1	119.9744	0.680	34	119.8815	0.725	37	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6,6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6,6]C[6,6]C[6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6,6]H)(H)	H(C[6]N[6,6]C[6])	C[6](N[6,6]C[6,6]C[6])(C[6]C[6,6a]H)(H){1|H<1>,1|N<3>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6,6]H)(H){1|C<4>,1|H<1>,3|C<3>}	H(C[6]N[6,6]C[6])	119.0120	0.000	1	119.9744	0.680	34	119.8815	0.725	37	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6,6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6,6]C[6,6]C[6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6,6]H)(H)	H(C[6]N[6,6]C[6])	C[6](N[6,6]C[6,6]C[6])(C[6]C[6,6a]H)(H){1|H<1>,1|O<1>,2|C<3>,2|C<4>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6,6]H)(H){1|C<4>,1|H<1>,3|C<3>}	H(C[6]N[6,6]C[6])	118.4160	0.000	1	119.9744	0.680	34	119.8815	0.725	37	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6,6]B[3x6]C[6,6])(C[6]C[6]H)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	H(C[6]N[6,6]C[6])	C[6](N[6,6]B[3x6]C[6,6])(C[6]C[6]H)(H){1|H<1>,1|O<2>,2|C<3>,2|C<4>}	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]N[6,6]C[6])	118.7040	0.000	1	118.7040	0.000	1	119.4398	2.291	192	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6,6]B[5,6]C[6,6])(C[6]C[6]H)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	H(C[6]N[6,6]C[6])	C[6](N[6,6]B[5,6]C[6,6])(C[6]C[6]H)(H){1|H<1>,1|O<2>,4|C<3>}	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]N[6,6]C[6])	118.8200	0.000	1	118.6058	0.117	5	119.4398	2.291	192	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6,6]B[5,6]C[6,6])(C[6]C[6]H)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	H(C[6]N[6,6]C[6])	C[6](N[6,6]B[5,6]C[6,6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,3|O<2>}	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]N[6,6]C[6])	119.0420	0.000	1	118.6058	0.117	5	119.4398	2.291	192	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6,6]B[5,6]C[6,6])(C[6]C[6]H)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	H(C[6]N[6,6]C[6])	C[6](N[6,6]B[5,6]C[6,6])(C[6]C[6]H)(H){1|H<1>,2|C<4>,3|C<3>}	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]N[6,6]C[6])	118.3890	0.211	3	118.6058	0.117	5	119.4398	2.291	192	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6,6]B[5a,6]C[6,6])(C[6]C[6]H)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	H(C[6]N[6,6]C[6])	C[6](N[6,6]B[5a,6]C[6,6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,3|O<2>}	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]N[6,6]C[6])	118.5810	0.294	3	118.5810	0.087	3	119.4398	2.291	192	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6,6]B[6,6]C[6,6])(C[6]C[6]H)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	H(C[6]N[6,6]C[6])	C[6](N[6,6]B[6,6]C[6,6])(C[6]C[6]H)(H){1|H<1>,1|O<2>,4|C<3>}	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]N[6,6]C[6])	123.0075	2.971	2	123.0075	8.824	2	119.4398	2.291	192	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6,6]B[6,6a]C[6,6])(C[6]C[6]H)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	H(C[6]N[6,6]C[6])	C[6](N[6,6]B[6,6a]C[6,6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,3|O<2>}	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]N[6,6]C[6])	118.8903	0.069	3	118.8903	0.005	3	119.4398	2.291	192	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6,6]C[5,6]C[6,6])(C[6]C[6]H)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	H(C[6]N[6,6]C[6])	C[6](N[6,6]C[5,6]C[6,6])(C[6]C[6]H)(H){1|C<3>,1|N<2>,2|H<1>,2|N<3>}	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]N[6,6]C[6])	119.8210	0.000	1	119.8210	0.000	1	119.4398	2.291	192	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6,6]C[5a,6]C[6,6])(C[6]C[6]H)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	H(C[6]N[6,6]C[6])	C[6](N[6,6]C[5a,6]C[6,6])(C[6]C[6]H)(H){1|H<1>,1|S<2>,3|C<3>}	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]N[6,6]C[6])	119.1530	0.000	1	119.1530	0.000	1	119.4398	2.291	192	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6,6]C[6,6,6a]B[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6,6]H)(H)	H(C[6]N[6,6]C[6])	C[6](N[6,6]C[6,6,6a]B[6])(C[6]C[6]H)(H){1|F<1>,1|H<1>,1|O<2>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6,6]H)(H){1|B<4>,2|C<3>}	H(C[6]N[6,6]C[6])	119.1420	0.000	1	122.1760	18.410	2	119.4398	2.291	192	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6,6]C[6,6,6a]B[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6,6]H)(H)	H(C[6]N[6,6]C[6])	C[6](N[6,6]C[6,6,6a]B[6])(C[6]C[6]H)(H){1|H<1>,1|O<2>,4|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6,6]H)(H){1|B<4>,2|C<3>}	H(C[6]N[6,6]C[6])	125.2100	0.000	1	122.1760	18.410	2	119.4398	2.291	192	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6,6]C[6,6,6a]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6,6]H)(H)	H(C[6]N[6,6]C[6])	C[6](N[6,6]C[6,6,6a]C[5,6])(C[6]C[6]H)(H){1|C<4>,2|H<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6,6]H)(H){1|C<4>,2|C<3>}	H(C[6]N[6,6]C[6])	118.8810	0.000	1	118.8810	0.000	1	119.4398	2.291	192	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6,6]C[6,6,6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6,6]H)(H)	H(C[6]N[6,6]C[6])	C[6](N[6,6]C[6,6,6a]C[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6,6]H)(H){3|C<3>}	H(C[6]N[6,6]C[6])	119.5350	0.000	1	121.6031	11.768	9	119.4398	2.291	192	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6,6]C[6,6,6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6,6]H)(H)	H(C[6]N[6,6]C[6])	C[6](N[6,6]C[6,6,6a]C[6])(C[6]C[6]H)(H){1|C<4>,2|C<3>,3|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6,6]H)(H){1|C<4>,2|C<3>}	H(C[6]N[6,6]C[6])	121.8616	3.572	8	121.6031	11.768	9	119.4398	2.291	192	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6,6]C[6,6,6a]Ga[6,6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6,6]H)(H)	H(C[6]N[6,6]C[6])	C[6](N[6,6]C[6,6,6a]Ga[6,6])(C[6]C[6]H)(H){1|Cl<1>,1|Cl<2>,1|H<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6,6]H)(H){1|Ga<4>,2|C<3>}	H(C[6]N[6,6]C[6])	118.1400	0.171	2	118.1400	0.029	2	119.4398	2.291	192	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6,6]C[6,6,6a]O[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6,6]H)(H)	H(C[6]N[6,6]C[6])	C[6](N[6,6]C[6,6,6a]O[6])(C[6]C[6]H)(H){1|B<4>,1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6,6]H)(H){1|O<2>,2|C<3>}	H(C[6]N[6,6]C[6])	119.8730	0.000	1	119.8730	0.000	1	119.4398	2.291	192	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6,6]C[6,6]2)(C[6]C[6]H)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	H(C[6]N[6,6]C[6])	C[6](N[6,6]C[6,6]2)(C[6]C[6]H)(H){1|C<4>,1|H<1>,3|C<3>}	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]N[6,6]C[6])	119.5900	0.000	1	119.3745	0.093	2	119.4398	2.291	192	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6,6]C[6,6]2)(C[6]C[6]H)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	H(C[6]N[6,6]C[6])	C[6](N[6,6]C[6,6]2)(C[6]C[6]H)(H){1|H<1>,5|C<3>}	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]N[6,6]C[6])	119.1590	0.000	1	119.3745	0.093	2	119.4398	2.291	192	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6,6]C[6,6]B[6])(C[6]C[6]H)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]C)(H)	H(C[6]N[6,6]C[6])	C[6](N[6,6]C[6,6]B[6])(C[6]C[6]H)(H){1|C<4>,1|F<1>,1|O<2>,3|C<3>}	C[6](C[6]N[6,6]H)(C[6]C[6]C)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]N[6,6]C[6])	119.1390	0.000	1	119.1390	0.000	1	119.4398	2.291	192	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6,6]C[6,6]B[6])(C[6]C[6]H)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	H(C[6]N[6,6]C[6])	C[6](N[6,6]C[6,6]B[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|O<2>,2|F<1>}	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]N[6,6]C[6])	119.6530	0.000	1	118.9008	0.291	78	119.4398	2.291	192	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6,6]C[6,6]B[6])(C[6]C[6]H)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	H(C[6]N[6,6]C[6])	C[6](N[6,6]C[6,6]B[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>,1|N<3>,2|F<1>}	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]N[6,6]C[6])	118.9630	0.075	7	118.9008	0.291	78	119.4398	2.291	192	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6,6]C[6,6]B[6])(C[6]C[6]H)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	H(C[6]N[6,6]C[6])	C[6](N[6,6]C[6,6]B[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>,1|N<3>,2|F<1>}	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|O<2>}	H(C[6]N[6,6]C[6])	119.3040	0.136	2	118.9008	0.291	78	119.4398	2.291	192	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6,6]C[6,6]B[6])(C[6]C[6]H)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	H(C[6]N[6,6]C[6])	C[6](N[6,6]C[6,6]B[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>,1|O<2>,2|F<1>}	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]N[6,6]C[6])	119.1280	0.300	4	118.9008	0.291	78	119.4398	2.291	192	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6,6]C[6,6]B[6])(C[6]C[6]H)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	H(C[6]N[6,6]C[6])	C[6](N[6,6]C[6,6]B[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>,3|C<4>}	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]N[6,6]C[6])	118.6822	0.171	6	118.9008	0.291	78	119.4398	2.291	192	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6,6]C[6,6]B[6])(C[6]C[6]H)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	H(C[6]N[6,6]C[6])	C[6](N[6,6]C[6,6]B[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<2>,3|C<3>}	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]N[6,6]C[6])	118.7010	0.110	3	118.9008	0.291	78	119.4398	2.291	192	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6,6]C[6,6]B[6])(C[6]C[6]H)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	H(C[6]N[6,6]C[6])	C[6](N[6,6]C[6,6]B[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,2|C<3>,2|F<1>}	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]N[6,6]C[6])	118.9650	0.000	1	118.9008	0.291	78	119.4398	2.291	192	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6,6]C[6,6]B[6])(C[6]C[6]H)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	H(C[6]N[6,6]C[6])	C[6](N[6,6]C[6,6]B[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,2|C<3>,2|I<1>}	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]N[6,6]C[6])	118.9090	0.000	1	118.9008	0.291	78	119.4398	2.291	192	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6,6]C[6,6]B[6])(C[6]C[6]H)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	H(C[6]N[6,6]C[6])	C[6](N[6,6]C[6,6]B[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,4|C<3>}	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]N[6,6]C[6])	118.4032	0.116	4	118.9008	0.291	78	119.4398	2.291	192	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6,6]C[6,6]B[6])(C[6]C[6]H)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	H(C[6]N[6,6]C[6])	C[6](N[6,6]C[6,6]B[6])(C[6]C[6]H)(H){1|F<1>,1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]N[6,6]C[6])	118.2990	0.000	1	118.9008	0.291	78	119.4398	2.291	192	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6,6]C[6,6]B[6])(C[6]C[6]H)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	H(C[6]N[6,6]C[6])	C[6](N[6,6]C[6,6]B[6])(C[6]C[6]H)(H){1|F<1>,1|H<1>,1|O<2>,3|C<3>}	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|C<4>}	H(C[6]N[6,6]C[6])	119.5410	0.000	1	118.9008	0.291	78	119.4398	2.291	192	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6,6]C[6,6]B[6])(C[6]C[6]H)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	H(C[6]N[6,6]C[6])	C[6](N[6,6]C[6,6]B[6])(C[6]C[6]H)(H){1|F<1>,1|H<1>,1|O<2>,3|C<3>}	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]N[6,6]C[6])	119.2105	0.088	2	118.9008	0.291	78	119.4398	2.291	192	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6,6]C[6,6]B[6])(C[6]C[6]H)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	H(C[6]N[6,6]C[6])	C[6](N[6,6]C[6,6]B[6])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,3|C<3>}	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]N[6,6]C[6])	118.5510	0.000	1	118.9008	0.291	78	119.4398	2.291	192	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6,6]C[6,6]B[6])(C[6]C[6]H)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	H(C[6]N[6,6]C[6])	C[6](N[6,6]C[6,6]B[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<2>,3|C<3>}	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]N[6,6]C[6])	118.7350	0.000	1	118.9008	0.291	78	119.4398	2.291	192	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6,6]C[6,6]B[6])(C[6]C[6]H)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	H(C[6]N[6,6]C[6])	C[6](N[6,6]C[6,6]B[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>,2|C<4>}	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]N[6,6]C[6])	118.3830	0.000	1	118.9008	0.291	78	119.4398	2.291	192	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6,6]C[6,6]B[6])(C[6]C[6]H)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	H(C[6]N[6,6]C[6])	C[6](N[6,6]C[6,6]B[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>,2|F<1>}	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]N[6,6]C[6])	119.0245	0.792	27	118.9008	0.291	78	119.4398	2.291	192	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6,6]C[6,6]B[6])(C[6]C[6]H)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	H(C[6]N[6,6]C[6])	C[6](N[6,6]C[6,6]B[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,4|C<3>}	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]N[6,6]C[6])	118.4968	0.192	5	118.9008	0.291	78	119.4398	2.291	192	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6,6]C[6,6]B[6])(C[6]C[6]H)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	H(C[6]N[6,6]C[6])	C[6](N[6,6]C[6,6]B[6])(C[6]C[6]H)(H){1|H<1>,1|O<2>,2|C<3>,2|F<1>}	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]N[6,6]C[6])	118.9571	0.150	7	118.9008	0.291	78	119.4398	2.291	192	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6,6]C[6,6]B[6])(C[6]C[6]H)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	H(C[6]N[6,6]C[6])	C[6](N[6,6]C[6,6]B[6])(C[6]C[6]H)(H){1|H<1>,1|O<2>,4|C<3>}	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]N[6,6]C[6])	118.7775	0.131	2	118.9008	0.291	78	119.4398	2.291	192	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6,6]C[6,6]B[6])(C[6]C[6]H)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	H(C[6]N[6,6]C[6])	C[6](N[6,6]C[6,6]B[6])(C[6]C[6]H)(H){2|Br<1>,1|C<4>,1|H<1>,2|C<3>}	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]N[6,6]C[6])	118.7330	0.000	1	118.9008	0.291	78	119.4398	2.291	192	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]C)(H)	H(C[6]N[6,6]C[6])	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<4>,2|H<1>,3|C<3>}	C[6](C[6]N[6,6]H)(C[6]C[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]N[6,6]C[6])	119.2445	0.176	8	119.3663	0.039	15	119.4398	2.291	192	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]C)(H)	H(C[6]N[6,6]C[6])	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(H){2|C<3>,2|C<4>,2|H<1>}	C[6](C[6]N[6,6]H)(C[6]C[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]N[6,6]C[6])	119.5054	0.107	7	119.3663	0.039	15	119.4398	2.291	192	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	H(C[6]N[6,6]C[6])	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,2|N<2>}	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|Cl<1>,2|C<3>}	H(C[6]N[6,6]C[6])	119.2760	0.000	1	120.1105	3.283	45	119.4398	2.291	192	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	H(C[6]N[6,6]C[6])	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>,3|H<1>}	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]N[6,6]C[6])	119.3620	0.000	1	120.1105	3.283	45	119.4398	2.291	192	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	H(C[6]N[6,6]C[6])	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<4>,3|H<1>}	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]N[6,6]C[6])	119.1350	0.000	1	120.1105	3.283	45	119.4398	2.291	192	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	H(C[6]N[6,6]C[6])	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>,1|O<2>,2|C<4>}	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]N[6,6]C[6])	125.4150	0.000	1	120.1105	3.283	45	119.4398	2.291	192	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	H(C[6]N[6,6]C[6])	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>,1|O<2>,2|C<4>}	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]N[6,6]C[6])	125.9470	0.000	1	120.1105	3.283	45	119.4398	2.291	192	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	H(C[6]N[6,6]C[6])	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|N<2>,1|N<3>,3|H<1>}	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]N[6,6]C[6])	119.8505	0.172	2	120.1105	3.283	45	119.4398	2.291	192	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	H(C[6]N[6,6]C[6])	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<4>,1|O<1>,2|C<3>,2|H<1>}	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]N[6,6]C[6])	119.0170	0.000	1	120.1105	3.283	45	119.4398	2.291	192	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	H(C[6]N[6,6]C[6])	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<4>,2|C<3>,3|H<1>}	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]N[6,6]C[6])	119.8670	1.445	24	120.1105	3.283	45	119.4398	2.291	192	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	H(C[6]N[6,6]C[6])	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<4>,2|H<1>,3|C<3>}	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]N[6,6]C[6])	118.9630	0.000	1	120.1105	3.283	45	119.4398	2.291	192	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	H(C[6]N[6,6]C[6])	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>,2|C<3>}	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|O<2>,2|C<3>}	H(C[6]N[6,6]C[6])	120.0825	0.364	4	120.1105	3.283	45	119.4398	2.291	192	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	H(C[6]N[6,6]C[6])	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>,2|C<3>}	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|O<3>,2|C<3>}	H(C[6]N[6,6]C[6])	119.8290	0.000	1	120.1105	3.283	45	119.4398	2.291	192	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	H(C[6]N[6,6]C[6])	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]N[6,6]C[6])	119.0140	0.513	2	120.1105	3.283	45	119.4398	2.291	192	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	H(C[6]N[6,6]C[6])	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,4|C<3>}	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]N[6,6]C[6])	119.2110	0.000	1	120.1105	3.283	45	119.4398	2.291	192	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	H(C[6]N[6,6]C[6])	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|N<3>,2|C<3>}	H(C[6]N[6,6]C[6])	120.5660	0.000	1	120.1105	3.283	45	119.4398	2.291	192	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	H(C[6]N[6,6]C[6])	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|N<3>,2|H<1>,3|C<3>}	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]N[6,6]C[6])	119.1580	0.000	1	120.1105	3.283	45	119.4398	2.291	192	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	H(C[6]N[6,6]C[6])	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|N<3>,2|H<1>,3|C<3>}	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]N[6,6]C[6])	124.8340	0.000	1	120.1105	3.283	45	119.4398	2.291	192	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	H(C[6]N[6,6]C[6])	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|Rh<9>,1|H<1>,2|C<3>,2|C<4>}	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]N[6,6]C[6])	119.3900	0.000	1	120.1105	3.283	45	119.4398	2.291	192	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]N[6,6]H)(C[6]N[6]H)(H)	H(C[6]N[6,6]C[6])	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<4>,1|N<2>,1|N<4>,3|H<1>}	C[6](C[6]N[6,6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>}	H(C[6]N[6,6]C[6])	119.7790	0.000	1	120.2930	0.528	2	119.4398	2.291	192	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]N[6,6]H)(C[6]N[6]H)(H)	H(C[6]N[6,6]C[6])	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]N[6,6]H)(C[6]N[6]H)(H){1|Fe<6>,2|C<3>}	H(C[6]N[6,6]C[6])	120.8070	0.000	1	120.2930	0.528	2	119.4398	2.291	192	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6,6]C[6,6]Ga[6])(C[6]C[6]H)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	H(C[6]N[6,6]C[6])	C[6](N[6,6]C[6,6]Ga[6])(C[6]C[6]H)(H){2|Cl<1>,1|C<3>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|Ga<4>,1|C<3>,1|H<1>}	H(C[6]N[6,6]C[6])	119.4430	0.206	2	119.0365	0.239	4	119.4398	2.291	192	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6,6]C[6,6]Ga[6])(C[6]C[6]H)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	H(C[6]N[6,6]C[6])	C[6](N[6,6]C[6,6]Ga[6])(C[6]C[6]H)(H){2|Cl<1>,1|C<3>,1|C<4>,1|H<1>,2|N<3>}	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|Ga<5>,1|C<3>,1|H<1>}	H(C[6]N[6,6]C[6])	118.6300	0.112	2	119.0365	0.239	4	119.4398	2.291	192	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6,6]C[6,6]Ge[6])(C[6]C[6]H)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	H(C[6]N[6,6]C[6])	C[6](N[6,6]C[6,6]Ge[6])(C[6]C[6]H)(H){1|B<4>,1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|Ge<4>,1|C<3>,1|H<1>}	H(C[6]N[6,6]C[6])	118.9460	0.000	1	118.8622	0.489	4	119.4398	2.291	192	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6,6]C[6,6]Ge[6])(C[6]C[6]H)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	H(C[6]N[6,6]C[6])	C[6](N[6,6]C[6,6]Ge[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>,2|N<3>}	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|Ge<3>,1|C<3>,1|H<1>}	H(C[6]N[6,6]C[6])	118.2340	0.000	1	118.8622	0.489	4	119.4398	2.291	192	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6,6]C[6,6]Ge[6])(C[6]C[6]H)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	H(C[6]N[6,6]C[6])	C[6](N[6,6]C[6,6]Ge[6])(C[6]C[6]H)(H){1|Cl<1>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|Ge<3>,1|C<3>,1|H<1>}	H(C[6]N[6,6]C[6])	118.4570	0.000	1	118.8622	0.489	4	119.4398	2.291	192	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6,6]C[6,6]Ge[6])(C[6]C[6]H)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	H(C[6]N[6,6]C[6])	C[6](N[6,6]C[6,6]Ge[6])(C[6]C[6]H)(H){1|Cl<1>,1|Cu<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|Ge<4>,1|C<3>,1|H<1>}	H(C[6]N[6,6]C[6])	119.8120	0.000	1	118.8622	0.489	4	119.4398	2.291	192	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6,6]C[6,6]In[6])(C[6]C[6]H)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	H(C[6]N[6,6]C[6])	C[6](N[6,6]C[6,6]In[6])(C[6]C[6]H)(H){3|Cl<1>,1|C<3>,1|C<4>,1|H<1>,1|N<3>,1|O<3>}	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|In<6>,1|C<3>,1|H<1>}	H(C[6]N[6,6]C[6])	118.6950	0.000	1	118.5250	0.032	3	119.4398	2.291	192	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6,6]C[6,6]In[6])(C[6]C[6]H)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	H(C[6]N[6,6]C[6])	C[6](N[6,6]C[6,6]In[6])(C[6]C[6]H)(H){3|Cl<1>,1|C<3>,1|H<1>,1|O<2>,2|N<3>}	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|In<6>,1|C<3>,1|H<1>}	H(C[6]N[6,6]C[6])	118.4400	0.143	2	118.5250	0.032	3	119.4398	2.291	192	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6,6]C[6,6]Nb[6])(C[6]C[6]H)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	H(C[6]N[6,6]C[6])	C[6](N[6,6]C[6,6]Nb[6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,5|O<2>}	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|Nb<6>,1|C<3>,1|H<1>}	H(C[6]N[6,6]C[6])	118.3310	0.000	1	118.3310	0.000	1	119.4398	2.291	192	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6,6]C[6,6]O[6,6])(C[6]C[6]H)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	H(C[6]N[6,6]C[6])	C[6](N[6,6]C[6,6]O[6,6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,3|C<4>}	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<3>}	H(C[6]N[6,6]C[6])	119.9290	0.000	1	119.9290	0.000	1	119.4398	2.291	192	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6,6]C[6,6]S[6])(C[6]C[6]H)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]C)(H)	H(C[6]N[6,6]C[6])	C[6](N[6,6]C[6,6]S[6])(C[6]C[6]H)(H){1|C<4>,1|N<2>,2|C<3>,2|O<1>}	C[6](C[6]N[6,6]H)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|S<4>}	H(C[6]N[6,6]C[6])	119.3540	0.000	1	119.3540	0.000	1	119.4398	2.291	192	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6,6]C[6,6a]C[6,6])(C[6]C[6]H)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	H(C[6]N[6,6]C[6])	C[6](N[6,6]C[6,6a]C[6,6])(C[6]C[6]H)(H){1|H<1>,4|C<3>}	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]N[6,6]C[6])	119.4525	0.250	2	119.4525	0.062	2	119.4398	2.291	192	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6,6]Ge[5,6]C[6,6])(C[6]C[6]H)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	H(C[6]N[6,6]C[6])	C[6](N[6,6]Ge[5,6]C[6,6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|N<3>,1|N<4>}	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|Ge<3>,1|C<3>,1|H<1>}	H(C[6]N[6,6]C[6])	118.7080	0.000	1	118.7970	0.016	2	119.4398	2.291	192	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6,6]Ge[5,6]C[6,6])(C[6]C[6]H)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H)	H(C[6]N[6,6]C[6])	C[6](N[6,6]Ge[5,6]C[6,6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,2|N<3>}	C[6](C[6]N[6,6]H)(C[6]C[6]H)(H){1|Ge<3>,1|C<3>,1|H<1>}	H(C[6]N[6,6]C[6])	118.8860	0.000	1	118.7970	0.016	2	119.4398	2.291	192	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6,6a]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6,6a]C[6,6a]C[6a])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6,6a]H)(H)	H(C[6]N[6,6a]C[6])	C[6](N[6,6a]C[6,6a]C[6a])(C[6]C[6,6a]H)(H){1|H<1>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6,6a]H)(H){1|H<1>,4|C<3>}	H(C[6]N[6,6a]C[6])	127.9200	0.000	1	127.9200	0.000	1	127.9200	0.000	1	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6,6a]C[6,6a,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6,6a]H)(H)	H(C[6]N[6,6a]C[6])	C[6](N[6,6a]C[6,6a,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,4|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6,6a]H)(H){3|C<3>}	H(C[6]N[6,6a]C[6])	123.9860	0.000	1	123.9860	0.000	1	119.5695	1.363	21	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6,6a]C[6,6a]2)(C[6]C[6]H)(H)	C[6](C[6]N[6,6a]H)(C[6]C[6]H)(H)	H(C[6]N[6,6a]C[6])	C[6](N[6,6a]C[6,6a]2)(C[6]C[6]H)(H){1|H<1>,1|N<2>,3|C<3>}	C[6](C[6]N[6,6a]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]N[6,6a]C[6])	119.6390	0.000	1	119.6390	0.000	1	119.5695	1.363	21	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6,6a]C[6,6a]B[6a])(C[6]C[6]H)(H)	C[6](C[6]N[6,6a]H)(C[6]C[6]C)(H)	H(C[6]N[6,6a]C[6])	C[6](N[6,6a]C[6,6a]B[6a])(C[6]C[6]H)(H){3|C<3>,3|C<4>}	C[6](C[6]N[6,6a]H)(C[6]C[6]C)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]N[6,6a]C[6])	118.5090	0.191	2	118.5090	0.036	2	119.5695	1.363	21	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6,6a]C[6,6a]B[6a])(C[6]C[6]H)(H)	C[6](C[6]N[6,6a]H)(C[6]C[6]H)(H)	H(C[6]N[6,6a]C[6])	C[6](N[6,6a]C[6,6a]B[6a])(C[6]C[6]H)(H){1|H<1>,2|C<4>,3|C<3>}	C[6](C[6]N[6,6a]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|C<4>}	H(C[6]N[6,6a]C[6])	118.6320	0.000	1	118.8090	0.063	2	119.5695	1.363	21	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6,6a]C[6,6a]B[6a])(C[6]C[6]H)(H)	C[6](C[6]N[6,6a]H)(C[6]C[6]H)(H)	H(C[6]N[6,6a]C[6])	C[6](N[6,6a]C[6,6a]B[6a])(C[6]C[6]H)(H){1|H<1>,2|F<1>,3|C<3>}	C[6](C[6]N[6,6a]H)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]N[6,6a]C[6])	118.9860	0.000	1	118.8090	0.063	2	119.5695	1.363	21	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]N[6,6a]H)(C[6]C[6]H)(H)	H(C[6]N[6,6a]C[6])	C[6](N[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|O<2>,2|C<3>}	C[6](C[6]N[6,6a]H)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	H(C[6]N[6,6a]C[6])	119.2560	0.000	1	119.4158	0.033	13	119.5695	1.363	21	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]N[6,6a]H)(C[6]C[6]H)(H)	H(C[6]N[6,6a]C[6])	C[6](N[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,3|C<3>}	C[6](C[6]N[6,6a]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]N[6,6a]C[6])	119.1790	0.000	1	119.4158	0.033	13	119.5695	1.363	21	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]N[6,6a]H)(C[6]C[6]H)(H)	H(C[6]N[6,6a]C[6])	C[6](N[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>,2|C<3>}	C[6](C[6]N[6,6a]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]N[6,6a]C[6])	119.8850	0.000	1	119.4158	0.033	13	119.5695	1.363	21	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]N[6,6a]H)(C[6]C[6]H)(H)	H(C[6]N[6,6a]C[6])	C[6](N[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|O<1>,3|C<3>}	C[6](C[6]N[6,6a]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]N[6,6a]C[6])	119.4330	0.184	2	119.4158	0.033	13	119.5695	1.363	21	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]N[6,6a]H)(C[6]C[6]H)(H)	H(C[6]N[6,6a]C[6])	C[6](N[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,4|C<3>}	C[6](C[6]N[6,6a]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]N[6,6a]C[6])	119.3337	0.071	3	119.4158	0.033	13	119.5695	1.363	21	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]N[6,6a]H)(C[6]C[6]H)(H)	H(C[6]N[6,6a]C[6])	C[6](N[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,4|C<3>}	C[6](C[6]N[6,6a]H)(C[6]C[6]H)(H){3|C<3>}	H(C[6]N[6,6a]C[6])	119.4320	0.122	2	119.4158	0.033	13	119.5695	1.363	21	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]N[6,6a]H)(C[6]C[6]H)(H)	H(C[6]N[6,6a]C[6])	C[6](N[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){2|H<1>,3|C<3>}	C[6](C[6]N[6,6a]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]N[6,6a]C[6])	119.4517	0.058	3	119.4158	0.033	13	119.5695	1.363	21	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6,6a]C[6,6a]Ge[6a])(C[6]C[6]H)(H)	C[6](C[6]N[6,6a]H)(C[6]C[6]H)(H)	H(C[6]N[6,6a]C[6])	C[6](N[6,6a]C[6,6a]Ge[6a])(C[6]C[6]H)(H){1|Mo<9>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]N[6,6a]H)(C[6]C[6]H)(H){1|Ge<3>,1|C<3>,1|H<1>}	H(C[6]N[6,6a]C[6])	118.9460	0.000	1	118.9460	0.000	1	119.5695	1.363	21	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H)	C[6](C[6]N[6,6a]H)(C[6]C[6]H)(H)	H(C[6]N[6,6a]C[6])	C[6](N[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H){1|H<1>,1|N<2>,3|C<3>}	C[6](C[6]N[6,6a]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]N[6,6a]C[6])	121.3460	0.000	1	121.3460	0.000	1	119.5695	1.363	21	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Ru)(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6,6a]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Ru)(C[6]C[6,6]H)(H){3|C<3>}	C[6](C[6,6]C[6,6,6a]C[6])(C[6]N[6]H)(H){1|Ru<9>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.3870	0.008	2	118.3870	0.000	2	118.3870	0.000	2	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Fe)(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a,6a]C[6a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Fe)(C[6]C[6,6a]H)(H){3|C<3>}	C[6](C[6,6a]C[6,6a,6a]C[6a])(C[6]N[6]H)(H){1|Fe<6>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.6600	0.081	2	118.6600	0.006	2	119.2756	3.501	7	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Mn)(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a,6a]C[6a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Mn)(C[6]C[6,6a]H)(H){3|C<3>}	C[6](C[6,6a]C[6,6a,6a]C[6a])(C[6]N[6]H)(H){1|Mn<6>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.4575	0.361	2	118.4575	0.131	2	119.2756	3.501	7	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Os)(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a,6a]C[6a,6a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Os)(C[6]C[6,6a]H)(H){3|C<3>}	C[6](C[6,6a]C[6,6a,6a]C[6a,6a])(C[6]N[6]H)(H){1|Os<6>,4|C<3>}	H(C[6]C[6]N[6])	118.6010	0.288	2	118.6010	0.083	2	119.2756	3.501	7	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6a]C[6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6a]C[6])(C[6]C[6,6a]H)(H){1|H<1>,5|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(H){1|C<4>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	123.4920	0.000	1	123.4920	0.000	1	119.2756	3.501	7	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](N[6]C[6,6a]Cu)(C[6]C[6]Br)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(Br)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Cu)(C[6]C[6]Br)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(Br){1|Cu<4>,2|C<3>}	H(C[6]C[6]N[6])	119.0121	0.466	10	119.0121	0.217	10	119.0121	0.217	10	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](N[6]C[6,6a]Zn)(C[6]C[6]Cl)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(Cl)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Zn)(C[6]C[6]Cl)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(Cl){1|Zn<5>,2|C<3>}	H(C[6]C[6]N[6])	118.3630	0.000	1	118.3630	0.000	1	118.3630	0.000	1	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:F-1:	C[6]-3:	C[6](N[6]C[5]C[6])(C[6]C[6]F)(H)	C[6](C[6]N[6]H)(C[6]N[6]O)(F)	H(C[6]C[6]N[6])	C[6](N[6]C[5]C[6])(C[6]C[6]F)(H){1|C<4>,1|H<1>,1|N<2>,1|O<2>,2|O<1>}	C[6](C[6]N[6]H)(C[6]N[6]O)(F){1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	118.5690	0.000	1	118.5690	0.000	1	119.8591	0.238	17	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:F-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]F)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(F)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]F)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(F){1|Co<6>,2|C<3>}	H(C[6]C[6]N[6])	120.0340	0.000	1	120.0340	0.000	1	119.8591	0.238	17	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:F-1:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]F)(H)	C[6](C[6]N[6]H)2(F)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]F)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]N[6]H)2(F){1|Ir<6>,1|C<3>}	H(C[6]C[6]N[6])	120.4205	0.118	2	120.4205	0.014	2	119.8591	0.238	17	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:F-1:	C[6]-3:	C[6](N[6]C[6]Os)(C[6]C[6]F)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(F)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Os)(C[6]C[6]F)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(F){1|Os<9>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	120.1350	0.000	1	120.1350	0.000	1	119.8591	0.238	17	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:F-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]F)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(F)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]F)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(F){1|Ru<9>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	120.0516	0.134	5	120.0516	0.018	5	119.8591	0.238	17	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:F-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]F)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(F)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]F)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(F){1|Zn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.6470	0.109	3	119.8105	0.043	6	119.8591	0.238	17	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:F-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]F)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(F)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]F)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(F){1|Zn<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	120.0650	0.000	1	119.8105	0.043	6	119.8591	0.238	17	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:F-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]F)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(F)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]F)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(F){1|Zn<6>,1|C<3>,1|F<1>}	H(C[6]C[6]N[6])	119.9285	0.127	2	119.8105	0.043	6	119.8591	0.238	17	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:F-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]F)(H)	C[6](C[6]N[6]H)(C[6]N[6]N)(F)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]F)(H){1|O<1>,2|N<3>}	C[6](C[6]N[6]H)(C[6]N[6]N)(F){1|Zn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.9040	0.000	1	118.9040	0.000	1	119.8591	0.238	17	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]B[3,3,5,3x6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]B[3,3,5,3x6]C[6])(C[6]C[6]H)(H){1|B<5>,1|C<3>,1|C<4>,2|B<6>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	120.2200	0.000	1	121.5580	11.115	3	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]B[3,3,5,3x6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]B[3,3,5,3x6]C[6])(C[6]C[6]H)(H){1|C<3>,3|B<6>,3|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.1010	0.000	1	121.5580	11.115	3	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]B[3,3,5,3x6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]B[3,3,5,3x6]C[6])(C[6]C[6]H)(H){1|Rh<6>,1|B<5>,1|C<3>,1|H<2>,2|B<6>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<6>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	125.3530	0.000	1	121.5580	11.115	3	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]B[3,3,5,4x6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]B[3,3,5,4x6]C[6])(C[6]C[6]H)(H){1|C<2>,1|C<3>,2|H<1>,3|B<6>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6937	0.193	4	120.0605	3.971	11	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]B[3,3,5,4x6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]B[3,3,5,4x6]C[6])(C[6]C[6]H)(H){1|Ni<9>,1|B<5>,1|C<3>,2|B<6>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.1860	0.082	2	120.0605	3.971	11	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]B[3,3,5,4x6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]B[3,3,5,4x6]C[6])(C[6]C[6]H)(H){1|Rh<8>,1|C<3>,1|C<4>,1|H<1>,3|B<6>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.0600	0.000	1	120.0605	3.971	11	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]B[3,3,5,4x6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]B[3,3,5,4x6]C[6])(C[6]C[6]H)(H){1|Rh<8>,1|C<3>,2|H<1>,3|B<6>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	121.5125	0.821	2	120.0605	3.971	11	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]B[3,3,5,4x6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]B[3,3,5,4x6]C[6])(C[6]C[6]H)(H){1|Rh<9>,1|C<3>,2|H<1>,3|B<6>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	123.2165	1.333	2	120.0605	3.971	11	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]B[3,3,5,6,6a,6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]B[3,3,5,6,6a,6a]C[6])(C[6]C[6]H)(H){1|B<5>,1|C<3>,2|B<6>,3|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.2100	0.000	1	119.2100	0.000	1	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]B[3a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]B[3a]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,4|C<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.1460	0.006	2	118.1460	0.000	2	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]B[3x3,3x5,12x6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]B[3x3,3x5,12x6]C[6])(C[6]C[6]H)(H){1|Co<10>,1|H<1>,2|C<3>,4|B<6>}	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|B<6>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	119.1660	0.062	2	119.1660	0.004	2	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]B[3x3,5,4x6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]B[3x3,5,4x6]C[6])(C[6]C[6]H)(H){1|Rh<6>,1|C<3>,1|H<2>,2|H<1>,3|B<6>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.3140	0.000	1	120.7447	3.478	3	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]B[3x3,5,4x6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]B[3x3,5,4x6]C[6])(C[6]C[6]H)(H){1|Rh<7>,1|C<3>,1|H<2>,2|H<1>,3|B<6>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	121.4600	1.971	2	120.7447	3.478	3	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]B[3x3,5,5,6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]B[3x3,5,5,6,6]C[6])(C[6]C[6]H)(H){1|B<5>,1|B<7>,1|C<3>,2|B<6>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.2380	0.052	2	119.2380	0.003	2	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]B[3x3,5,5,7x6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]B[3x3,5,5,7x6]C[6])(C[6]C[6]H)(H){1|B<5>,1|C<3>,1|C<5>,2|B<6>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.0130	0.051	2	119.0130	0.003	2	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]B[3x6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]B[3x6]C[6])(C[6]C[6]H)(H){1|C<3>,2|H<1>,3|C<4>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	120.2615	1.729	4	119.5019	2.012	8	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]B[3x6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]B[3x6]C[6])(C[6]C[6]H)(H){1|C<4>,2|H<1>,3|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4115	0.149	2	119.5019	2.012	8	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]B[3x6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]B[3x6]C[6])(C[6]C[6]H)(H){2|H<1>,4|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.0730	0.190	2	119.5019	2.012	8	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]B[3x6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]B[3x6]C[6])(C[6]C[6]H)(H){1|H<1>,1|O<2>,4|C<3>}	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	116.7660	0.344	2	116.7660	0.118	2	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]B[3x6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]B[3x6a]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,4|C<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3257	0.078	4	118.3257	0.006	4	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]B[4x3,4x5,4x6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]B[4x3,4x5,4x6]C[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>,4|B<6>}	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|B<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6750	0.198	3	118.6750	0.039	3	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]B[5]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]B[5]C[6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|O<2>}	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|B<3>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.3400	0.236	2	118.3400	0.056	2	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]B[5]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]B[5]C[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<2>,3|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8615	0.161	2	118.9525	0.021	6	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]B[5]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]B[5]C[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.9300	0.146	2	118.9525	0.021	6	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]B[5]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]B[5]C[6])(C[6]C[6]H)(H){1|Cl<1>,1|C<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.0660	0.127	2	118.9525	0.021	6	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]B[5]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]B[5]C[6])(C[6]C[6]H)(H){1|C<3>,1|N<3>,2|H<1>,2|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.2710	0.300	4	118.9880	0.072	22	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]B[5]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]B[5]C[6])(C[6]C[6]H)(H){1|H<1>,2|C<4>,3|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4150	0.000	1	118.9880	0.072	22	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]B[5]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]B[5]C[6])(C[6]C[6]H)(H){1|N<2>,2|H<1>,3|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.0309	0.179	8	118.9880	0.072	22	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]B[5]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]B[5]C[6])(C[6]C[6]H)(H){2|H<1>,4|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8879	0.183	9	118.9880	0.072	22	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]B[5]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]B[5]C[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2205	0.175	2	118.2570	0.014	4	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]B[5]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]B[5]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,4|C<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2935	0.078	2	118.2570	0.014	4	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]B[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]B[5]N[6])(C[6]C[6]H)(H){1|B<3>,1|C<3>,1|H<1>,2|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<3>,1|H<1>,1|N<3>}	H(C[6]C[6]N[6])	120.0530	0.000	1	120.0530	0.000	1	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]B[5a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]B[5a]C[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,2|C<4>,2|O<2>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.1322	0.094	4	119.0803	0.063	10	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]B[5a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]B[5a]C[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,2|C<3>,2|O<2>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.2362	0.079	4	119.0803	0.063	10	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]B[5a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]B[5a]C[6])(C[6]C[6]H)(H){1|H<1>,2|O<2>,3|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6645	0.264	2	119.0803	0.063	10	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]B[5a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]B[5a]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,2|H<1>,2|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	122.6272	1.656	6	122.6272	2.743	6	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]B[5a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]B[5a]C[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,3|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|B<3>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3935	0.182	2	118.3935	0.033	2	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]B[5x3,5x5,20x6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]B[5x3,5x5,20x6]C[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>,5|B<6>}	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|B<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.9802	1.421	4	119.9802	2.020	4	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]B[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]B[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,4|C<4>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.8335	0.074	2	118.6598	0.141	14	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]B[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]B[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,2|H<1>,3|C<4>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7980	0.038	2	118.6598	0.141	14	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]B[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]B[6,6]C[6])(C[6]C[6]H)(H){2|H<1>,4|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7974	0.162	10	118.6598	0.141	14	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]B[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]B[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|N<3>,2|C<4>,2|H<1>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.0715	0.042	2	118.0715	0.002	2	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]B[6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]B[6]C[6])(C[6]C[6]H)(H){1|H<1>,4|C<3>}	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|B<3>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.6732	0.148	4	118.6732	0.022	4	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]B[6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]B)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]B[6]C[6])(C[6]C[6]H)(H){1|B<3>,1|C<3>,1|H<1>,2|O<2>}	C[6](C[6]C[6]B)(C[6]N[6]H)(H){1|B<3>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.0230	0.000	1	119.0230	0.000	1	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]B[6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]B[6]C[6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,3|C<4>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7223	0.287	4	118.7223	0.083	4	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]B[6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]B[6]C[6])(C[6]C[6]H)(H){1|Cl<1>,2|H<1>,3|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8960	0.267	2	118.7348	0.222	9	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]B[6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]B[6]C[6])(C[6]C[6]H)(H){2|H<1>,3|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<3>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5575	0.659	4	118.7348	0.222	9	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]B[6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]B[6]C[6])(C[6]C[6]H)(H){2|H<1>,4|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8637	0.298	3	118.7348	0.222	9	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]B[6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]B[6]C[6])(C[6]C[6]H)(H){1|C<3>,1|N<3>,2|C<4>,2|H<1>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.1060	0.054	2	118.0635	0.038	6	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]B[6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]B[6]C[6])(C[6]C[6]H)(H){1|C<3>,2|H<1>,3|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.9515	0.380	2	118.0635	0.038	6	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]B[6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]B[6]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>,2|C<4>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.1330	0.071	2	118.0635	0.038	6	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]B[6a,6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]B[6a,6a]C[6])(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|C<4>,1|H<1>,2|O<2>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	120.0940	0.265	4	120.0940	0.070	4	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]B[6a,6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]B[6a,6a]C[6])(C[6]C[6]H)(H){2|H<1>,4|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8053	0.361	3	118.8053	0.130	3	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]B[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]B[6a]C[6])(C[6]C[6]H)(H){1|C<3>,1|N<3>,2|H<1>,2|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.2933	0.555	6	119.1962	0.413	16	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]B[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]B[6a]C[6])(C[6]C[6]H)(H){1|C<3>,2|H<1>,2|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<3>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.1689	0.798	8	119.1962	0.413	16	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]B[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]B[6a]C[6])(C[6]C[6]H)(H){2|C<3>,2|H<1>,2|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.0145	0.252	2	119.1962	0.413	16	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[4]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[4]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|O<2>,2|C<3>}	H(C[6]C[6]N[6])	119.5550	0.000	1	121.6380	8.136	3	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[4]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[4]C[6])(C[6]C[6]H)(H){2|H<1>,3|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]N[6])	124.8890	0.000	1	121.6380	8.136	3	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[4]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[4]C[6])(C[6]C[6]H)(H){2|H<1>,3|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){3|C<3>}	H(C[6]C[6]N[6])	120.4700	0.000	1	121.6380	8.136	3	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[4]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[4]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>,2|C<4>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	118.7875	0.023	2	118.8713	0.021	3	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[4]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[4]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]N[6])	119.0390	0.000	1	118.8713	0.021	3	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[4]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[4]C[6])(C[6]C[6]H)(H){1|H<1>,1|O<2>,3|C<3>}	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]N[6])	119.4805	0.373	2	119.4805	0.139	2	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[4]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[4]C[6])(C[6]C[6]H)(H){1|H<1>,4|C<3>}	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|H<1>,4|C<3>}	H(C[6]C[6]N[6])	119.8345	0.145	2	119.8345	0.021	2	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[5,6]Ag)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[5,6]Ag)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Ag<4>,2|C<3>}	H(C[6]C[6]N[6])	118.2245	0.243	2	118.2245	0.059	2	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[5,6]Ag)(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[5,6]Ag)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[6]N[5,6]H)(C[6]N[6]H)(H){1|Ag<5>,1|C<3>,1|N<2>}	H(C[6]C[6]N[6])	118.2105	0.087	2	118.2105	0.008	2	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[5,6]C)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[5,6]C)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|C<4>,2|C<3>}	H(C[6]C[6]N[6])	119.0390	0.025	2	119.0390	0.001	2	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[5,6]C)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]N[5])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[5,6]C)(C[6]C[6]H)(H){1|Fe<10>,1|N<3>,2|C<4>}	C[6](C[6]C[5,6]N[5])(C[6]N[6]H)(H){1|Fe<10>,1|C<3>,4|C<4>}	H(C[6]C[6]N[6])	117.6580	0.000	1	117.6580	0.000	1	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[5,6]Co)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[5,6]Co)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Co<6>,2|C<3>}	H(C[6]C[6]N[6])	121.2395	4.252	6	121.2395	18.082	6	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[5,6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[5,6]Cu)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	118.7180	0.000	1	118.7473	0.080	12	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[5,6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[5,6]Cu)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Cu<3>,2|C<3>}	H(C[6]C[6]N[6])	118.8045	0.045	2	118.7473	0.080	12	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[5,6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[5,6]Cu)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Cu<4>,2|C<3>}	H(C[6]C[6]N[6])	118.7379	0.329	9	118.7473	0.080	12	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[5,6]Cu)(C[6]C[6]H)(H)	C[6](C[6]N[5,6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[5,6]Cu)(C[6]C[6]H)(H){3|N<3>}	C[6](C[6]N[5,6]N)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|N<2>}	H(C[6]C[6]N[6])	118.0755	0.897	2	118.0755	0.805	2	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	119.4980	0.000	1	119.2522	0.173	5	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]N[6])	118.8090	0.171	2	119.2522	0.173	5	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]N[6])	119.5725	0.057	2	119.2522	0.173	5	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[5,6]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[5,6]Ir)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	118.9335	0.076	2	118.9335	0.006	2	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[5,6]Ni)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[5,6]Ni)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	118.8120	0.102	2	120.3233	7.540	7	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[5,6]Ni)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[5,6]Ni)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Ni<6>,2|C<3>}	H(C[6]C[6]N[6])	120.9278	3.116	5	120.3233	7.540	7	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[5,6]Pd)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[5,6]Pd)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<4>}	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|N<2>}	H(C[6]C[6]N[6])	118.8830	0.323	3	118.5960	0.125	10	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[5,6]Pd)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[5,6]Pd)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	118.7630	0.177	2	118.5960	0.125	10	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[5,6]Pd)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[5,6]Pd)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Pd<4>,2|C<3>}	H(C[6]C[6]N[6])	118.3570	0.272	5	118.5960	0.125	10	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[5,6]Pt)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[5,6]Pt)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	119.1855	0.101	2	118.8183	0.114	6	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[5,6]Pt)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[5,6]Pt)(C[6]C[6]H)(H){1|Ru<10>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Ru<10>,1|Pt<4>,2|C<4>}	H(C[6]C[6]N[6])	118.6347	0.227	4	118.8183	0.114	6	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[5,6]Rh)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[5,6]Rh)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Rh<4>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	118.4620	0.000	1	119.0227	0.079	10	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[5,6]Rh)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[5,6]Rh)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Rh<4>,2|C<3>}	H(C[6]C[6]N[6])	119.2165	0.173	2	119.0227	0.079	10	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[5,6]Rh)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[5,6]Rh)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Rh<6>,2|C<3>}	H(C[6]C[6]N[6])	119.0474	0.220	7	119.0227	0.079	10	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[5,6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[5,6]Ru)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	118.3775	0.145	2	118.9694	0.150	17	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[5,6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[5,6]Ru)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Ru<6>,2|C<3>}	H(C[6]C[6]N[6])	118.8985	0.407	6	118.9694	0.150	17	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[5,6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[5,6]Ru)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Ru<8>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	118.9603	0.148	4	118.9694	0.150	17	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[5,6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[5,6]Ru)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Ru<8>,2|C<3>}	H(C[6]C[6]N[6])	119.2984	0.228	5	118.9694	0.150	17	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[5,6]S)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]O)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[5,6]S)(C[6]C[6]H)(H){1|Fe<10>,1|O<1>,2|C<4>}	C[6](C[6]C[5,6]O)(C[6]N[6]H)(H){1|Fe<10>,1|S<4>,2|C<4>}	H(C[6]C[6]N[6])	118.3605	0.400	2	118.3605	0.160	2	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[5,6]Zn)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[5,6]Zn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Zn<4>,2|C<3>}	H(C[6]C[6]N[6])	119.3095	0.284	2	118.8988	0.272	4	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[5,6]Zn)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[5,6]Zn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Zn<6>,2|C<3>}	H(C[6]C[6]N[6])	118.4880	0.247	2	118.8988	0.272	4	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[5]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[5]C[6])(C[6]C[6]H)(H){1|H<1>,4|C<3>}	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H){1|H<1>,1|S<2>,3|C<3>}	H(C[6]C[6]N[6])	119.2940	0.392	2	119.2940	0.153	2	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[5]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[5]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<2>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]N[6])	120.0290	0.145	4	122.4941	10.671	10	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[5]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[5]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<2>,3|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<4>,2|C<3>}	H(C[6]C[6]N[6])	125.9270	2.321	2	122.4941	10.671	10	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[5]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[5]C[6])(C[6]C[6]H)(H){1|N<2>,2|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]N[6])	120.1285	0.021	2	122.4941	10.671	10	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[5]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[5]C[6])(C[6]C[6]H)(H){2|H<1>,3|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]N[6])	126.3570	1.294	2	122.4941	10.671	10	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[5]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[5]C[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]N[6])	118.9525	0.564	2	118.9525	0.318	2	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[5]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[5]C[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>,1|S<1>,2|C<4>}	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|O<2>}	H(C[6]C[6]N[6])	119.1590	0.000	1	119.1590	0.000	1	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[5]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[5]C[6])(C[6]C[6]H)(H){2|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|C<4>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	120.2015	0.193	2	120.2015	0.037	2	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[5]C[6])(C[6]C[6]H)(H)	C[6](C[6]N[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[5]C[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<1>,1|O<2>,2|N<3>}	C[6](C[6]N[6]H)(C[6]N[6]N)(H){1|B<4>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	124.1030	0.000	1	119.1892	0.944	34	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[5]C[6])(C[6]C[6]H)(H)	C[6](C[6]N[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[5]C[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<1>,1|O<2>,2|N<3>}	C[6](C[6]N[6]H)(C[6]N[6]N)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	119.0403	0.443	33	119.1892	0.944	34	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[5a,6]B)(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[5a,6]B)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H){1|B<4>,2|C<3>}	H(C[6]C[6]N[6])	118.3300	0.000	1	118.6935	0.264	2	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[5a,6]B)(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[5a,6]B)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H){1|B<5>,2|C<3>}	H(C[6]C[6]N[6])	119.0570	0.000	1	118.6935	0.264	2	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[5a,6]B[5a])(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[5a,6]B[5a])(C[6]C[6]H)(H){1|H<1>,2|C<3>,3|O<2>}	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|O<2>}	H(C[6]C[6]N[6])	118.9580	0.000	1	118.9580	0.000	1	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[5a,6]C)(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[5a,6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]N[6])	119.0230	0.000	1	119.0230	0.000	1	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[5a,6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[5a,6]Cu)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H){1|Cu<4>,2|C<3>}	H(C[6]C[6]N[6])	118.2029	0.300	7	118.2130	0.078	8	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[5a,6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[5a,6]Cu)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H){1|Cu<5>,2|C<3>}	H(C[6]C[6]N[6])	118.2840	0.000	1	118.2130	0.078	8	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[5a,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[5a,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]N[6])	119.9840	0.000	1	121.0488	5.022	5	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[5a,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[5a,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]N[6])	121.3150	2.495	4	121.0488	5.022	5	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[5a,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]O)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[5a,6]H)(C[6]C[6]H)(H){1|C<3>,1|N<3>,1|O<2>}	C[6](C[6]C[5a,6]O)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]N[6])	119.3775	0.199	2	119.3775	0.039	2	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[5a,6]H)(C[6]C[6]H)(H)	C[6](C[6]N[5a,6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[5a,6]H)(C[6]C[6]H)(H){1|N<2>,2|N<3>}	C[6](C[6]N[5a,6]N)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]N[6])	118.5850	0.000	1	118.5850	0.000	1	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[5a,6]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[5a,6]Ir)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H){1|Ir<6>,2|C<3>}	H(C[6]C[6]N[6])	118.7695	0.247	2	118.2825	0.347	4	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[5a,6]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[5a,6]Ir)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H){1|Ir<7>,2|C<3>}	H(C[6]C[6]N[6])	117.7955	0.177	2	118.2825	0.347	4	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[5a,6]Li)(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[5a,6]Li)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H){1|Li<4>,2|C<3>}	H(C[6]C[6]N[6])	117.7506	0.090	7	117.7638	0.008	8	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[5a,6]Li)(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[5a,6]Li)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<4>}	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H){1|Li<4>,2|C<3>}	H(C[6]C[6]N[6])	117.8560	0.000	1	117.7638	0.008	8	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[5a,6]O)(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[5a,6]O)(C[6]C[6]H)(H){1|C<3>,2|N<3>}	C[6](C[6]C[5a,6]N)(C[6]N[6]H)(H){1|C<3>,1|N<2>,1|O<1>}	H(C[6]C[6]N[6])	118.9910	0.000	1	118.9910	0.000	1	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[5a,6]Pd)(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[5a,6]Pd)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H){1|Pd<4>,2|C<3>}	H(C[6]C[6]N[6])	118.5561	0.394	13	118.5561	0.155	13	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[5a,6]Pt)(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[5a,6]Pt)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H){1|Pt<4>,2|C<3>}	H(C[6]C[6]N[6])	118.0380	0.374	24	118.0046	0.137	28	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[5a,6]Pt)(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[5a,6]Pt)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H){1|Pt<5>,2|C<3>}	H(C[6]C[6]N[6])	118.0680	0.075	2	118.0046	0.137	28	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[5a,6]Pt)(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[5a,6]Pt)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H){1|Pt<6>,2|C<3>}	H(C[6]C[6]N[6])	117.5400	0.058	2	118.0046	0.137	28	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[5a,6]Rh)(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[5a,6]Rh)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H){1|Rh<4>,2|C<3>}	H(C[6]C[6]N[6])	118.6117	0.475	3	118.1834	0.098	21	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[5a,6]Rh)(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[5a,6]Rh)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H){1|Rh<5>,2|C<3>}	H(C[6]C[6]N[6])	118.1694	0.250	5	118.1834	0.098	21	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[5a,6]Rh)(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[5a,6]Rh)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H){1|Rh<7>,2|C<3>}	H(C[6]C[6]N[6])	118.0226	0.157	10	118.1834	0.098	21	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[5a,6]Rh)(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[5a,6]Rh)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H){1|Rh<8>,2|C<3>}	H(C[6]C[6]N[6])	118.3143	0.303	3	118.1834	0.098	21	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[5a,6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[5a,6]Ru)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H){1|Ru<7>,2|C<3>}	H(C[6]C[6]N[6])	118.2899	0.227	13	118.2767	0.057	20	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[5a,6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[5a,6]Ru)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H){1|Ru<8>,2|C<3>}	H(C[6]C[6]N[6])	118.2760	0.167	4	118.2767	0.057	20	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[5a,6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[5a,6]Ru)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5a,6]H)(C[6]N[6]H)(H){1|Ru<9>,2|C<3>}	H(C[6]C[6]N[6])	118.2203	0.432	3	118.2767	0.057	20	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[5a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[5a]C[6])(C[6]C[6]H)(H){2|H<1>,3|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]N[6])	121.8815	0.903	2	121.8815	0.815	2	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[5x3,5x5,20x6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[5x3,5x5,20x6]C[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>,5|B<6>}	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|C<3>,1|C<6>,1|H<1>}	H(C[6]C[6]N[6])	119.2097	0.052	4	119.2097	0.003	4	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6]Al)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6]Al)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Al<4>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	119.2240	0.000	1	119.0413	0.025	3	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6]Al)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6]Al)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Al<5>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	118.9340	0.000	1	119.0413	0.025	3	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6]Al)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6]Al)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Al<4>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	118.9660	0.000	1	119.0413	0.025	3	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6]C)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|C<3>,2|C<4>}	H(C[6]C[6]N[6])	119.7875	0.033	4	119.7875	0.001	4	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]O)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6]C)(C[6]C[6]H)(H){1|C<3>,1|O<1>,2|C<4>}	C[6](C[6]C[6,6]O)(C[6]N[6]H)(H){1|H<1>,3|C<4>}	H(C[6]C[6]N[6])	117.1470	0.000	1	117.1470	0.000	1	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6]Cd)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6]Cd)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Cd<6>,1|C<2>,1|C<3>}	H(C[6]C[6]N[6])	120.8480	0.000	1	120.8480	0.000	1	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6]Co)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6]Co)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Co<6>,2|C<3>}	H(C[6]C[6]N[6])	118.7187	0.320	3	118.9721	0.392	7	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6]Co)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6]Co)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Co<7>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	119.1623	0.777	4	118.9721	0.392	7	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6]Cu)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Cu<3>,2|C<3>}	H(C[6]C[6]N[6])	117.7240	0.000	1	121.0466	8.678	7	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6]Cu)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Cu<4>,2|C<3>}	H(C[6]C[6]N[6])	117.9970	0.000	1	121.0466	8.678	7	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6]Cu)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Cu<5>,2|C<3>}	H(C[6]C[6]N[6])	118.2650	0.000	1	121.0466	8.678	7	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6]Cu)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Cu<5>,1|C<2>,1|C<3>}	H(C[6]C[6]N[6])	122.8920	0.932	2	121.0466	8.678	7	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6]Cu)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Cu<5>,2|C<3>}	H(C[6]C[6]N[6])	123.7780	1.178	2	121.0466	8.678	7	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6]Fe)(C[6]C[6]H)(H)	C[6](C[6]N[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6]Fe)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6,6]H)(C[6]N[6]H)(H){1|Fe<6>,2|C<3>}	H(C[6]C[6]N[6])	118.1900	0.000	1	118.1900	0.000	1	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	120.3440	0.000	1	119.9551	0.109	8	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	119.6540	0.584	2	119.9551	0.109	8	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]N[6])	119.9978	0.144	5	119.9551	0.109	8	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6]Hg)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6]Hg)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Hg<6>,2|C<3>}	H(C[6]C[6]N[6])	118.4485	0.318	4	118.4485	0.101	4	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6]Ir)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	118.8270	0.000	1	118.9547	0.216	13	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6]Ir)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Ir<8>,2|C<3>}	H(C[6]C[6]N[6])	118.0280	0.000	1	118.9547	0.216	13	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6]Ir)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	119.0643	0.435	9	118.9547	0.216	13	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6]Ir)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|O<2>}	H(C[6]C[6]N[6])	118.7660	0.000	1	118.9547	0.216	13	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6]Ir)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Ir<8>,2|C<3>}	H(C[6]C[6]N[6])	119.2110	0.000	1	118.9547	0.216	13	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6]Mg)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6]Mg)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Mg<5>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	118.8495	0.445	2	118.6058	0.150	4	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6]Mg)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6]Mg)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Mg<5>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	118.3620	0.120	2	118.6058	0.150	4	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6]Mn)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6]Mn)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Mn<6>,2|C<3>}	H(C[6]C[6]N[6])	119.1630	0.000	1	118.6513	0.167	6	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6]Mn)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6]Mn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Mn<6>,2|C<3>}	H(C[6]C[6]N[6])	118.6568	0.310	4	118.6513	0.167	6	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6]Mn)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6]Mn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Mn<7>,2|C<3>}	H(C[6]C[6]N[6])	118.1180	0.000	1	118.6513	0.167	6	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6]Ni)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6]Ni)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Ni<4>,2|C<3>}	H(C[6]C[6]N[6])	118.0490	0.000	1	118.8800	0.230	10	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6]Ni)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6]Ni)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Ni<5>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	119.0420	0.206	5	118.8800	0.230	10	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6]Ni)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6]Ni)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	118.8852	0.599	4	118.8800	0.230	10	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6]O)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6]O)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|O<1>}	H(C[6]C[6]N[6])	119.8047	0.302	3	119.8047	0.091	3	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6]Os)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6]Os)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Os<9>,2|C<3>}	H(C[6]C[6]N[6])	118.7010	0.000	1	118.7010	0.000	1	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6]Pd)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6]Pd)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Pd<4>,2|C<3>}	H(C[6]C[6]N[6])	119.0643	0.770	4	118.9435	0.284	11	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6]Pd)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6]Pd)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	118.9267	0.575	3	118.9435	0.284	11	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6]Pd)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6]Pd)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|N<3>}	H(C[6]C[6]N[6])	118.8300	0.528	2	118.9435	0.284	11	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6]Pd)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6]Pd)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Pd<6>,1|C<3>,1|N<3>}	H(C[6]C[6]N[6])	118.8405	0.111	2	118.9435	0.284	11	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6]Pt)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6]Pt)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	118.8945	0.180	2	118.9820	0.027	4	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6]Pt)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6]Pt)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Pt<4>,2|C<3>}	H(C[6]C[6]N[6])	119.0695	0.129	2	118.9820	0.027	4	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6]Re)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6]Re)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Re<5>,2|C<3>}	H(C[6]C[6]N[6])	117.9790	0.000	1	117.9850	0.067	3	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6]Re)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6]Re)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Re<6>,2|C<3>}	H(C[6]C[6]N[6])	117.9880	0.365	2	117.9850	0.067	3	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6]Rh)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6]Rh)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Rh<5>,2|C<3>}	H(C[6]C[6]N[6])	118.1232	0.494	4	118.3193	0.249	6	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6]Rh)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6]Rh)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Rh<6>,2|C<3>}	H(C[6]C[6]N[6])	118.5480	0.000	1	118.3193	0.249	6	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6]Rh)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6]Rh)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Rh<8>,2|C<3>}	H(C[6]C[6]N[6])	118.8750	0.000	1	118.3193	0.249	6	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6]Ru)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	118.7977	0.570	3	119.0428	7.434	28	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6]Ru)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Ru<5>,2|C<3>}	H(C[6]C[6]N[6])	118.0607	0.428	18	119.0428	7.434	28	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6]Ru)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Ru<7>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	119.0810	0.000	1	119.0428	7.434	28	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6]Ru)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Ru<8>,2|C<3>}	H(C[6]C[6]N[6])	118.6460	0.000	1	119.0428	7.434	28	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6]Ru)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	119.8070	0.000	1	119.0428	7.434	28	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6]Ru)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Ru<6>,2|C<3>}	H(C[6]C[6]N[6])	125.0303	5.963	3	119.0428	7.434	28	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6]Ru)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Ru<9>,2|C<3>}	H(C[6]C[6]N[6])	119.0890	0.000	1	119.0428	7.434	28	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6]Zn)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6]Zn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Zn<6>,2|C<3>}	H(C[6]C[6]N[6])	119.1186	1.824	7	119.1186	3.328	7	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Ag)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Ag)(C[6]C[6]H)(H){1|C<2>,2|C<3>}	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H){1|Ag<4>,2|C<3>}	H(C[6]C[6]N[6])	118.7265	2.367	2	118.7265	5.601	2	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Ag)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Ag)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ag<3>,2|C<3>}	H(C[6]C[6]N[6])	118.2482	0.954	5	118.4923	0.519	22	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Ag)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Ag)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ag<4>,2|C<3>}	H(C[6]C[6]N[6])	118.6755	0.605	15	118.4923	0.519	22	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Ag)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Ag)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ag<5>,2|C<3>}	H(C[6]C[6]N[6])	117.7280	0.403	2	118.4923	0.519	22	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Al)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Al)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Al<4>,2|C<3>}	H(C[6]C[6]N[6])	118.7250	0.260	4	119.0600	0.519	18	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Al)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Al)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Al<5>,2|C<3>}	H(C[6]C[6]N[6])	118.7823	0.293	3	119.0600	0.519	18	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Al)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Al)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Al<6>,1|C<3>,1|N<2>}	H(C[6]C[6]N[6])	119.2190	0.214	3	119.0600	0.519	18	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Al)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Al)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Al<6>,2|C<3>}	H(C[6]C[6]N[6])	119.2720	1.017	8	119.0600	0.519	18	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Au)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Au)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Au<4>,2|C<3>}	H(C[6]C[6]N[6])	119.4750	0.000	1	119.7395	0.140	2	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Au)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Au)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Au<5>,2|C<3>}	H(C[6]C[6]N[6])	120.0040	0.000	1	119.7395	0.140	2	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]B)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]B)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|B<4>,2|C<3>}	H(C[6]C[6]N[6])	117.7935	0.481	4	117.7935	0.231	4	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Ba)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Ba)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ba<8>,2|C<3>}	H(C[6]C[6]N[6])	117.8670	0.630	8	117.8670	0.396	8	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Bi)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Bi)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Bi<6>,2|C<3>}	H(C[6]C[6]N[6])	118.7503	0.232	10	118.7503	0.054	10	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]C)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]C)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H){1|C<4>,2|C<3>}	H(C[6]C[6]N[6])	120.0605	1.687	4	119.3167	1.205	12	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]C)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]C)(C[6]C[6]H)(H){3|C<3>}	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H){1|C<4>,2|C<3>}	H(C[6]C[6]N[6])	118.9447	0.446	8	119.3167	1.205	12	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]C)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]C[4])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]C)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6,6a]C[4])(C[6]N[6]H)(H){1|H<1>,2|C<3>,3|C<4>}	H(C[6]C[6]N[6])	122.1980	0.000	1	122.1980	0.000	1	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]C)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]C)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|C<4>,2|C<3>}	H(C[6]C[6]N[6])	119.1712	0.763	61	119.1712	0.582	61	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]C)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]Ir)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]C)(C[6]C[6]H)(H){1|Ir<8>,2|C<3>}	C[6](C[6]C[6,6a]Ir)(C[6]N[6]H)(H){1|C<4>,2|C<3>}	H(C[6]C[6]N[6])	118.5620	0.000	1	118.5620	0.000	1	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]C)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]Os)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]C)(C[6]C[6]H)(H){1|Os<6>,2|C<3>}	C[6](C[6]C[6,6a]Os)(C[6]N[6]H)(H){1|C<4>,2|C<3>}	H(C[6]C[6]N[6])	118.3347	0.908	8	118.3347	0.825	8	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]C)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]Pd)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]C)(C[6]C[6]H)(H){1|Pd<4>,2|C<3>}	C[6](C[6]C[6,6a]Pd)(C[6]N[6]H)(H){1|C<4>,2|C<3>}	H(C[6]C[6]N[6])	119.1080	0.000	1	119.1080	0.000	1	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Ca)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Ca)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ca<7>,2|C<3>}	H(C[6]C[6]N[6])	118.1560	0.117	4	118.1405	0.131	8	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Ca)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Ca)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ca<8>,2|C<3>}	H(C[6]C[6]N[6])	118.1250	0.540	4	118.1405	0.131	8	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Cd)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Cd)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H){1|Cd<6>,2|C<3>}	H(C[6]C[6]N[6])	118.3945	0.315	2	118.3945	0.099	2	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Cd)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Cd)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Cd<5>,2|C<3>}	H(C[6]C[6]N[6])	118.5316	0.479	5	118.4619	0.130	128	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Cd)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Cd)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Cd<6>,2|C<3>}	H(C[6]C[6]N[6])	118.4534	0.374	103	118.4619	0.130	128	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Cd)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Cd)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Cd<7>,2|C<3>}	H(C[6]C[6]N[6])	118.4397	0.238	17	118.4619	0.130	128	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Cd)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Cd)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Cd<8>,2|C<3>}	H(C[6]C[6]N[6])	118.7663	0.174	3	118.4619	0.130	128	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Cm)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Cm)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Cm<8>,2|C<3>}	H(C[6]C[6]N[6])	118.2430	0.734	2	118.2430	0.539	2	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Co)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Co)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H){1|Co<6>,2|C<3>}	H(C[6]C[6]N[6])	119.4155	0.325	2	119.4155	0.105	2	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Co)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Co)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Co<4>,2|C<3>}	H(C[6]C[6]N[6])	118.8852	1.409	13	118.6817	2.629	412	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Co)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Co)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Co<5>,2|C<3>}	H(C[6]C[6]N[6])	118.4661	0.288	10	118.6817	2.629	412	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Co)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Co)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Co<6>,2|C<3>}	H(C[6]C[6]N[6])	118.6660	1.712	359	118.6817	2.629	412	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Co)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Co)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Co<7>,2|C<3>}	H(C[6]C[6]N[6])	118.8679	0.392	28	118.6817	2.629	412	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Co)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Co)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Co<8>,2|C<3>}	H(C[6]C[6]N[6])	118.6495	0.186	2	118.6817	2.629	412	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Cr)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Cr)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H){1|Cr<6>,2|C<3>}	H(C[6]C[6]N[6])	118.8105	0.177	2	118.8105	0.032	2	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Cr)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Cr)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Cr<5>,2|C<3>}	H(C[6]C[6]N[6])	118.1250	0.000	1	118.9710	0.849	71	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Cr)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Cr)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Cr<6>,2|C<3>}	H(C[6]C[6]N[6])	118.8192	0.530	61	118.9710	0.849	71	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Cr)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Cr)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Cr<8>,1|C<3>,1|N<2>}	H(C[6]C[6]N[6])	118.7050	0.130	2	118.9710	0.849	71	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Cr)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Cr)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Cr<8>,2|C<3>}	H(C[6]C[6]N[6])	120.4906	2.004	7	118.9710	0.849	71	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]Br)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(H){1|Br<1>,2|C<3>}	C[6](C[6]C[6,6a]Br)(C[6]N[6]H)(H){1|Cu<4>,2|C<3>}	H(C[6]C[6]N[6])	118.4482	0.140	5	118.4482	0.020	5	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H){1|Cu<4>,2|C<3>}	H(C[6]C[6]N[6])	118.6955	0.302	2	118.2446	0.197	5	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(H){3|C<3>}	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H){1|Cu<5>,2|C<3>}	H(C[6]C[6]N[6])	117.9440	0.093	3	118.2446	0.197	5	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]C[6a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(H){3|C<3>}	C[6](C[6]C[6,6a]C[6a])(C[6]N[6]H)(H){1|Cu<4>,4|C<3>}	H(C[6]C[6]N[6])	118.2251	0.163	7	118.2251	0.027	7	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Cu<3>,2|C<3>}	H(C[6]C[6]N[6])	118.8805	1.057	12	118.8864	1.295	633	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Cu<4>,2|C<3>}	H(C[6]C[6]N[6])	118.6331	1.005	218	118.8864	1.295	633	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Cu<5>,2|C<3>}	H(C[6]C[6]N[6])	119.0450	1.192	370	118.8864	1.295	633	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Cu<6>,2|C<3>}	H(C[6]C[6]N[6])	118.7830	1.104	33	118.8864	1.295	633	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Eu)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Eu)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Eu<13>,2|C<3>}	H(C[6]C[6]N[6])	118.2151	0.326	7	118.0822	0.081	16	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Eu)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Eu)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Eu<8>,2|C<3>}	H(C[6]C[6]N[6])	117.9788	0.213	9	118.0822	0.081	16	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Fe)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Fe)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H){1|Fe<6>,2|C<3>}	H(C[6]C[6]N[6])	118.2625	0.327	2	118.2625	0.107	2	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Fe)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Fe)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Fe<4>,2|C<3>}	H(C[6]C[6]N[6])	118.7175	0.245	2	118.7092	0.309	561	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Fe)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Fe)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Fe<6>,2|C<3>}	H(C[6]C[6]N[6])	117.8080	0.000	1	118.7092	0.309	561	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Fe)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Fe)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Fe<4>,2|C<3>}	H(C[6]C[6]N[6])	118.3960	0.004	2	118.7092	0.309	561	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Fe)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Fe)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Fe<5>,2|C<3>}	H(C[6]C[6]N[6])	118.7338	0.537	9	118.7092	0.309	561	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Fe)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Fe)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Fe<6>,2|C<3>}	H(C[6]C[6]N[6])	118.7021	0.535	544	118.7092	0.309	561	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Fe)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Fe)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Fe<7>,2|C<3>}	H(C[6]C[6]N[6])	121.3400	0.233	2	118.7092	0.309	561	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Fe)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Fe)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Fe<8>,2|C<3>}	H(C[6]C[6]N[6])	118.5930	0.000	1	118.7092	0.309	561	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]H)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]N[6])	119.7903	0.670	10	119.6331	0.267	27	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]H)(C[6]C[6]H)(H){3|C<3>}	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]N[6])	119.5407	0.395	17	119.6331	0.267	27	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]C[4])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]H)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6,6a]C[4])(C[6]N[6]H)(H){2|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]N[6])	122.4345	3.276	2	122.4345	10.732	2	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]C[6a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]H)(C[6]C[6]H)(H){3|C<3>}	C[6](C[6]C[6,6a]C[6a])(C[6]N[6]H)(H){1|H<1>,4|C<3>}	H(C[6]C[6]N[6])	119.6620	0.115	2	119.6620	0.013	2	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]N[6])	119.6636	0.230	9	120.2500	2.470	232	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]N[6])	120.2736	1.598	223	120.2500	2.470	232	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]H)(C[6]C[6]H)(H){1|N<2>,2|C<3>}	C[6](C[6]C[6,6a]N)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]N[6])	118.5305	0.012	2	118.7921	0.029	15	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]H)(C[6]C[6]H)(H){1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]N)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]N[6])	118.8324	0.143	13	118.7921	0.029	15	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]O)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]H)(C[6]C[6]H)(H){1|O<2>,2|C<3>}	C[6](C[6]C[6,6a]O)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]N[6])	118.8815	1.036	2	118.8815	1.073	2	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Hg)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]C[6a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Hg)(C[6]C[6]H)(H){3|C<3>}	C[6](C[6]C[6,6a]C[6a])(C[6]N[6]H)(H){1|Hg<4>,4|C<3>}	H(C[6]C[6]N[6])	118.1470	0.677	2	118.1470	0.459	2	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Hg)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Hg)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Hg<4>,2|C<3>}	H(C[6]C[6]N[6])	118.7860	0.199	2	118.7860	0.040	2	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]In[4])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]In[4])(C[6]C[6]H)(H){1|Cl<1>,1|Se<2>,1|Se<3>,1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|In<4>,2|C<3>}	H(C[6]C[6]N[6])	118.9110	0.000	1	118.9110	0.000	1	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]In[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]In[6])(C[6]C[6]H)(H){1|Cl<1>,1|Se<2>,1|Se<3>,1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|In<4>,2|C<3>}	H(C[6]C[6]N[6])	119.7990	0.000	1	119.7990	0.000	1	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Ir)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H){1|Ir<6>,2|C<3>}	H(C[6]C[6]N[6])	118.6510	0.025	2	118.8190	0.085	3	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Ir)(C[6]C[6]H)(H){3|C<3>}	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H){1|Ir<6>,2|C<3>}	H(C[6]C[6]N[6])	119.1550	0.000	1	118.8190	0.085	3	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]C[6a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Ir)(C[6]C[6]H)(H){3|C<3>}	C[6](C[6]C[6,6a]C[6a])(C[6]N[6]H)(H){1|Ir<6>,4|C<3>}	H(C[6]C[6]N[6])	118.6695	0.238	2	118.6695	0.057	2	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Ir)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ir<6>,2|C<3>}	H(C[6]C[6]N[6])	118.0520	0.711	3	118.8232	0.268	91	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Ir)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ir<7>,2|C<3>}	H(C[6]C[6]N[6])	118.0470	0.000	1	118.8232	0.268	91	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Ir)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ir<6>,2|C<3>}	H(C[6]C[6]N[6])	118.8437	0.488	65	118.8232	0.268	91	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Ir)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ir<7>,2|C<3>}	H(C[6]C[6]N[6])	118.8390	0.078	6	118.8232	0.268	91	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Ir)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ir<8>,2|C<3>}	H(C[6]C[6]N[6])	118.9272	0.592	16	118.8232	0.268	91	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]N[5a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Ir)(C[6]C[6]H)(H){1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]N[5a])(C[6]N[6]H)(H){1|Ir<8>,1|N<2>,3|C<3>}	H(C[6]C[6]N[6])	117.9620	0.000	1	117.9620	0.000	1	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Li)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Li)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Li<4>,2|C<3>}	H(C[6]C[6]N[6])	118.1338	0.470	5	118.1338	0.221	5	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Mg)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Mg)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Mg<6>,2|C<3>}	H(C[6]C[6]N[6])	118.4125	0.172	12	118.4125	0.030	12	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Mn)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Mn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Mn<5>,2|C<3>}	H(C[6]C[6]N[6])	118.4853	0.209	10	118.5683	0.514	366	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Mn)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Mn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Mn<6>,2|C<3>}	H(C[6]C[6]N[6])	118.5758	0.740	337	118.5683	0.514	366	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Mn)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Mn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Mn<7>,2|C<3>}	H(C[6]C[6]N[6])	118.4790	0.394	19	118.5683	0.514	366	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Mo)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]C[6a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Mo)(C[6]C[6]H)(H){3|C<3>}	C[6](C[6]C[6,6a]C[6a])(C[6]N[6]H)(H){1|Mo<6>,4|C<3>}	H(C[6]C[6]N[6])	118.2450	0.033	2	118.2450	0.001	2	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Mo)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Mo)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Mo<6>,2|C<3>}	H(C[6]C[6]N[6])	118.4572	0.380	24	118.4541	0.136	26	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Mo)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Mo)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Mo<8>,2|C<3>}	H(C[6]C[6]N[6])	118.4170	0.301	2	118.4541	0.136	26	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]N)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]N)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|N<2>,2|C<3>}	H(C[6]C[6]N[6])	119.5290	0.000	1	119.5290	0.000	1	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Ni)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Ni)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ni<4>,2|C<3>}	H(C[6]C[6]N[6])	118.8374	0.708	31	118.6846	0.521	427	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Ni)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Ni)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ni<5>,2|C<3>}	H(C[6]C[6]N[6])	118.5779	0.343	9	118.6846	0.521	427	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Ni)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Ni)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ni<6>,2|C<3>}	H(C[6]C[6]N[6])	118.6737	0.736	379	118.6846	0.521	427	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Ni)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Ni)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ni<7>,2|C<3>}	H(C[6]C[6]N[6])	118.7258	0.216	8	118.6846	0.521	427	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]O)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]O)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H){1|O<1>,2|C<3>}	H(C[6]C[6]N[6])	119.5130	0.000	1	119.4820	0.002	2	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]O)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]O)(C[6]C[6]H)(H){3|C<3>}	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H){1|O<1>,2|C<3>}	H(C[6]C[6]N[6])	119.4510	0.000	1	119.4820	0.002	2	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]O)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]O)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|O<1>,2|C<3>}	H(C[6]C[6]N[6])	120.1170	1.895	20	120.0832	2.988	24	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]O)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]O)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|O<2>,2|C<3>}	H(C[6]C[6]N[6])	119.9142	0.328	4	120.0832	2.988	24	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]O)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]O)(C[6]C[6]H)(H){1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]N)(C[6]N[6]H)(H){1|O<1>,2|C<3>}	H(C[6]C[6]N[6])	119.3190	0.212	2	119.5647	0.204	3	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]O)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]O)(C[6]C[6]H)(H){1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]N)(C[6]N[6]H)(H){1|O<2>,2|C<3>}	H(C[6]C[6]N[6])	120.0560	0.000	1	119.5647	0.204	3	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]O)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]S)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]O)(C[6]C[6]H)(H){1|S<2>,2|C<3>}	C[6](C[6]C[6,6a]S)(C[6]N[6]H)(H){1|O<1>,2|C<3>}	H(C[6]C[6]N[6])	123.9100	0.000	1	123.9100	0.000	1	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Os)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Os)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H){1|Os<5>,2|C<3>}	H(C[6]C[6]N[6])	118.1250	0.000	1	118.1250	0.000	1	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Os)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]C[6a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Os)(C[6]C[6]H)(H){3|C<3>}	C[6](C[6]C[6,6a]C[6a])(C[6]N[6]H)(H){1|Os<6>,4|C<3>}	H(C[6]C[6]N[6])	118.7177	0.336	4	118.7177	0.113	4	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Os)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Os)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Os<4>,2|C<3>}	H(C[6]C[6]N[6])	118.8290	0.000	1	118.8601	0.313	56	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Os)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Os)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Os<6>,2|C<3>}	H(C[6]C[6]N[6])	118.8374	0.605	46	118.8601	0.313	56	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Os)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Os)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Os<7>,2|C<3>}	H(C[6]C[6]N[6])	118.8340	0.000	1	118.8601	0.313	56	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Os)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Os)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Os<9>,2|C<3>}	H(C[6]C[6]N[6])	118.9980	0.282	8	118.8601	0.313	56	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Pd)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Pd)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H){1|Pd<4>,2|C<3>}	H(C[6]C[6]N[6])	118.8250	0.000	1	118.8250	0.000	1	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Pd)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Pd)(C[6]C[6]H)(H){3|C<3>}	C[6](C[6]C[6,6a]C[6])(C[6]N[6]H)(H){1|Pd<4>,4|C<3>}	H(C[6]C[6]N[6])	119.0120	0.000	1	119.0120	0.000	1	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Pd)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Pd)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Pd<4>,2|C<3>}	H(C[6]C[6]N[6])	118.2958	0.488	5	118.8291	0.317	197	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Pd)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Pd)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Pd<4>,2|C<3>}	H(C[6]C[6]N[6])	118.7660	0.410	2	118.8291	0.317	197	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Pd)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Pd)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|N<2>}	H(C[6]C[6]N[6])	118.4463	0.157	3	118.8291	0.317	197	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Pd)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Pd)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Pd<4>,2|C<3>}	H(C[6]C[6]N[6])	118.8347	0.557	159	118.8291	0.317	197	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Pd)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Pd)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Pd<5>,2|C<3>}	H(C[6]C[6]N[6])	119.0005	0.530	17	118.8291	0.317	197	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Pd)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Pd)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Pd<6>,1|C<3>,1|N<2>}	H(C[6]C[6]N[6])	118.3200	0.614	2	118.8291	0.317	197	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Pd)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Pd)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Pd<6>,2|C<3>}	H(C[6]C[6]N[6])	119.0416	0.785	7	118.8291	0.317	197	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Pd)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Pd)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Pd<7>,2|C<3>}	H(C[6]C[6]N[6])	118.6685	0.213	2	118.8291	0.317	197	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Pd)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]O)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Pd)(C[6]C[6]H)(H){1|O<2>,2|C<3>}	C[6](C[6]C[6,6a]O)(C[6]N[6]H)(H){1|Pd<4>,2|C<3>}	H(C[6]C[6]N[6])	117.9910	0.000	1	117.9910	0.000	1	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Pt)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Pt)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H){1|Pt<4>,2|C<3>}	H(C[6]C[6]N[6])	118.9923	0.259	3	118.9923	0.067	3	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Pt)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]C[6a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Pt)(C[6]C[6]H)(H){3|C<3>}	C[6](C[6]C[6,6a]C[6a])(C[6]N[6]H)(H){1|Pt<4>,4|C<3>}	H(C[6]C[6]N[6])	119.0144	0.770	14	119.0144	0.592	14	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Pt)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Pt)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Pt<4>,2|C<3>}	H(C[6]C[6]N[6])	123.2710	0.000	1	118.9069	0.865	217	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Pt)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Pt)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Pt<4>,2|C<3>}	H(C[6]C[6]N[6])	118.9267	0.772	168	118.9069	0.865	217	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Pt)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Pt)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Pt<5>,2|C<3>}	H(C[6]C[6]N[6])	118.9617	0.542	22	118.9069	0.865	217	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Pt)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Pt)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Pt<6>,2|C<3>}	H(C[6]C[6]N[6])	118.5653	1.535	26	118.9069	0.865	217	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Pt)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Pt)(C[6]C[6]H)(H){1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]N)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|N<2>}	H(C[6]C[6]N[6])	118.0560	0.000	1	118.0560	0.000	1	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Pt)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]N[5a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Pt)(C[6]C[6]H)(H){1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]N[5a])(C[6]N[6]H)(H){1|Pt<4>,1|N<2>,3|C<3>}	H(C[6]C[6]N[6])	118.3160	0.202	2	118.3160	0.041	2	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Pt)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]N[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Pt)(C[6]C[6]H)(H){1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]N[6])(C[6]N[6]H)(H){1|Pt<4>,1|N<2>,3|C<3>}	H(C[6]C[6]N[6])	118.8640	0.000	1	118.8640	0.000	1	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Pt)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]O)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Pt)(C[6]C[6]H)(H){1|O<2>,2|C<3>}	C[6](C[6]C[6,6a]O)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|N<2>}	H(C[6]C[6]N[6])	118.2290	0.000	1	118.2290	0.000	1	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Re)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Re)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Re<6>,2|C<3>}	H(C[6]C[6]N[6])	118.7519	0.553	139	118.7519	0.306	139	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Rh)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Rh)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Rh<5>,2|C<3>}	H(C[6]C[6]N[6])	117.7620	0.000	1	118.6574	0.249	43	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Rh)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Rh)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Rh<4>,2|C<3>}	H(C[6]C[6]N[6])	118.6617	0.246	11	118.6574	0.249	43	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Rh)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Rh)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Rh<5>,1|C<3>,1|N<2>}	H(C[6]C[6]N[6])	118.8360	0.000	1	118.6574	0.249	43	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Rh)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Rh)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Rh<5>,2|C<3>}	H(C[6]C[6]N[6])	118.6934	0.685	11	118.6574	0.249	43	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Rh)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Rh)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Rh<6>,2|C<3>}	H(C[6]C[6]N[6])	118.8760	0.579	7	118.6574	0.249	43	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Rh)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Rh)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Rh<7>,2|C<3>}	H(C[6]C[6]N[6])	118.3410	0.000	1	118.6574	0.249	43	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Rh)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Rh)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Rh<8>,1|C<3>,1|N<2>}	H(C[6]C[6]N[6])	118.8770	0.000	1	118.6574	0.249	43	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Rh)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Rh)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Rh<8>,2|C<3>}	H(C[6]C[6]N[6])	118.5415	0.435	10	118.6574	0.249	43	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Ru)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H){1|Ru<6>,2|C<3>}	H(C[6]C[6]N[6])	118.5447	0.621	3	118.5447	0.385	3	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]C[6a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Ru)(C[6]C[6]H)(H){3|C<3>}	C[6](C[6]C[6,6a]C[6a])(C[6]N[6]H)(H){1|Ru<6>,4|C<3>}	H(C[6]C[6]N[6])	118.6395	0.019	2	118.5855	0.018	4	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]C[6a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Ru)(C[6]C[6]H)(H){3|C<3>}	C[6](C[6]C[6,6a]C[6a])(C[6]N[6]H)(H){1|Ru<8>,4|C<3>}	H(C[6]C[6]N[6])	118.5315	0.202	2	118.5855	0.018	4	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]Cl)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Ru)(C[6]C[6]H)(H){1|Cl<1>,2|C<3>}	C[6](C[6]C[6,6a]Cl)(C[6]N[6]H)(H){1|Ru<6>,2|C<3>}	H(C[6]C[6]N[6])	118.6695	0.247	6	118.6695	0.061	6	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Ru)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ru<6>,2|C<3>}	H(C[6]C[6]N[6])	117.8978	0.136	4	118.6572	0.651	181	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Ru)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ru<5>,2|C<3>}	H(C[6]C[6]N[6])	118.1697	0.182	4	118.6572	0.651	181	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Ru)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ru<6>,2|C<3>}	H(C[6]C[6]N[6])	118.6644	0.594	154	118.6572	0.651	181	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Ru)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ru<7>,2|C<3>}	H(C[6]C[6]N[6])	118.2070	0.000	1	118.6572	0.651	181	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Ru)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ru<8>,2|C<3>}	H(C[6]C[6]N[6])	120.0570	3.870	3	118.6572	0.651	181	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Ru)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Ru<9>,2|C<3>}	H(C[6]C[6]N[6])	118.6661	1.305	15	118.6572	0.651	181	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Sb)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Sb)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Sb<5>,2|C<3>}	H(C[6]C[6]N[6])	118.7895	0.104	2	118.9300	0.140	6	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Sb)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Sb)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Sb<6>,2|C<3>}	H(C[6]C[6]N[6])	119.0002	0.459	4	118.9300	0.140	6	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Si)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Si)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Si<5>,2|C<3>}	H(C[6]C[6]N[6])	119.0400	0.000	1	119.0400	0.000	1	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Sm)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Sm)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Sm<11>,2|C<3>}	H(C[6]C[6]N[6])	118.3937	0.292	4	118.3000	0.122	12	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Sm)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Sm)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Sm<13>,2|C<3>}	H(C[6]C[6]N[6])	118.3685	0.423	4	118.3000	0.122	12	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Sm)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Sm)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Sm<9>,2|C<3>}	H(C[6]C[6]N[6])	118.1378	0.361	4	118.3000	0.122	12	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Sn)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]C[6a])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Sn)(C[6]C[6]H)(H){3|C<3>}	C[6](C[6]C[6,6a]C[6a])(C[6]N[6]H)(H){1|Sn<6>,4|C<3>}	H(C[6]C[6]N[6])	118.5230	0.147	2	118.5230	0.022	2	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Sn)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Sn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Sn<4>,2|C<3>}	H(C[6]C[6]N[6])	118.5395	0.260	2	118.9286	0.069	42	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Sn)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Sn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Sn<5>,2|C<3>}	H(C[6]C[6]N[6])	118.7112	0.226	5	118.9286	0.069	42	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Sn)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Sn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Sn<6>,2|C<3>}	H(C[6]C[6]N[6])	118.9913	0.235	34	118.9286	0.069	42	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Sn)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Sn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Sn<7>,2|C<3>}	H(C[6]C[6]N[6])	118.6620	0.000	1	118.9286	0.069	42	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Sr)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Sr)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Sr<7>,2|C<3>}	H(C[6]C[6]N[6])	118.1685	0.251	2	118.1508	0.021	4	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Sr)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Sr)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Sr<8>,2|C<3>}	H(C[6]C[6]N[6])	118.1330	0.007	2	118.1508	0.021	4	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]U)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]U)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|U<10>,2|C<3>}	H(C[6]C[6]N[6])	118.1990	0.290	2	118.1990	0.084	2	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]V)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]V)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|V<5>,2|C<3>}	H(C[6]C[6]N[6])	118.8505	0.152	4	119.2241	1.826	10	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]V)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]V)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|V<6>,2|C<3>}	H(C[6]C[6]N[6])	118.4625	0.120	2	119.2241	1.826	10	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]V)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]V)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|V<8>,2|C<3>}	H(C[6]C[6]N[6])	118.2505	0.243	2	119.2241	1.826	10	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]V)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]V)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|V<9>,2|C<3>}	H(C[6]C[6]N[6])	121.7065	0.592	2	119.2241	1.826	10	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]W)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]W)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|W<6>,2|C<3>}	H(C[6]C[6]N[6])	118.4801	0.393	8	118.4801	0.155	8	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Zn)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Zn)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H){1|Zn<6>,2|C<3>}	H(C[6]C[6]N[6])	118.3900	0.030	2	118.3900	0.001	2	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Zn)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Zn)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Zn<4>,2|C<3>}	H(C[6]C[6]N[6])	118.1460	0.697	2	118.7003	0.397	235	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Zn)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Zn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Zn<3>,2|C<3>}	H(C[6]C[6]N[6])	121.7170	0.642	2	118.7003	0.397	235	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Zn)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Zn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Zn<4>,2|C<3>}	H(C[6]C[6]N[6])	118.8290	0.830	23	118.7003	0.397	235	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Zn)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Zn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Zn<5>,2|C<3>}	H(C[6]C[6]N[6])	118.5857	0.354	85	118.7003	0.397	235	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Zn)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Zn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Zn<6>,2|C<3>}	H(C[6]C[6]N[6])	118.7154	0.614	123	118.7003	0.397	235	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Zr)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Zr)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(H){1|Zr<10>,1|C<3>,1|N<2>}	H(C[6]C[6]N[6])	118.2810	0.000	1	118.2810	0.000	1	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ag)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ag)(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ag<3>,1|C<3>}	H(C[6]C[6]N[6])	118.1770	0.000	1	119.8377	7.526	17	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ag)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ag)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ag<2>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	123.1705	3.170	2	119.8377	7.526	17	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ag)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ag)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ag<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4440	0.188	2	119.8377	7.526	17	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ag)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ag)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ag<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.0314	0.330	8	119.8377	7.526	17	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ag)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ag)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ag<3>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	122.8960	2.394	4	119.8377	7.526	17	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ag)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ag)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ag<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3128	0.193	11	118.3686	0.291	91	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ag)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ag)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ag<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.9314	0.374	8	118.3686	0.291	91	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ag)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ag)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<4>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ag<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2907	0.199	3	118.3686	0.291	91	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ag)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ag)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ag<3>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6845	0.575	2	118.3686	0.291	91	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ag)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ag)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ag<3>,1|C<3>,1|N<3>}	H(C[6]C[6]N[6])	118.9550	0.000	1	118.3686	0.291	91	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ag)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ag)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ag<4>,1|C<2>,1|C<3>}	H(C[6]C[6]N[6])	119.2420	0.620	4	118.3686	0.291	91	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ag)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ag)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ag<4>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	118.7820	0.240	2	118.3686	0.291	91	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ag)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ag)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ag<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.1180	0.785	2	118.3686	0.291	91	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ag)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ag)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ag<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3890	0.355	6	118.3686	0.291	91	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ag)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ag)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ag<3>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3884	0.344	5	118.3686	0.291	91	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ag)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ag)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ag<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2402	0.474	36	118.3686	0.291	91	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ag)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ag)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ag<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8531	0.794	9	118.3686	0.291	91	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ag)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ag)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ag<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.0435	0.193	2	118.3686	0.291	91	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ag)(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ag)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Ag<2>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.9885	0.098	2	117.8100	0.053	4	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ag)(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ag)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Ag<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.6315	0.148	2	117.8100	0.053	4	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ag)(C[6]C[6]H)(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ag)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|S<2>}	C[6](C[6]N[6]H)2(H){1|Ag<4>,1|C<3>}	H(C[6]C[6]N[6])	119.0880	0.000	1	119.0880	0.000	1	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Al)(C[6]C[6]H)(H)	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Al)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|Al<4>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.9240	0.087	4	118.9240	0.008	4	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Al)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Al)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Al<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6820	0.116	2	118.7547	0.006	6	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Al)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Al)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Al<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7910	0.033	4	118.7547	0.006	6	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Al)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Al)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Al<3>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2170	0.000	1	118.6882	0.384	104	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Al)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Al)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Al<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.9740	0.000	1	118.6882	0.384	104	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Al)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Al)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Al<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7360	0.000	2	118.6882	0.384	104	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Al)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Al)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Al<5>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	119.3400	0.256	3	118.6882	0.384	104	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Al)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Al)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Al<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3760	0.107	3	118.6882	0.384	104	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Al)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Al)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Al<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.9417	0.018	4	118.6882	0.384	104	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Al)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Al)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Al<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6080	0.000	1	118.6882	0.384	104	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Al)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Al)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Al<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5910	0.058	2	118.6882	0.384	104	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Al)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Al)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Al<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4670	0.083	2	118.6882	0.384	104	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Al)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Al)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Al<3>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	119.0100	0.000	1	118.6882	0.384	104	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Al)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Al)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Al<3>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8880	0.000	1	118.6882	0.384	104	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Al)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Al)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Al<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8420	0.388	29	118.6882	0.384	104	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Al)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Al)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Al<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6201	0.114	9	118.6882	0.384	104	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Al)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Al)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Al<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.1080	0.000	1	118.6882	0.384	104	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Al)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Al)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Al<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5671	0.314	23	118.6882	0.384	104	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Al)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Al)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Al<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.1953	1.569	10	118.6882	0.384	104	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Al)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Al)(C[6]C[6]H)(H){1|Rh<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Al<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7410	0.000	1	118.6882	0.384	104	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Al)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Al)(C[6]C[6]H)(H){1|Si<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Al<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5400	0.000	1	118.6882	0.384	104	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Al)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Al)(C[6]C[6]H)(H){1|Sn<3>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Al<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3997	0.301	4	118.6882	0.384	104	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Al)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Al)(C[6]C[6]H)(H){1|Sn<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Al<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.0970	0.067	3	118.6882	0.384	104	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Al)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Al)(C[6]C[6]H)(H){2|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Al<4>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	118.0475	0.033	2	118.6882	0.384	104	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Al)(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Al)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Al<3>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.8805	0.128	4	117.8961	0.025	10	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Al)(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Al)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Al<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.8983	0.132	4	117.8961	0.025	10	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Al)(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Al)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Al<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.9230	0.352	2	117.8961	0.025	10	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]As)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]As)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|As<2>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.5030	0.000	1	119.5030	0.000	1	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]As)(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]As)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|As<3>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8727	0.291	6	118.8516	0.063	8	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]As)(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]As)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|As<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7885	0.062	2	118.8516	0.063	8	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Au)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Au)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Au<3>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.1045	0.292	2	119.1045	0.085	2	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Au)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Au)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Au<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.5840	0.000	1	119.1154	0.258	33	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Au)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Au)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Au<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.2610	0.322	2	119.1154	0.258	33	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Au)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Au)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Au<4>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	119.4630	0.580	2	119.1154	0.258	33	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Au)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Au)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Au<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.0176	0.476	26	119.1154	0.258	33	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Au)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Au)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Au<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.6590	0.895	2	119.1154	0.258	33	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Au)(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Au)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Au<2>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5663	0.346	3	118.7010	0.135	5	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Au)(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Au)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Au<3>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.9030	0.407	2	118.7010	0.135	5	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ba)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ba)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ba<13>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.1223	0.190	3	118.0771	0.056	8	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ba)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ba)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ba<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.1640	0.316	3	118.0771	0.056	8	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ba)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ba)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ba<12>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.8790	0.122	2	118.0771	0.056	8	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Be)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Be)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Be<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4663	0.071	3	118.4663	0.005	3	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Bi)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Bi)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Bi<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.1310	0.215	2	118.1310	0.046	2	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Bi)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Bi)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Bi<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5763	0.230	4	118.6895	0.126	14	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Bi)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Bi)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Bi<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.1540	0.000	1	118.6895	0.126	14	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Bi)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Bi)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Bi<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.9050	0.496	2	118.6895	0.126	14	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Bi)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Bi)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Bi<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6120	0.407	3	118.6895	0.126	14	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Bi)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Bi)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Bi<6>,1|C<3>,1|O<2>}	H(C[6]C[6]N[6])	119.0340	0.136	2	118.6895	0.126	14	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Bi)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Bi)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Bi<7>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7400	0.434	2	118.6895	0.126	14	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ca)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ca)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ca<10>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4820	0.000	1	118.0883	0.039	21	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ca)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ca)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ca<8>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.9842	0.093	6	118.0883	0.039	21	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ca)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ca)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ca<8>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.8150	0.231	2	118.0883	0.039	21	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ca)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ca)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ca<12>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.0433	0.150	4	118.0883	0.039	21	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ca)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ca)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ca<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2627	0.136	4	118.0883	0.039	21	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ca)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ca)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ca<8>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.1532	0.112	4	118.0883	0.039	21	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ca)(C[6]C[6]H)(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ca)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]N[6]H)2(H){1|Ca<11>,1|C<4>}	H(C[6]C[6]N[6])	118.7920	0.000	1	118.6725	0.029	2	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ca)(C[6]C[6]H)(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ca)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]N[6]H)2(H){1|Ca<8>,1|C<4>}	H(C[6]C[6]N[6])	118.5530	0.000	1	118.6725	0.029	2	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H)	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H){1|Cd<6>,1|C<3>,1|H<1>,2|N<2>}	H(C[6]C[6]N[6])	118.4045	0.182	2	118.6596	0.262	5	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H)	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H){1|Cd<6>,1|C<3>,1|H<1>,2|N<3>}	H(C[6]C[6]N[6])	118.8297	0.632	3	118.6596	0.262	5	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H)	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H){1|Cd<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]N[6])	118.0252	0.087	4	118.0252	0.008	4	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H)	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|Cd<4>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.3935	0.361	2	118.2223	0.083	4	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H)	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|Cd<6>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.0510	0.010	2	118.2223	0.083	4	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cd<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2700	0.244	8	118.2576	0.098	44	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<2>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cd<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.7157	0.175	4	118.2576	0.098	44	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cd<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.9795	0.421	2	118.2576	0.098	44	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cd<7>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2040	0.181	2	118.2576	0.098	44	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4081	0.309	14	118.2576	0.098	44	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cd<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3021	0.213	14	118.2576	0.098	44	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.0650	0.551	3	118.6232	0.429	308	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cd<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5018	0.208	13	118.6232	0.429	308	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cd<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6614	0.503	34	118.6232	0.429	308	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cd<7>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.9420	1.231	3	118.6232	0.429	308	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2060	0.180	2	118.6232	0.429	308	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cd<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.1115	0.086	2	118.6232	0.429	308	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cd<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3360	0.279	2	118.6232	0.429	308	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cd<8>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.9922	0.111	4	118.6232	0.429	308	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cd<6>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	118.4753	0.133	3	118.6232	0.429	308	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cd<6>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	118.8410	0.000	1	118.6232	0.429	308	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cd<4>,1|C<2>,1|C<3>}	H(C[6]C[6]N[6])	118.4500	0.000	1	118.6232	0.429	308	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cd<4>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	118.8893	0.410	6	118.6232	0.429	308	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4801	0.341	12	118.6232	0.429	308	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cd<5>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	118.9580	0.000	1	118.6232	0.429	308	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cd<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5645	0.299	8	118.6232	0.429	308	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cd<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3899	0.465	32	118.6232	0.429	308	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cd<6>,1|C<3>,1|N<3>}	H(C[6]C[6]N[6])	119.2772	0.792	18	118.6232	0.429	308	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cd<6>,2|C<3>}	H(C[6]C[6]N[6])	118.6257	0.245	10	118.6232	0.429	308	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cd<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6494	0.615	41	118.6232	0.429	308	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cd<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6004	0.781	104	118.6232	0.429	308	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cd<6>,1|C<3>,1|N<3>}	H(C[6]C[6]N[6])	119.4250	0.000	1	118.6232	0.429	308	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cd<6>,2|C<3>}	H(C[6]C[6]N[6])	118.7740	0.000	1	118.6232	0.429	308	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cd<7>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5844	0.142	5	118.6232	0.429	308	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cd<8>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4370	0.000	1	118.6232	0.429	308	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Cd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.1280	0.792	2	118.0480	0.143	7	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Cd<6>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	118.1960	0.095	2	118.0480	0.143	7	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Cd<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.8960	0.219	3	118.0480	0.143	7	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H)	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|Cd<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4185	0.231	2	118.4185	0.053	2	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Cd<5>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.6465	0.042	2	118.6465	0.002	2	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H)	C[6](C[6]N[5a]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[5a]C[6])(C[6]N[6]H)(H){1|Cd<4>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.5145	0.159	2	118.3727	0.062	4	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H)	C[6](C[6]N[5a]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[5a]C[6])(C[6]N[6]H)(H){1|Cd<6>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.2310	0.283	2	118.3727	0.062	4	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]N[6]H)2(H){1|Cd<6>,1|C<3>}	H(C[6]C[6]N[6])	119.3385	0.163	4	119.1282	0.241	5	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cd)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]N[6]H)2(H){1|Cd<6>,1|C<3>}	H(C[6]C[6]N[6])	118.2870	0.000	1	119.1282	0.241	5	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ce)(C[6]C[6]H)(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ce)(C[6]C[6]H)(H){1|N<2>,2|H<1>}	C[6](C[6]N[6]H)2(H){1|Ce<17>,1|C<4>}	H(C[6]C[6]N[6])	119.1050	0.000	1	119.1050	0.000	1	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>,2|N<2>}	H(C[6]C[6]N[6])	119.2698	1.263	4	118.6455	1.141	8	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>,2|N<3>}	H(C[6]C[6]N[6])	118.0213	0.171	4	118.6455	1.141	8	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>,1|N<2>,1|O<2>}	H(C[6]C[6]N[6])	118.2477	0.166	12	118.2370	0.024	16	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>,1|N<2>,1|S<2>}	H(C[6]C[6]N[6])	118.0975	0.005	2	118.2370	0.024	16	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H){1|Co<6>,1|H<1>,1|N<2>,2|C<3>}	H(C[6]C[6]N[6])	118.3120	0.059	2	118.2370	0.024	16	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|Cl<1>,1|Co<6>,3|C<3>}	H(C[6]C[6]N[6])	118.8260	0.000	1	118.4274	0.099	52	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|Co<5>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.2715	0.006	2	118.4274	0.099	52	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|Co<6>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.4284	0.316	47	118.4274	0.099	52	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|Co<8>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.3615	0.500	2	118.4274	0.099	52	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	C[6](C[6]C[6]Br)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|Br<1>,1|C<3>,1|H<1>}	C[6](C[6]C[6]Br)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2618	0.264	20	118.2618	0.070	20	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7880	0.000	1	118.6341	0.559	206	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5470	0.408	4	118.6341	0.559	206	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Co<5>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	118.8875	0.095	4	118.6341	0.559	206	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Co<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3833	0.144	4	118.6341	0.559	206	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.0656	1.294	45	118.6341	0.559	206	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Co<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4543	0.824	8	118.6341	0.559	206	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Co<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5600	0.018	2	118.6341	0.559	206	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3103	0.260	6	118.6341	0.559	206	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Co<7>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.6945	0.016	2	118.6341	0.559	206	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Co<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5460	0.523	11	118.6341	0.559	206	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3902	0.326	79	118.6341	0.559	206	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Co<7>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3547	0.132	4	118.6341	0.559	206	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Co<8>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3670	0.385	2	118.6341	0.559	206	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){3|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8714	0.398	34	118.6341	0.559	206	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	C[6](C[6]C[6]Cl)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|Cl<1>,1|C<3>,1|C<4>}	C[6](C[6]C[6]Cl)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6330	0.000	1	118.2396	0.066	5	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	C[6](C[6]C[6]Cl)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|Cl<1>,1|C<3>,1|H<1>}	C[6](C[6]C[6]Cl)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.1412	0.153	4	118.2396	0.066	5	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5850	0.263	2	118.7903	0.623	1762	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<6>,1|C<3>}	H(C[6]C[6]N[6])	119.5680	0.000	1	118.7903	0.623	1762	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6302	0.870	17	118.7903	0.623	1762	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6822	0.290	50	118.7903	0.623	1762	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.9377	0.725	293	118.7903	0.623	1762	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<7>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.9731	0.530	11	118.7903	0.623	1762	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<8>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7150	0.000	1	118.7903	0.623	1762	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	121.1150	3.335	2	118.7903	0.623	1762	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8238	0.352	4	118.7903	0.623	1762	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<7>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6555	0.687	2	118.7903	0.623	1762	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<4>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	118.7265	0.508	2	118.7903	0.623	1762	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.1542	0.347	22	118.7903	0.623	1762	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3546	0.429	125	118.7903	0.623	1762	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.1461	0.418	22	118.7903	0.623	1762	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<7>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6885	0.118	8	118.7903	0.623	1762	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<8>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3440	0.502	2	118.7903	0.623	1762	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.1950	0.492	2	118.7903	0.623	1762	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<6>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	118.5930	0.000	1	118.7903	0.623	1762	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<7>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4300	0.107	2	118.7903	0.623	1762	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<7>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	118.8180	0.000	1	118.7903	0.623	1762	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<4>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4015	0.293	2	118.7903	0.623	1762	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<4>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7800	0.017	3	118.7903	0.623	1762	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6450	0.294	3	118.7903	0.623	1762	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<8>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2450	0.000	1	118.7903	0.623	1762	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Br<1>,1|Co<6>,1|C<3>}	H(C[6]C[6]N[6])	118.3120	0.000	1	118.7903	0.623	1762	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cl<1>,1|Co<6>,1|C<3>}	H(C[6]C[6]N[6])	118.5425	0.135	2	118.7903	0.623	1762	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<3>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7480	0.107	2	118.7903	0.623	1762	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<4>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	118.8435	0.132	2	118.7903	0.623	1762	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7896	0.674	17	118.7903	0.623	1762	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6099	0.694	19	118.7903	0.623	1762	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<5>,1|C<3>,1|N<3>}	H(C[6]C[6]N[6])	118.2960	0.000	1	118.7903	0.623	1762	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<5>,2|C<3>}	H(C[6]C[6]N[6])	118.7390	0.000	1	118.7903	0.623	1762	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<6>,1|B<4>,1|C<3>}	H(C[6]C[6]N[6])	118.3960	0.000	1	118.7903	0.623	1762	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<6>,1|C<2>,1|C<3>}	H(C[6]C[6]N[6])	121.7330	0.000	1	118.7903	0.623	1762	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	119.0240	0.000	1	118.7903	0.623	1762	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6936	0.587	270	118.7903	0.623	1762	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|I<1>}	H(C[6]C[6]N[6])	118.4490	0.000	1	118.7903	0.623	1762	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|N<2>}	H(C[6]C[6]N[6])	119.1140	0.066	2	118.7903	0.623	1762	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|N<3>}	H(C[6]C[6]N[6])	119.1076	0.672	14	118.7903	0.623	1762	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|O<2>}	H(C[6]C[6]N[6])	118.8180	0.188	2	118.7903	0.623	1762	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|S<4>}	H(C[6]C[6]N[6])	119.0180	0.802	3	118.7903	0.623	1762	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<6>,2|C<3>}	H(C[6]C[6]N[6])	118.6369	0.259	39	118.7903	0.623	1762	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<7>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2737	0.150	6	118.7903	0.623	1762	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<7>,1|C<3>,1|N<3>}	H(C[6]C[6]N[6])	118.9435	0.046	2	118.7903	0.623	1762	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3804	0.386	28	118.7903	0.623	1762	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8609	0.674	34	118.7903	0.623	1762	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8843	0.927	689	118.7903	0.623	1762	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<6>,2|C<3>}	H(C[6]C[6]N[6])	119.4342	1.841	5	118.7903	0.623	1762	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<7>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.3126	1.071	34	118.7903	0.623	1762	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<8>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.0030	0.204	6	118.7903	0.623	1762	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	121.2985	4.942	2	118.2600	1.310	54	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Co<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.1820	0.107	2	118.2600	1.310	54	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Co<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.9520	0.142	3	118.2600	1.310	54	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Co<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.8095	0.192	2	118.2600	1.310	54	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.1690	0.759	45	118.2600	1.310	54	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.1640	0.561	2	118.3290	0.143	4	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|O<2>,2|C<3>}	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|Co<8>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4940	0.064	2	118.3290	0.143	4	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	C[6](C[6]C[6]P)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<4>}	C[6](C[6]C[6]P)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.9670	0.272	2	118.9670	0.074	2	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.1879	0.143	9	118.3467	0.141	11	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<4>}	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.0615	0.035	2	118.3467	0.141	11	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Co<6>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.7240	0.000	1	118.2243	0.073	38	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Co<6>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.2108	0.260	37	118.2243	0.073	38	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]N[6]H)2(H){1|Co<6>,1|C<3>}	H(C[6]C[6]N[6])	119.8186	0.564	10	119.5825	0.494	17	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6]H)2(H){2|Co<4>,1|C<3>}	H(C[6]C[6]N[6])	118.5645	0.310	2	119.5825	0.494	17	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]H)(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6]H)2(H){2|Co<6>,1|C<3>}	H(C[6]C[6]N[6])	119.5174	0.757	5	119.5825	0.494	17	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cr)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cr)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cr<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5452	0.316	6	118.3937	0.119	13	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cr)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cr)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cr<8>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.1620	0.591	2	118.3937	0.119	13	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cr)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cr)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cr<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3046	0.270	5	118.3937	0.119	13	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cr)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cr)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cr<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5895	0.162	2	118.7872	1.184	243	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cr)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cr)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cr<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	122.0890	0.000	1	118.7872	1.184	243	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cr)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cr)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cr<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8697	1.220	43	118.7872	1.184	243	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cr)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cr)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cr<7>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4980	0.000	1	118.7872	1.184	243	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cr)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cr)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cr<9>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4403	1.151	3	118.7872	1.184	243	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cr)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cr)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cr<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5118	0.239	8	118.7872	1.184	243	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cr)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cr)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cr<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2485	0.201	23	118.7872	1.184	243	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cr)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cr)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cr<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5435	0.364	24	118.7872	1.184	243	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cr)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cr)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cr<8>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7430	0.000	1	118.7872	1.184	243	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cr)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cr)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cr<8>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	119.5788	0.151	5	118.7872	1.184	243	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cr)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cr)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cr<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	121.4530	0.000	1	118.7872	1.184	243	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cr)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cr)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cr<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6753	0.263	6	118.7872	1.184	243	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cr)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cr)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cr<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6787	0.316	19	118.7872	1.184	243	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cr)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cr)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cr<9>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3270	0.099	2	118.7872	1.184	243	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cr)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cr)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cr<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.6750	0.047	2	118.7872	1.184	243	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cr)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cr)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cr<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	120.3560	3.242	4	118.7872	1.184	243	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cr)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cr)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cr<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8846	1.232	92	118.7872	1.184	243	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cr)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cr)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cr<8>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6835	0.305	6	118.7872	1.184	243	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cr)(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cr)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Cr<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.6995	0.088	2	118.9772	2.182	4	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cr)(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cr)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Cr<8>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	120.2550	0.081	2	118.9772	2.182	4	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cr)(C[6]C[6]H)(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cr)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]N[6]H)2(H){1|Cr<6>,1|C<3>}	H(C[6]C[6]N[6])	119.7550	0.000	1	119.7550	0.000	1	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>,2|N<3>}	H(C[6]C[6]N[6])	118.2515	0.057	2	118.2515	0.003	2	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>,1|N<2>,1|O<2>}	H(C[6]C[6]N[6])	118.3265	0.260	2	118.1598	0.060	4	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H){1|Cu<6>,1|C<3>,1|H<1>,1|N<2>,1|S<2>}	H(C[6]C[6]N[6])	117.9930	0.049	2	118.1598	0.060	4	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|Cu<4>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.2839	0.533	18	118.3420	0.297	28	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|Cu<5>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.4464	0.580	10	118.3420	0.297	28	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]Br)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|Br<1>,1|C<3>,1|C<4>}	C[6](C[6]C[6]Br)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8030	0.518	2	118.5687	0.164	4	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]Br)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|Br<1>,2|C<3>}	C[6](C[6]C[6]Br)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3345	0.064	2	118.5687	0.164	4	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cu<3>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3345	0.142	2	118.3863	0.313	158	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4942	0.763	15	118.3863	0.313	158	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cu<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8175	0.088	2	118.3863	0.313	158	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cu<2>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8375	0.011	2	118.3863	0.313	158	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.1945	0.287	23	118.3863	0.313	158	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6050	0.290	11	118.3863	0.313	158	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<2>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.7750	0.000	1	118.3863	0.313	158	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<2>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.1035	0.153	2	118.3863	0.313	158	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cu<3>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.7985	0.127	2	118.3863	0.313	158	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.7870	0.082	2	118.3863	0.313	158	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.7403	0.124	4	118.3863	0.313	158	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<2>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.1825	0.047	2	118.3863	0.313	158	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|P<4>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.1282	0.230	5	118.3863	0.313	158	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,2|C<4>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cu<3>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4815	0.445	2	118.3863	0.313	158	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,2|C<4>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6515	0.936	4	118.3863	0.313	158	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cu<3>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5930	0.000	1	118.3863	0.313	158	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5152	0.211	8	118.3863	0.313	158	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7157	0.231	29	118.3863	0.313	158	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2567	1.095	16	118.3863	0.313	158	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2240	0.427	22	118.3863	0.313	158	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){3|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4377	0.619	3	118.3863	0.313	158	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]Cl)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|Cl<1>,1|C<3>,1|C<4>}	C[6](C[6]C[6]Cl)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3165	0.596	2	118.5687	0.161	6	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]Cl)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|Cl<1>,1|C<3>,1|C<4>}	C[6](C[6]C[6]Cl)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.9275	0.103	2	118.5687	0.161	6	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]Cl)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|Cl<1>,1|C<3>,1|H<1>}	C[6](C[6]C[6]Cl)(C[6]N[6]H)(H){1|Cu<2>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4620	0.173	2	118.5687	0.161	6	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|Br<2>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.0820	0.000	1	118.7734	1.054	1858	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4070	0.000	1	118.7734	1.054	1858	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>}	H(C[6]C[6]N[6])	126.5905	4.231	2	118.7734	1.054	1858	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<6>,1|C<3>}	H(C[6]C[6]N[6])	126.3210	0.000	1	118.7734	1.054	1858	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<2>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>}	H(C[6]C[6]N[6])	122.3470	2.823	3	118.7734	1.054	1858	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<2>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5097	0.209	3	118.7734	1.054	1858	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<3>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	118.4600	0.000	1	118.7734	1.054	1858	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<3>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5225	0.545	17	118.7734	1.054	1858	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5563	0.596	137	118.7734	1.054	1858	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.9044	0.778	351	118.7734	1.054	1858	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8610	1.025	27	118.7734	1.054	1858	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<3>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	118.1875	0.064	2	118.7734	1.054	1858	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.0775	0.216	2	118.7734	1.054	1858	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	120.5100	1.678	3	118.7734	1.054	1858	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<3>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	118.1793	0.074	3	118.7734	1.054	1858	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<3>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.0800	0.243	6	118.7734	1.054	1858	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.0055	0.303	34	118.7734	1.054	1858	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7825	2.505	41	118.7734	1.054	1858	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<5>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	118.6650	0.000	1	118.7734	1.054	1858	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3167	0.161	16	118.7734	1.054	1858	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5910	0.071	2	118.7734	1.054	1858	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5650	0.100	2	118.7734	1.054	1858	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<4>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<3>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5660	0.220	4	118.7734	1.054	1858	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<4>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4233	0.322	81	118.7734	1.054	1858	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5810	0.000	1	118.7734	1.054	1858	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<5>,1|C<2>,1|H<1>}	H(C[6]C[6]N[6])	117.4330	0.000	1	118.7734	1.054	1858	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Br<1>,1|Cu<4>,1|C<3>}	H(C[6]C[6]N[6])	118.6280	0.000	1	118.7734	1.054	1858	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Br<1>,1|Cu<5>,1|C<3>}	H(C[6]C[6]N[6])	118.8720	0.000	1	118.7734	1.054	1858	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cl<1>,1|Cu<4>,1|C<3>}	H(C[6]C[6]N[6])	118.4710	0.129	2	118.7734	1.054	1858	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cl<1>,1|Cu<5>,1|C<3>}	H(C[6]C[6]N[6])	118.8107	0.055	4	118.7734	1.054	1858	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<3>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5070	0.184	7	118.7734	1.054	1858	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<4>,1|C<2>,1|C<3>}	H(C[6]C[6]N[6])	118.3605	0.178	4	118.7734	1.054	1858	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	118.6813	0.623	3	118.7734	1.054	1858	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6143	0.975	117	118.7734	1.054	1858	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|N<3>}	H(C[6]C[6]N[6])	119.0530	0.294	4	118.7734	1.054	1858	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|O<2>}	H(C[6]C[6]N[6])	118.5240	0.034	2	118.7734	1.054	1858	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<4>,2|C<3>}	H(C[6]C[6]N[6])	118.5885	0.282	4	118.7734	1.054	1858	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<5>,1|C<2>,1|C<3>}	H(C[6]C[6]N[6])	118.4670	0.000	1	118.7734	1.054	1858	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	119.0016	0.365	11	118.7734	1.054	1858	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6229	0.677	122	118.7734	1.054	1858	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|N<3>}	H(C[6]C[6]N[6])	119.3800	0.000	1	118.7734	1.054	1858	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|O<2>}	H(C[6]C[6]N[6])	118.5930	0.240	2	118.7734	1.054	1858	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<5>,2|C<3>}	H(C[6]C[6]N[6])	118.6771	0.277	15	118.7734	1.054	1858	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4056	0.321	27	118.7734	1.054	1858	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<8>,2|C<3>}	H(C[6]C[6]N[6])	119.0140	0.000	1	118.7734	1.054	1858	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<3>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8313	1.077	11	118.7734	1.054	1858	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6593	0.839	231	118.7734	1.054	1858	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<4>,2|C<3>}	H(C[6]C[6]N[6])	119.0860	0.000	1	118.7734	1.054	1858	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	119.0217	0.650	3	118.7734	1.054	1858	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.0308	1.126	449	118.7734	1.054	1858	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|O<2>}	H(C[6]C[6]N[6])	118.6620	0.000	1	118.7734	1.054	1858	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<5>,2|C<3>}	H(C[6]C[6]N[6])	119.2850	0.429	2	118.7734	1.054	1858	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5674	1.048	81	118.7734	1.054	1858	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<6>,2|C<3>}	H(C[6]C[6]N[6])	119.1100	0.000	1	118.7734	1.054	1858	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<7>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.1635	0.098	2	118.7734	1.054	1858	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|Si<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.4505	2.881	2	118.7734	1.054	1858	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|Si<5>,1|C<2>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<6>,1|C<3>}	H(C[6]C[6]N[6])	114.7970	0.000	1	118.7734	1.054	1858	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|Si<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cu<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.0870	0.000	1	118.7734	1.054	1858	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Cu<3>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.7365	0.228	2	117.7775	0.101	55	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.6750	0.033	2	117.7775	0.101	55	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.3200	0.000	1	117.7775	0.101	55	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Cu<3>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.5468	0.190	6	117.7775	0.101	55	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.7442	0.346	18	117.7775	0.101	55	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.8482	0.292	24	117.7775	0.101	55	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2935	0.013	2	117.7775	0.101	55	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]N[5])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[5])(C[6]N[6]H)(H){1|Cu<4>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.0140	0.194	2	118.0140	0.038	2	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H){1|Cu<6>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.6050	0.000	1	118.8557	0.175	11	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H){2|Cu<4>,1|N<3>,2|C<3>}	H(C[6]C[6]N[6])	118.7360	0.000	1	118.8557	0.175	11	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H){2|Cu<5>,1|N<3>,2|C<3>}	H(C[6]C[6]N[6])	118.8969	0.455	9	118.8557	0.175	11	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<2>}	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.9960	0.433	2	118.0753	0.139	9	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<2>}	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.9080	0.000	1	118.0753	0.139	9	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|O<2>,2|C<3>}	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.0087	0.283	4	118.0753	0.139	9	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|O<2>,2|C<3>}	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3715	0.670	2	118.0753	0.139	9	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|Cu<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.7290	0.202	2	117.7290	0.041	2	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Cu<4>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	117.9063	0.624	7	118.2111	0.201	33	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>,2|N<2>}	H(C[6]C[6]N[6])	118.5615	0.579	2	118.2111	0.201	33	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Cu<5>,1|H<1>,1|N<2>,2|C<3>}	H(C[6]C[6]N[6])	118.3008	0.352	10	118.2111	0.201	33	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Cu<5>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.1385	0.351	8	118.2111	0.201	33	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Cu<6>,1|H<1>,1|N<2>,2|C<3>}	H(C[6]C[6]N[6])	118.6770	0.402	2	118.2111	0.201	33	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Cu<6>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.2575	0.223	4	118.2111	0.201	33	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]N[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<2>}	C[6](C[6]N[6]C)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>}	H(C[6]C[6]N[6])	119.5335	0.162	2	119.4420	1.196	7	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]N[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]N[6]C)(C[6]N[6]H)(H){2|Cu<4>,1|C<3>}	H(C[6]C[6]N[6])	118.9180	0.000	1	119.4420	1.196	7	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]N[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<2>}	C[6](C[6]N[6]C)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>}	H(C[6]C[6]N[6])	119.0730	0.000	1	119.4420	1.196	7	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]N[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]N[6]C)(C[6]N[6]H)(H){1|Cu<5>,1|Cu<6>,1|C<3>}	H(C[6]C[6]N[6])	120.2465	2.149	2	119.4420	1.196	7	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]N[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<4>,1|N<2>,1|N<3>}	C[6](C[6]N[6]C)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>}	H(C[6]C[6]N[6])	118.5430	0.000	1	119.4420	1.196	7	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]N[6]H)2(H){1|Cu<4>,1|C<3>}	H(C[6]C[6]N[6])	119.5960	0.653	4	119.0852	0.452	37	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]N[6]H)2(H){1|Cu<5>,1|C<3>}	H(C[6]C[6]N[6])	121.8390	0.000	1	119.0852	0.452	37	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6]H)2(H){2|Cu<4>,1|C<3>}	H(C[6]C[6]N[6])	119.2899	0.321	10	119.0852	0.452	37	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]N[6]H)2(H){1|Cu<4>,1|C<3>}	H(C[6]C[6]N[6])	118.4057	0.213	6	119.0852	0.452	37	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]N[6]H)2(H){1|Cu<5>,1|C<3>}	H(C[6]C[6]N[6])	118.9257	0.323	11	119.0852	0.452	37	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]N[6]H)2(H){1|Cu<6>,1|C<3>}	H(C[6]C[6]N[6])	118.6480	0.000	1	119.0852	0.452	37	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|O<2>}	C[6](C[6]N[6]H)2(H){1|Cu<5>,1|C<3>}	H(C[6]C[6]N[6])	119.1690	0.000	1	119.0852	0.452	37	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>}	C[6](C[6]N[6]H)2(H){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4390	0.000	1	119.0852	0.452	37	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|H<1>,2|N<2>}	C[6](C[6]N[6]H)2(H){1|Cu<6>,1|C<3>}	H(C[6]C[6]N[6])	118.8880	0.000	1	119.0852	0.452	37	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]H)(H){1|N<2>,2|H<1>}	C[6](C[6]N[6]H)2(H){1|Cu<4>,1|C<3>}	H(C[6]C[6]N[6])	119.2690	0.000	1	119.0852	0.452	37	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Er)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Er)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Er<15>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	119.2140	0.556	3	119.2140	0.309	3	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Eu)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Eu)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Eu<13>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4610	0.098	2	118.3362	0.255	23	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Eu)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Eu)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Eu<9>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6185	0.095	2	118.3362	0.255	23	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Eu)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Eu)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Eu<10>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.1855	0.628	4	118.3362	0.255	23	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Eu)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Eu)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Eu<11>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.1580	0.000	1	118.3362	0.255	23	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Eu)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Eu)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Eu<13>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4460	0.219	2	118.3362	0.255	23	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Eu)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Eu)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Eu<8>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3152	0.604	12	118.3362	0.255	23	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Eu)(C[6]C[6]H)(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Eu)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]N[6]H)2(H){1|Eu<9>,1|C<3>}	H(C[6]C[6]N[6])	118.9075	0.165	4	118.9075	0.027	4	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>,1|N<2>,1|O<2>}	H(C[6]C[6]N[6])	118.1895	0.028	2	118.1895	0.001	2	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|Fe<6>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.3100	0.325	24	118.3100	0.106	24	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4661	0.180	9	118.4643	0.236	60	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Fe<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2479	0.188	10	118.4643	0.236	60	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.1843	0.193	6	118.4643	0.236	60	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<2>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Fe<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.0015	0.036	2	118.4643	0.236	60	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|C<3>,2|C<4>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8190	0.000	1	118.4643	0.236	60	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4969	0.189	12	118.4643	0.236	60	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Fe<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4860	0.471	2	118.4643	0.236	60	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6846	0.773	18	118.4643	0.236	60	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	C[6](C[6]C[6]Cl)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|Cl<1>,1|C<3>,1|C<4>}	C[6](C[6]C[6]Cl)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3270	0.000	1	118.3270	0.000	1	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4283	0.250	15	118.7249	0.616	1942	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.2648	1.611	10	118.7249	0.616	1942	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6230	0.612	42	118.7249	0.616	1942	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6644	0.451	866	118.7249	0.616	1942	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<7>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6388	0.413	13	118.7249	0.616	1942	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<8>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.9073	0.634	3	118.7249	0.616	1942	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|C<3>,1|C<5>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6658	0.206	6	118.7249	0.616	1942	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|C<3>,1|C<5>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<8>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.5718	0.104	4	118.7249	0.616	1942	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2470	0.000	1	118.7249	0.616	1942	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3847	0.241	3	118.7249	0.616	1942	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.1864	0.166	12	118.7249	0.616	1942	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2161	0.306	11	118.7249	0.616	1942	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	118.2025	0.180	2	118.7249	0.616	1942	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3968	0.335	95	118.7249	0.616	1942	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<7>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	119.7840	0.000	1	118.7249	0.616	1942	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2451	0.110	7	118.7249	0.616	1942	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<4>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.1350	0.000	1	118.7249	0.616	1942	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<4>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2037	0.199	3	118.7249	0.616	1942	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<4>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	118.2040	0.000	1	118.7249	0.616	1942	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4840	0.217	17	118.7249	0.616	1942	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5290	0.263	60	118.7249	0.616	1942	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	118.1774	0.147	5	118.7249	0.616	1942	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8708	1.063	114	118.7249	0.616	1942	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|N<3>}	H(C[6]C[6]N[6])	118.8680	0.000	1	118.7249	0.616	1942	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<6>,2|C<3>}	H(C[6]C[6]N[6])	118.4384	0.314	5	118.7249	0.616	1942	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<7>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3650	0.361	4	118.7249	0.616	1942	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<8>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	118.4300	0.000	1	118.7249	0.616	1942	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<8>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	120.3717	2.444	15	118.7249	0.616	1942	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|Fe<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.3900	0.000	1	118.7249	0.616	1942	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2745	0.578	11	118.7249	0.616	1942	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7645	1.229	38	118.7249	0.616	1942	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8889	1.018	562	118.7249	0.616	1942	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|N<3>}	H(C[6]C[6]N[6])	118.9940	0.000	1	118.7249	0.616	1942	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|O<2>}	H(C[6]C[6]N[6])	118.7033	0.703	6	118.7249	0.616	1942	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<7>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3747	0.241	3	118.7249	0.616	1942	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Fe<8>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.5860	0.305	2	118.7249	0.616	1942	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2760	0.549	2	117.9544	0.253	19	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Fe<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.9132	0.184	6	117.9544	0.253	19	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Fe<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.8550	0.224	6	117.9544	0.253	19	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.4305	0.125	2	117.9544	0.253	19	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3703	1.111	3	117.9544	0.253	19	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<2>}	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2230	0.141	2	117.8577	0.244	7	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.1170	0.177	2	117.8577	0.244	7	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|C<3>,1|N<2>,1|O<2>}	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.4413	0.494	3	117.8577	0.244	7	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2502	0.054	4	118.2502	0.003	4	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Fe<6>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.4073	1.027	8	118.3906	0.824	10	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){3|C<3>}	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Fe<6>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.3240	0.163	2	118.3906	0.824	10	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]N[6]H)2(H){1|Fe<6>,1|C<3>}	H(C[6]C[6]N[6])	119.6970	0.393	21	119.5330	0.153	38	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6]H)2(H){2|Fe<6>,1|C<3>}	H(C[6]C[6]N[6])	119.4008	0.230	13	119.5330	0.153	38	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]N[6]H)2(H){1|Fe<6>,1|C<3>}	H(C[6]C[6]N[6])	119.1015	0.362	4	119.5330	0.153	38	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ga)(C[6]C[6]H)(H)	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ga)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|Ga<4>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	119.0220	0.086	4	119.0220	0.007	4	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ga)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ga)(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ga<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	122.9990	0.515	2	119.7324	3.051	10	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ga)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ga)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ga<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6535	0.192	2	119.7324	3.051	10	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ga)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ga)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ga<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.0032	0.245	6	119.7324	3.051	10	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ga)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ga)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ga<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6560	0.000	1	120.9218	5.664	13	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ga)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ga)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ga<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	121.1107	2.382	12	120.9218	5.664	13	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ga)(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ga)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Ga<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	122.1860	1.451	2	122.1860	2.105	2	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ge)(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ge)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Ge<3>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4560	0.153	2	118.4560	0.023	2	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Hf)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Hf)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Hf<10>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	118.7100	0.000	1	118.7100	0.000	1	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Hg)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Hg)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Hg<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3725	0.291	2	118.5303	0.075	21	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Hg)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Hg)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Hg<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5262	0.267	18	118.5303	0.075	21	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Hg)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Hg)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Hg<4>,2|C<3>}	H(C[6]C[6]N[6])	118.9190	0.000	1	118.5303	0.075	21	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Hg)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Hg)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Hg<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5770	0.000	1	118.7708	0.283	61	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Hg)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Hg)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Hg<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7210	0.000	1	118.7708	0.283	61	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Hg)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Hg)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Hg<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7230	0.000	1	118.7708	0.283	61	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Hg)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Hg)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Hg<3>,1|C<3>,1|N<3>}	H(C[6]C[6]N[6])	118.8200	0.000	1	118.7708	0.283	61	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Hg)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Hg)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Hg<4>,1|C<3>,1|N<3>}	H(C[6]C[6]N[6])	119.1445	0.161	11	118.7708	0.283	61	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Hg)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Hg)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Hg<4>,2|C<3>}	H(C[6]C[6]N[6])	118.6972	0.680	30	118.7708	0.283	61	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Hg)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Hg)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Hg<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8190	0.320	8	118.7708	0.283	61	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Hg)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Hg)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Hg<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5150	0.218	8	118.7708	0.283	61	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Hg)(C[6]C[6]H)(H)	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Hg)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|Hg<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.0723	0.151	3	118.0723	0.023	3	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Hg)(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Hg)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Hg<4>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.4525	0.046	2	118.4525	0.002	2	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]In)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]In)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|In<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.9945	0.633	2	118.9386	0.240	20	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]In)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]In)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|In<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.1105	0.748	6	118.9386	0.240	20	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]In)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]In)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|In<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8915	0.275	11	118.9386	0.240	20	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]In)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]In)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|In<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3130	0.000	1	118.9386	0.240	20	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]In)(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]In)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|In<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.8885	0.131	2	117.8885	0.017	2	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[3x3,4,3x5,14x6]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<5>,2|C<3>}	C[6](C[6]C[3x3,4,3x5,14x6]C[6])(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>,4|B<6>}	H(C[6]C[6]N[6])	118.3300	0.145	3	118.3300	0.021	3	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|H<1>,1|N<2>,1|O<2>}	H(C[6]C[6]N[6])	118.3828	0.179	4	118.3828	0.032	4	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|Ir<8>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.1330	0.616	4	118.3500	0.414	6	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){3|C<3>}	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|Ir<6>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.7840	0.604	2	118.3500	0.414	6	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6]B)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]B)(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.4417	1.100	4	119.4417	1.209	4	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<2>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5943	0.169	3	118.5946	0.253	203	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ir<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6050	0.088	2	118.5946	0.253	203	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7980	0.877	2	118.5946	0.253	203	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<2>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2240	0.000	1	118.5946	0.253	203	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2710	0.531	5	118.5946	0.253	203	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ir<7>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	119.2200	0.092	2	118.5946	0.253	203	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<2>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ir<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4725	0.198	4	118.5946	0.253	203	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<2>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4940	0.244	5	118.5946	0.253	203	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<2>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|O<2>}	H(C[6]C[6]N[6])	118.3520	0.000	1	118.5946	0.253	203	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,2|C<4>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.1660	0.000	1	118.5946	0.253	203	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ir<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7490	0.437	2	118.5946	0.253	203	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6377	0.454	124	118.5946	0.253	203	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ir<7>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7555	0.074	2	118.5946	0.253	203	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6382	0.259	8	118.5946	0.253	203	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4177	0.940	18	118.5946	0.253	203	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ir<9>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3330	0.467	2	118.5946	0.253	203	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){3|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5927	0.495	19	118.5946	0.253	203	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){3|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2910	0.146	2	118.5946	0.253	203	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6]F)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|F<1>,2|C<3>}	C[6](C[6]C[6]F)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4900	0.000	1	118.4900	0.000	1	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8640	0.154	2	118.8008	0.346	1409	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.2753	0.507	3	118.8008	0.346	1409	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.9331	0.705	55	118.8008	0.346	1409	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<7>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8763	0.529	3	118.8008	0.346	1409	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<7>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	119.7120	0.000	1	118.8008	0.346	1409	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	118.7900	0.000	1	118.8008	0.346	1409	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7722	0.507	33	118.8008	0.346	1409	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,1|C<5>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	122.5960	0.000	1	118.8008	0.346	1409	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,1|C<5>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<7>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.1830	0.000	1	118.8008	0.346	1409	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,1|C<6>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2130	0.000	1	118.8008	0.346	1409	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.6420	0.000	1	118.8008	0.346	1409	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.2208	0.198	5	118.8008	0.346	1409	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<4>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	119.0100	0.000	1	118.8008	0.346	1409	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	118.5080	0.112	2	118.8008	0.346	1409	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4188	0.621	19	118.8008	0.346	1409	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<7>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	119.0735	0.112	2	118.8008	0.346	1409	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<7>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	118.8430	0.000	1	118.8008	0.346	1409	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6870	0.431	10	118.8008	0.346	1409	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<4>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<7>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	119.4170	0.000	1	118.8008	0.346	1409	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.7090	0.045	2	118.8008	0.346	1409	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<7>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6195	0.257	2	118.8008	0.346	1409	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<7>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	119.1260	0.000	1	118.8008	0.346	1409	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<9>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	119.8720	0.000	1	118.8008	0.346	1409	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|O<2>}	H(C[6]C[6]N[6])	118.9017	0.243	3	118.8008	0.346	1409	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<4>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<7>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7093	0.370	3	118.8008	0.346	1409	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<4>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7365	0.904	2	118.8008	0.346	1409	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.0525	0.397	2	118.8008	0.346	1409	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<3>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.9555	0.047	2	118.8008	0.346	1409	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<4>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	118.8660	0.000	1	118.8008	0.346	1409	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	119.3650	0.000	1	118.8008	0.346	1409	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7676	0.547	54	118.8008	0.346	1409	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|O<2>}	H(C[6]C[6]N[6])	118.8560	0.000	1	118.8008	0.346	1409	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	118.8670	0.000	1	118.8008	0.346	1409	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7001	1.315	8	118.8008	0.346	1409	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|N<3>}	H(C[6]C[6]N[6])	118.9405	0.247	2	118.8008	0.346	1409	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6785	0.271	2	118.8008	0.346	1409	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	119.0850	0.338	8	118.8008	0.346	1409	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7844	0.561	1003	118.8008	0.346	1409	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|O<2>}	H(C[6]C[6]N[6])	119.8370	0.763	3	118.8008	0.346	1409	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<7>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7711	0.603	58	118.8008	0.346	1409	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.9335	0.616	99	118.8008	0.346	1409	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|O<2>}	H(C[6]C[6]N[6])	118.7493	0.135	4	118.8008	0.346	1409	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<9>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.3285	0.381	2	118.8008	0.346	1409	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|Ir<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ir<7>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8640	0.000	1	118.8008	0.346	1409	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.8390	0.236	12	117.9832	0.121	29	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.1135	0.161	2	117.9832	0.121	29	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|N<2>,2|C<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6500	0.025	2	117.9832	0.121	29	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.9938	0.361	13	117.9832	0.121	29	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6]N[5])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[5])(C[6]N[6]H)(H){2|Ir<8>,3|C<3>}	H(C[6]C[6]N[6])	118.8880	0.000	1	118.8880	0.000	1	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,1|N<3>,1|O<2>}	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4220	0.000	1	117.8892	0.643	17	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|O<2>,2|C<3>}	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.6817	0.842	12	117.8892	0.643	17	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|O<2>,2|C<3>}	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3785	0.490	4	117.8892	0.643	17	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.8508	0.831	16	118.0307	0.787	20	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<3>}	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7502	0.814	4	118.0307	0.787	20	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|H<1>,2|N<2>}	H(C[6]C[6]N[6])	118.2423	0.788	18	118.4843	0.326	72	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Ir<8>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.4610	0.624	4	118.4843	0.326	72	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){3|C<3>}	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Ir<6>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.5733	0.451	50	118.4843	0.326	72	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]N[6]H)2(H){1|Ir<6>,1|C<3>}	H(C[6]C[6]N[6])	119.5100	0.477	13	119.3760	0.243	22	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6]H)2(H){2|Ir<6>,1|C<3>}	H(C[6]C[6]N[6])	120.0280	0.000	1	119.3760	0.243	22	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]N[6]H)2(H){1|Ir<8>,1|C<3>}	H(C[6]C[6]N[6])	119.0769	0.379	8	119.3760	0.243	22	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Li)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Li)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Li<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.1271	0.380	15	118.1271	0.144	15	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Li)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Li)(C[6]C[6]H)(H){1|Al<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Li<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.9930	0.212	6	118.3014	0.617	89	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Li)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Li)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Li<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3417	1.016	9	118.3014	0.617	89	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Li)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Li)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Li<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2014	0.469	5	118.3014	0.617	89	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Li)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Li)(C[6]C[6]H)(H){1|C<3>,1|C<4>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Li<4>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	116.1040	0.000	1	118.3014	0.617	89	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Li)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Li)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Li<4>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	117.8800	0.103	2	118.3014	0.617	89	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Li)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Li)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Li<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.7025	0.030	2	118.3014	0.617	89	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Li)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Li)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Li<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	120.4270	0.000	1	118.3014	0.617	89	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Li)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Li)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<4>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Li<5>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	120.2415	3.193	2	118.3014	0.617	89	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Li)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Li)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Li<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3698	0.079	4	118.3014	0.617	89	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Li)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Li)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Li<3>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4412	0.424	8	118.3014	0.617	89	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Li)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Li)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Li<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2936	0.595	41	118.3014	0.617	89	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Li)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Li)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Li<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.0920	0.000	1	118.3014	0.617	89	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Li)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Li)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Li<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5180	0.262	2	118.3014	0.617	89	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Li)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Li)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Li<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.0917	0.162	4	118.3014	0.617	89	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Li)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Li)(C[6]C[6]H)(H){1|Mg<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Li<3>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.0670	0.000	1	118.3014	0.617	89	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mg)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mg)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Mg<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4580	0.334	2	118.5386	0.036	5	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mg)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mg)(C[6]C[6]H)(H){3|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Mg<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5923	0.070	3	118.5386	0.036	5	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mg)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mg)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mg<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.1207	0.227	12	118.6622	1.119	79	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mg)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mg)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mg<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.6035	0.158	2	118.6622	1.119	79	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mg)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mg)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mg<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5550	0.000	1	118.6622	1.119	79	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mg)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mg)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mg<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2120	0.372	7	118.6622	1.119	79	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mg)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mg)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mg<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.8190	0.000	1	118.6622	1.119	79	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mg)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mg)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mg<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.7195	1.572	19	118.6622	1.119	79	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mg)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mg)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mg<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3926	0.279	5	118.6622	1.119	79	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mg)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mg)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mg<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3363	0.368	17	118.6622	1.119	79	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mg)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mg)(C[6]C[6]H)(H){1|C<3>,3|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mg<4>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	119.9220	0.000	1	118.6622	1.119	79	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mg)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mg)(C[6]C[6]H)(H){1|C<3>,3|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mg<5>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	120.6060	0.000	1	118.6622	1.119	79	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mg)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mg)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mg<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4457	0.097	3	118.6622	1.119	79	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mg)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mg)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mg<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2170	0.378	4	118.6622	1.119	79	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mg)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mg)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mg<6>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	118.6200	0.013	2	118.6622	1.119	79	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mg)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mg)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mg<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3573	0.495	3	118.6622	1.119	79	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mg)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mg)(C[6]C[6]H)(H){1|Mg<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mg<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4030	0.000	1	118.6622	1.119	79	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mg)(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mg)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Mg<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.8580	0.170	3	117.6787	0.110	7	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mg)(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mg)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Mg<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.5443	0.381	4	117.6787	0.110	7	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>,2|N<3>}	H(C[6]C[6]N[6])	117.6720	1.734	2	117.6720	3.006	2	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>,1|N<2>,1|O<2>}	H(C[6]C[6]N[6])	118.2720	0.246	2	118.2720	0.061	2	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|Mn<6>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.0618	0.351	12	118.0618	0.123	12	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3620	0.279	10	118.3210	0.440	117	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|C<2>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.9720	0.000	1	118.3210	0.440	117	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.1623	0.342	15	118.3210	0.440	117	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Mn<7>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3683	0.142	3	118.3210	0.440	117	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Mn<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8800	0.267	2	118.3210	0.440	117	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.1996	0.753	42	118.3210	0.440	117	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4164	0.766	39	118.3210	0.440	117	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Mn<7>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5360	0.124	2	118.3210	0.440	117	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){3|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6573	0.279	3	118.3210	0.440	117	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6648	0.287	13	118.7587	1.049	988	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<6>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	119.0150	0.000	1	118.7587	1.049	988	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.0232	1.305	239	118.7587	1.049	988	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<7>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4289	0.298	37	118.7587	1.049	988	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<8>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4645	0.023	2	118.7587	1.049	988	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5378	0.247	5	118.7587	1.049	988	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.9978	0.116	6	118.7587	1.049	988	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2695	0.085	4	118.7587	1.049	988	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<6>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	117.7270	0.000	1	118.7587	1.049	988	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2184	0.572	20	118.7587	1.049	988	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<7>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.2312	1.420	5	118.7587	1.049	988	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<7>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	119.2430	0.000	1	118.7587	1.049	988	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<3>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6600	0.000	1	118.7587	1.049	988	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.9365	1.267	16	118.7587	1.049	988	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5026	0.179	13	118.7587	1.049	988	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<5>,2|C<3>}	H(C[6]C[6]N[6])	118.7925	0.264	2	118.7587	1.049	988	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<6>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	118.5510	0.000	2	118.7587	1.049	988	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8196	1.148	82	118.7587	1.049	988	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<6>,1|C<3>,1|N<3>}	H(C[6]C[6]N[6])	118.7220	0.106	5	118.7587	1.049	988	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<6>,1|C<3>,1|O<2>}	H(C[6]C[6]N[6])	118.4705	0.077	2	118.7587	1.049	988	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<6>,2|C<3>}	H(C[6]C[6]N[6])	118.7425	0.592	17	118.7587	1.049	988	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<7>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4290	0.532	22	118.7587	1.049	988	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<7>,2|C<3>}	H(C[6]C[6]N[6])	118.9050	0.000	1	118.7587	1.049	988	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<9>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3780	0.258	3	118.7587	1.049	988	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2892	0.171	6	118.7587	1.049	988	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.0384	1.472	36	118.7587	1.049	988	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6712	0.833	420	118.7587	1.049	988	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<6>,1|C<3>,1|N<3>}	H(C[6]C[6]N[6])	119.2190	0.000	1	118.7587	1.049	988	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<6>,2|C<3>}	H(C[6]C[6]N[6])	118.5880	0.092	2	118.7587	1.049	988	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<7>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.0948	1.854	16	118.7587	1.049	988	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mn<8>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2423	0.172	7	118.7587	1.049	988	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4885	0.021	2	117.8982	0.428	14	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.7998	0.657	12	117.8982	0.428	14	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|C<3>,1|N<2>,1|O<2>}	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.4257	0.091	3	117.6130	0.146	4	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|O<2>,2|C<3>}	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.1750	0.000	1	117.6130	0.146	4	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.0630	0.170	4	118.0630	0.029	4	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>,2|N<2>}	H(C[6]C[6]N[6])	117.9895	0.310	2	118.2046	0.076	28	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Mn<6>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.1999	0.271	24	118.2046	0.076	28	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){3|C<3>}	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Mn<6>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.4765	0.110	2	118.2046	0.076	28	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]N[6]H)2(H){1|Mn<6>,1|C<3>}	H(C[6]C[6]N[6])	118.9917	0.348	28	119.0401	0.114	44	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6]H)2(H){2|Mn<6>,1|C<3>}	H(C[6]C[6]N[6])	119.1048	0.280	12	119.0401	0.114	44	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]N[6]H)2(H){1|Mn<6>,1|C<3>}	H(C[6]C[6]N[6])	119.1060	0.368	2	119.0401	0.114	44	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|S<2>}	C[6](C[6]N[6]H)2(H){1|Mn<7>,1|C<4>}	H(C[6]C[6]N[6])	119.7160	0.000	1	119.0401	0.114	44	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mn)(C[6]C[6]H)(H){1|N<2>,2|H<1>}	C[6](C[6]N[6]H)2(H){1|Mn<6>,1|C<3>}	H(C[6]C[6]N[6])	118.8090	0.000	1	119.0401	0.114	44	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H)	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|Mo<6>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.0245	0.173	6	118.0245	0.030	6	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Mo<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7491	0.806	24	118.5397	0.465	47	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Mo<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2625	0.182	12	118.5397	0.465	47	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Mo<7>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3266	0.209	5	118.5397	0.465	47	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Mo<8>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.5205	0.132	2	118.5397	0.465	47	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Mo<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.8912	0.159	4	118.5397	0.465	47	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.0823	0.957	21	118.6928	0.605	214	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<7>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8650	0.000	1	118.6928	0.605	214	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<8>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.1969	1.235	16	118.6928	0.605	214	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3672	0.349	12	118.6928	0.605	214	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<8>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6700	0.072	2	118.6928	0.605	214	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.8670	0.000	1	118.6928	0.605	214	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<9>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2050	0.058	2	118.6928	0.605	214	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<9>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4010	0.000	1	118.6928	0.605	214	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<6>,2|C<3>}	H(C[6]C[6]N[6])	119.1530	0.035	2	118.6928	0.605	214	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<7>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8660	0.209	3	118.6928	0.605	214	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<8>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4150	0.000	1	118.6928	0.605	214	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<9>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.9160	1.020	2	118.6928	0.605	214	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<8>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.3450	0.000	1	118.6928	0.605	214	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<9>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.9985	0.111	2	118.6928	0.605	214	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	121.0370	0.000	1	118.6928	0.605	214	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4793	0.158	6	118.6928	0.605	214	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<6>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	118.3190	0.000	1	118.6928	0.605	214	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4935	0.491	45	118.6928	0.605	214	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<8>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6965	0.291	2	118.6928	0.605	214	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<9>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4394	0.123	10	118.6928	0.605	214	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6252	0.894	57	118.6928	0.605	214	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<6>,1|C<3>,1|O<2>}	H(C[6]C[6]N[6])	119.5540	0.000	1	118.6928	0.605	214	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<7>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5561	0.474	8	118.6928	0.605	214	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<8>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4530	0.313	11	118.6928	0.605	214	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<9>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.1733	0.940	3	118.6928	0.605	214	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H){1|Se<2>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Mo<7>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.1135	0.151	2	118.6928	0.605	214	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mo)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Mo<7>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.7176	0.099	20	117.7176	0.010	20	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Nb)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Nb)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Nb<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6540	0.233	2	118.5858	0.138	11	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Nb)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Nb)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Nb<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5707	0.405	9	118.5858	0.138	11	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Nd)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Nd)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Nd<12>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.8330	0.089	3	117.8330	0.008	3	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>,2|N<2>}	H(C[6]C[6]N[6])	118.2770	0.048	2	118.1523	0.044	6	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>,2|N<3>}	H(C[6]C[6]N[6])	118.1755	0.144	2	118.1523	0.044	6	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H){1|Ni<6>,1|H<1>,1|S<2>,2|C<3>}	H(C[6]C[6]N[6])	118.0045	0.347	2	118.1523	0.044	6	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>,1|N<2>,1|O<2>}	H(C[6]C[6]N[6])	118.2665	0.165	2	118.2255	0.046	6	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>,1|N<2>,1|S<2>}	H(C[6]C[6]N[6])	117.9905	0.013	2	118.2255	0.046	6	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>,2|N<2>}	H(C[6]C[6]N[6])	118.4195	0.118	2	118.2255	0.046	6	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|Ni<4>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.0431	1.656	10	118.1051	1.911	14	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|Ni<6>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.2600	0.097	4	118.1051	1.911	14	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3548	0.228	6	118.5879	0.589	121	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ni<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6593	0.264	6	118.5879	0.589	121	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ni<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4660	0.252	4	118.5879	0.589	121	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.1518	0.524	15	118.5879	0.589	121	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|C<3>,2|C<4>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ni<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3984	0.248	5	118.5879	0.589	121	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ni<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.0752	1.380	27	118.5879	0.589	121	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ni<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5670	0.204	2	118.5879	0.589	121	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7214	0.443	20	118.5879	0.589	121	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3980	0.168	36	118.5879	0.589	121	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	C[6](C[6]C[6]Cl)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|Cl<1>,1|C<3>,1|C<4>}	C[6](C[6]C[6]Cl)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.0290	0.000	1	119.0290	0.000	1	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.9380	0.124	4	118.6957	0.895	1615	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|C<2>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>}	H(C[6]C[6]N[6])	117.5350	0.000	1	118.6957	0.895	1615	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6047	0.362	34	118.6957	0.895	1615	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7394	1.717	39	118.6957	0.895	1615	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7150	1.151	320	118.6957	0.895	1615	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<7>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5896	0.657	17	118.6957	0.895	1615	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.1070	1.213	13	118.6957	0.895	1615	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.1347	0.226	10	118.6957	0.895	1615	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2012	0.357	33	118.6957	0.895	1615	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5934	1.255	15	118.6957	0.895	1615	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<8>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.1782	0.441	4	118.6957	0.895	1615	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<4>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	122.7995	0.911	2	118.6957	0.895	1615	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6700	0.000	1	118.6957	0.895	1615	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.1305	0.018	2	118.6957	0.895	1615	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.1243	0.475	4	118.6957	0.895	1615	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<4>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.2347	0.137	3	118.6957	0.895	1615	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Br<1>,1|Ni<6>,1|C<3>}	H(C[6]C[6]N[6])	118.5290	0.133	2	118.6957	0.895	1615	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cl<1>,1|Ni<6>,1|C<3>}	H(C[6]C[6]N[6])	118.5757	0.236	6	118.6957	0.895	1615	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<3>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2275	0.342	2	118.6957	0.895	1615	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6406	0.357	99	118.6957	0.895	1615	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3870	0.269	23	118.6957	0.895	1615	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<5>,1|C<3>,1|N<3>}	H(C[6]C[6]N[6])	118.0900	0.964	2	118.6957	0.895	1615	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<6>,1|C<2>,1|C<3>}	H(C[6]C[6]N[6])	118.3176	0.198	5	118.6957	0.895	1615	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	118.7851	0.198	9	118.6957	0.895	1615	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4384	0.540	177	118.6957	0.895	1615	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|I<1>}	H(C[6]C[6]N[6])	118.5810	0.000	1	118.6957	0.895	1615	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|N<3>}	H(C[6]C[6]N[6])	119.8593	1.876	4	118.6957	0.895	1615	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|O<2>}	H(C[6]C[6]N[6])	119.0785	0.220	2	118.6957	0.895	1615	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|S<4>}	H(C[6]C[6]N[6])	119.6867	1.290	4	118.6957	0.895	1615	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<6>,2|C<3>}	H(C[6]C[6]N[6])	118.6251	0.136	22	118.6957	0.895	1615	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<7>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5200	0.181	8	118.6957	0.895	1615	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|Cl<1>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.0180	0.000	1	118.6957	0.895	1615	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.0856	1.504	81	118.6957	0.895	1615	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<5>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	119.1160	0.137	4	118.6957	0.895	1615	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6841	0.309	22	118.6957	0.895	1615	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7400	0.884	627	118.6957	0.895	1615	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|N<3>}	H(C[6]C[6]N[6])	118.7080	0.403	2	118.6957	0.895	1615	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<7>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7900	0.533	10	118.6957	0.895	1615	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3248	0.178	4	118.2710	1.260	24	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Ni<3>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.8588	0.790	6	118.2710	1.260	24	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4324	1.369	14	118.2710	1.260	24	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|O<2>,2|C<3>}	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2097	0.731	22	118.2097	0.535	22	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2155	0.730	4	118.2155	0.533	4	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Ni<6>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.3610	0.000	1	118.4476	0.240	29	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Ni<5>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.6835	0.168	2	118.4476	0.240	29	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Ni<6>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.4091	0.508	25	118.4476	0.240	29	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){3|C<3>}	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Ni<6>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	119.0250	0.000	1	118.4476	0.240	29	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]N[6]H)2(H){1|Ni<4>,1|C<3>}	H(C[6]C[6]N[6])	118.8715	0.120	4	119.3961	1.069	47	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]N[6]H)2(H){1|Ni<6>,1|C<3>}	H(C[6]C[6]N[6])	119.3660	0.566	23	119.3961	1.069	47	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6]H)2(H){2|Ni<6>,1|C<3>}	H(C[6]C[6]N[6])	119.4327	0.308	7	119.3961	1.069	47	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]N[6]H)2(H){1|Ni<4>,1|C<3>}	H(C[6]C[6]N[6])	118.9940	0.428	3	119.3961	1.069	47	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]N[6]H)2(H){1|Ni<6>,1|C<3>}	H(C[6]C[6]N[6])	120.4655	3.402	4	119.3961	1.069	47	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|S<2>}	C[6](C[6]N[6]H)2(H){1|Ni<6>,1|C<3>}	H(C[6]C[6]N[6])	119.3065	0.197	6	119.3961	1.069	47	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Np)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Np)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Np<7>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5360	0.200	3	118.5360	0.040	3	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Os)(C[6]C[6]H)(H)	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Os)(C[6]C[6]H)(H){3|C<3>}	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|Os<7>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	117.6860	0.000	1	117.6860	0.000	1	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Os)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Os)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Os<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	121.7222	1.018	6	119.2068	2.333	26	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Os)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Os)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<2>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Os<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.5935	0.155	2	119.2068	2.333	26	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Os)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Os)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Os<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5617	0.391	10	119.2068	2.333	26	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Os)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Os)(C[6]C[6]H)(H){3|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Os<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5299	0.327	8	119.2068	2.333	26	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Os)(C[6]C[6]H)(H)	C[6](C[6]C[6]Cl)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Os)(C[6]C[6]H)(H){1|Cl<1>,1|C<3>,1|N<2>}	C[6](C[6]C[6]Cl)(C[6]N[6]H)(H){1|Os<9>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8070	0.000	1	118.8070	0.000	1	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Os)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Os)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Os<10>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	119.7990	0.000	1	118.6630	0.467	324	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Os)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Os)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Os<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.8749	2.204	7	118.6630	0.467	324	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Os)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Os)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Os<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6850	0.000	1	118.6630	0.467	324	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Os)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Os)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Os<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5689	0.884	7	118.6630	0.467	324	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Os)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Os)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Os<7>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.1335	0.812	2	118.6630	0.467	324	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Os)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Os)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Os<8>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7780	0.000	1	118.6630	0.467	324	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Os)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Os)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Os<8>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	119.8253	0.799	3	118.6630	0.467	324	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Os)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Os)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Os<9>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7860	0.078	2	118.6630	0.467	324	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Os)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Os)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Os<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.9473	0.242	10	118.6630	0.467	324	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Os)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Os)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Os<9>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.3685	0.513	2	118.6630	0.467	324	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Os)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Os)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Os<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.8343	0.578	15	118.6630	0.467	324	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Os)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Os)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Os<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4023	0.268	3	118.6630	0.467	324	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Os)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Os)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Os<9>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.1370	0.000	1	118.6630	0.467	324	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Os)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Os)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Os<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8390	0.000	1	118.6630	0.467	324	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Os)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Os)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Os<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.8400	0.133	2	118.6630	0.467	324	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Os)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Os)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Os<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.9372	0.708	10	118.6630	0.467	324	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Os)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Os)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Os<7>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2140	0.548	4	118.6630	0.467	324	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Os)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Os)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Os<9>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2890	0.963	3	118.6630	0.467	324	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Os)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Os)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Os<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2555	0.457	2	118.6630	0.467	324	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Os)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Os)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Os<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7140	0.561	223	118.6630	0.467	324	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Os)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Os)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Os<6>,1|C<3>,1|O<2>}	H(C[6]C[6]N[6])	118.2117	0.169	4	118.6630	0.467	324	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Os)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Os)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Os<7>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5650	0.283	5	118.6630	0.467	324	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Os)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Os)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Os<8>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8000	0.329	5	118.6630	0.467	324	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Os)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Os)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Os<9>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.0050	0.456	10	118.6630	0.467	324	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Os)(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Os)(C[6]C[6]H)(H){3|C<3>}	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Os<7>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.4270	0.000	1	118.4270	0.000	1	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]P[4])(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]P[4])(C[6]C[6]H)(H){1|C<3>,1|H<1>,3|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|P<3>}	H(C[6]C[6]N[6])	118.4677	0.146	4	118.4677	0.021	4	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pb)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pb)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pb<7>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2350	0.000	1	118.2350	0.000	1	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H){1|Pd<4>,1|H<1>,1|S<2>,2|C<3>}	H(C[6]C[6]N[6])	118.7634	0.542	20	118.7634	0.294	20	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H){1|Pd<4>,1|H<1>,1|N<2>,2|C<3>}	H(C[6]C[6]N[6])	118.6523	1.540	4	118.6523	2.373	4	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|Pd<4>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	119.0390	0.594	57	119.0390	0.353	57	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	C[6](C[6]C[6]B)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|B<3>,1|C<3>,1|H<1>}	C[6](C[6]C[6]B)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.2915	0.153	2	119.2915	0.024	2	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	C[6](C[6]C[6]Br)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|Br<1>,1|C<3>,1|H<1>}	C[6](C[6]C[6]Br)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7535	0.018	2	118.7535	0.000	2	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.0590	0.704	17	118.8809	0.654	196	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	119.2090	0.000	1	118.8809	0.654	196	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.0525	1.006	80	118.8809	0.654	196	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7730	0.000	1	118.8809	0.654	196	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<2>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6015	0.194	2	118.8809	0.654	196	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Pd<4>,1|C<2>,1|H<1>}	H(C[6]C[6]N[6])	120.3220	0.000	1	118.8809	0.654	196	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|C<3>,2|C<4>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.1200	0.000	1	118.8809	0.654	196	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6395	0.445	59	118.8809	0.654	196	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Pd<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6273	0.436	9	118.8809	0.654	196	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8780	0.907	21	118.8809	0.654	196	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){3|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7560	0.255	4	118.8809	0.654	196	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	C[6](C[6]C[6]Cl)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|Cl<1>,1|C<3>,1|H<1>}	C[6](C[6]C[6]Cl)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6650	0.134	2	118.6650	0.018	2	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7954	0.083	5	118.9646	0.625	1288	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>}	H(C[6]C[6]N[6])	116.5915	9.203	2	118.9646	0.625	1288	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8747	0.489	171	118.9646	0.625	1288	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.7738	1.767	4	118.9646	0.625	1288	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.1153	0.323	8	118.9646	0.625	1288	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<7>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.0315	1.221	2	118.9646	0.625	1288	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.2733	1.127	6	118.9646	0.625	1288	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	119.0563	0.352	3	118.9646	0.625	1288	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8246	0.654	75	118.9646	0.625	1288	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,2|C<3>}	H(C[6]C[6]N[6])	119.5730	1.212	3	118.9646	0.625	1288	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4113	0.487	7	118.9646	0.625	1288	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8596	0.554	5	118.9646	0.625	1288	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3058	0.246	8	118.9646	0.625	1288	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<4>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3300	0.755	2	118.9646	0.625	1288	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4941	0.254	9	118.9646	0.625	1288	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.0670	0.215	3	118.9646	0.625	1288	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<2>,1|H<1>}	H(C[6]C[6]N[6])	121.7030	0.000	1	118.9646	0.625	1288	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Br<1>,1|Pd<4>,1|C<3>}	H(C[6]C[6]N[6])	118.9403	0.666	3	118.9646	0.625	1288	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cl<1>,1|Pd<4>,1|C<3>}	H(C[6]C[6]N[6])	118.8733	0.484	27	118.9646	0.625	1288	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<2>,1|C<3>}	H(C[6]C[6]N[6])	119.2743	0.582	15	118.9646	0.625	1288	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	119.4718	0.476	11	118.9646	0.625	1288	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8589	0.781	405	118.9646	0.625	1288	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|I<1>}	H(C[6]C[6]N[6])	119.3010	0.000	1	118.9646	0.625	1288	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|N<2>}	H(C[6]C[6]N[6])	119.7360	0.000	1	118.9646	0.625	1288	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|N<3>}	H(C[6]C[6]N[6])	119.6887	0.742	53	118.9646	0.625	1288	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,1|Si<4>,1|C<3>}	H(C[6]C[6]N[6])	119.3677	0.210	13	118.9646	0.625	1288	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,2|C<3>}	H(C[6]C[6]N[6])	119.0844	0.766	21	118.9646	0.625	1288	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6361	0.647	8	118.9646	0.625	1288	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|Cl<1>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.6965	0.861	2	118.9646	0.625	1288	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<3>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8340	0.086	2	118.9646	0.625	1288	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.0035	0.750	371	118.9646	0.625	1288	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|O<2>}	H(C[6]C[6]N[6])	119.3067	0.436	11	118.9646	0.625	1288	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,2|C<3>}	H(C[6]C[6]N[6])	119.3130	0.125	4	118.9646	0.625	1288	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	120.1008	1.790	6	118.9646	0.625	1288	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.1650	0.275	10	118.9646	0.625	1288	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<7>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5228	0.304	8	118.9646	0.625	1288	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<8>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.0130	0.000	1	118.9646	0.625	1288	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|Se<2>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3980	0.000	1	118.9646	0.625	1288	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	C[6](C[6]C[6]I)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|I<1>}	C[6](C[6]C[6]I)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8675	0.359	2	118.8675	0.129	2	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.1565	0.551	63	118.1565	0.304	63	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7158	0.234	6	118.7040	0.044	9	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|C<3>,1|N<3>,1|O<2>}	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6803	0.200	3	118.7040	0.044	9	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.1220	0.285	6	118.1220	0.081	6	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	C[6](C[6]C[6]Se)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|Se<2>,1|C<3>,1|H<1>}	C[6](C[6]C[6]Se)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.9032	0.334	4	118.9032	0.111	4	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>,2|N<2>}	H(C[6]C[6]N[6])	119.0730	0.428	14	118.8563	0.226	28	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Pd<4>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.6396	0.431	14	118.8563	0.226	28	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	C[6](C[6]N[6]H)(C[6]N[6]O)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|N<2>,1|O<2>,1|S<2>}	C[6](C[6]N[6]H)(C[6]N[6]O)(H){1|Pd<4>,1|C<3>}	H(C[6]C[6]N[6])	117.0040	0.000	1	117.0040	0.000	1	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]N[6]H)2(H){1|Pd<4>,1|C<3>}	H(C[6]C[6]N[6])	119.2643	0.414	15	119.3223	0.167	45	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]N[6]H)2(H){1|Pd<6>,1|C<3>}	H(C[6]C[6]N[6])	119.0120	0.088	2	119.3223	0.167	45	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]N[6]H)2(H){1|Pd<4>,1|C<3>}	H(C[6]C[6]N[6])	119.4339	0.411	20	119.3223	0.167	45	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|S<2>}	C[6](C[6]N[6]H)2(H){1|Pd<4>,1|C<3>}	H(C[6]C[6]N[6])	118.8050	0.204	2	119.3223	0.167	45	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>}	C[6](C[6]N[6]H)2(H){2|Pd<4>,1|C<3>}	H(C[6]C[6]N[6])	119.1860	0.071	2	119.3223	0.167	45	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]H)(H){1|N<2>,2|H<1>}	C[6](C[6]N[6]H)2(H){1|Pd<4>,1|C<3>}	H(C[6]C[6]N[6])	119.4640	0.435	4	119.3223	0.167	45	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>,2|N<3>}	H(C[6]C[6]N[6])	118.5575	0.954	2	118.5575	0.910	2	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|Pt<4>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.8753	0.818	20	118.8645	0.637	21	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){3|C<3>}	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|Pt<4>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.6490	0.000	1	118.8645	0.637	21	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	C[6](C[6]C[6]B)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|B<3>,1|C<3>,1|H<1>}	C[6](C[6]C[6]B)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.9553	0.281	8	118.9553	0.079	8	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	C[6](C[6]C[6]Br)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|Br<1>,2|C<3>}	C[6](C[6]C[6]Br)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5564	0.330	5	118.5564	0.109	5	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6265	0.018	2	118.7895	0.300	314	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Pt<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5857	0.162	10	118.7895	0.300	314	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Pt<3>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.1030	0.079	2	118.7895	0.300	314	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	119.1680	0.000	1	118.7895	0.300	314	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8971	0.611	58	118.7895	0.300	314	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Pt<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6390	0.031	2	118.7895	0.300	314	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Pt<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5118	0.252	11	118.7895	0.300	314	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<2>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.0190	0.000	1	118.7895	0.300	314	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8868	0.555	103	118.7895	0.300	314	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Pt<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4790	0.330	10	118.7895	0.300	314	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Pt<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6776	0.653	60	118.7895	0.300	314	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8173	0.195	6	118.7895	0.300	314	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Pt<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5775	0.288	2	118.7895	0.300	314	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Pt<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5510	0.281	10	118.7895	0.300	314	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){3|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.9705	0.439	25	118.7895	0.300	314	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){3|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Pt<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5305	0.249	11	118.7895	0.300	314	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	C[6](C[6]C[6]Cl)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|Cl<1>,1|C<3>,1|C<4>}	C[6](C[6]C[6]Cl)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.0453	0.230	3	118.9918	0.041	5	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	C[6](C[6]C[6]Cl)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|Cl<1>,1|C<3>,1|H<1>}	C[6](C[6]C[6]Cl)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.9115	0.190	2	118.9918	0.041	5	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3945	0.070	2	118.9557	0.599	1231	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8575	0.203	6	118.9557	0.599	1231	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8473	1.013	6	118.9557	0.599	1231	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8540	0.000	1	118.9557	0.599	1231	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|C<2>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>}	H(C[6]C[6]N[6])	117.8080	0.000	1	118.9557	0.599	1231	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.1863	1.598	75	118.9557	0.599	1231	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5900	0.223	2	118.9557	0.599	1231	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8842	0.518	18	118.9557	0.599	1231	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.8139	0.374	9	118.9557	0.599	1231	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.4900	0.000	1	118.9557	0.599	1231	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6434	0.451	51	118.9557	0.599	1231	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5870	0.000	1	118.9557	0.599	1231	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7694	0.661	5	118.9557	0.599	1231	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.1820	0.000	1	118.9557	0.599	1231	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Br<1>,1|Pt<6>,1|C<3>}	H(C[6]C[6]N[6])	118.9690	0.000	1	118.9557	0.599	1231	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<4>,1|C<2>,1|C<3>}	H(C[6]C[6]N[6])	118.5829	0.350	7	118.9557	0.599	1231	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	119.1218	0.280	4	118.9557	0.599	1231	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.9173	0.400	117	118.9557	0.599	1231	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|O<2>}	H(C[6]C[6]N[6])	119.0330	0.000	1	118.9557	0.599	1231	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<4>,2|C<3>}	H(C[6]C[6]N[6])	119.2506	0.431	10	118.9557	0.599	1231	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7906	0.353	8	118.9557	0.599	1231	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<6>,1|C<2>,1|C<3>}	H(C[6]C[6]N[6])	118.3721	0.384	7	118.9557	0.599	1231	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.9627	0.399	20	118.9557	0.599	1231	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<6>,1|C<3>,1|O<2>}	H(C[6]C[6]N[6])	118.8375	0.138	2	118.9557	0.599	1231	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<6>,2|C<3>}	H(C[6]C[6]N[6])	119.7300	0.296	2	118.9557	0.599	1231	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|F<1>}	H(C[6]C[6]N[6])	118.7430	0.085	2	118.9557	0.599	1231	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.9740	0.687	715	118.9557	0.599	1231	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|N<3>}	H(C[6]C[6]N[6])	120.5757	2.994	3	118.9557	0.599	1231	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|O<2>}	H(C[6]C[6]N[6])	119.2920	0.000	1	118.9557	0.599	1231	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<4>,2|C<3>}	H(C[6]C[6]N[6])	119.7325	0.771	4	118.9557	0.599	1231	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8437	0.582	15	118.9557	0.599	1231	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.0410	0.882	108	118.9557	0.599	1231	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){2|Pt<4>,1|C<3>}	H(C[6]C[6]N[6])	119.8250	0.116	2	118.9557	0.599	1231	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|Se<2>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.0550	0.000	1	118.9557	0.599	1231	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|Si<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3212	0.598	10	118.9557	0.599	1231	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|Si<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2370	0.189	4	118.9557	0.599	1231	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|Si<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pt<7>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.2493	0.207	8	118.9557	0.599	1231	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.9324	0.271	14	118.4891	0.540	34	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Pt<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.9140	0.171	2	118.4891	0.540	34	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3928	1.286	6	118.4891	0.540	34	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Pt<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.0029	0.281	8	118.4891	0.540	34	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3220	0.591	2	118.4891	0.540	34	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Pt<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.3610	0.107	2	118.4891	0.540	34	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8912	0.635	8	118.4778	0.442	16	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|Pt<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.7745	0.257	4	118.4778	0.442	16	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|O<2>,2|C<3>}	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|Pt<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3540	0.266	4	118.4778	0.442	16	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	C[6](C[6]C[6]P)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|P<4>,2|C<3>}	C[6](C[6]C[6]P)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.2048	0.183	5	119.2048	0.034	5	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Pt<4>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.9370	0.404	4	118.8975	0.708	10	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){3|C<3>}	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Pt<4>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.8712	1.084	6	118.8975	0.708	10	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]N[6]H)2(H){1|Pt<4>,1|C<3>}	H(C[6]C[6]N[6])	119.6099	0.502	21	119.7631	0.869	30	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]N[6]H)2(H){1|Pt<6>,1|C<3>}	H(C[6]C[6]N[6])	120.3743	0.628	4	119.7631	0.869	30	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|S<2>}	C[6](C[6]N[6]H)2(H){1|Pt<5>,1|C<3>}	H(C[6]C[6]N[6])	119.1165	0.566	2	119.7631	0.869	30	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>}	C[6](C[6]N[6]H)2(H){1|Pt<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	123.5120	0.000	1	119.7631	0.869	30	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>}	C[6](C[6]N[6]H)2(H){2|Pt<4>,1|C<3>}	H(C[6]C[6]N[6])	118.9215	0.613	2	119.7631	0.869	30	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pu)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pu)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pu<11>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5995	0.147	4	118.6560	0.032	5	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pu)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pu)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pu<7>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8820	0.000	1	118.6560	0.032	5	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|H<1>,2|N<2>}	H(C[6]C[6]N[6])	118.5230	0.124	2	118.3847	0.044	4	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){3|C<3>}	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H){1|Re<6>,1|H<1>,1|N<2>,2|C<3>}	H(C[6]C[6]N[6])	118.2465	0.203	2	118.3847	0.044	4	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|Re<6>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	119.1194	2.238	19	119.1194	5.009	19	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Re<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6640	0.358	2	118.5484	0.213	159	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2575	0.492	18	118.5484	0.213	159	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|C<2>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5484	0.164	5	118.5484	0.213	159	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Re<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7110	0.477	6	118.5484	0.213	159	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5062	0.331	26	118.5484	0.213	159	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Re<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4095	0.235	2	118.5484	0.213	159	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5512	0.368	48	118.5484	0.213	159	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Re<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7700	0.074	2	118.5484	0.213	159	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6189	0.656	36	118.5484	0.213	159	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){3|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7125	0.345	14	118.5484	0.213	159	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3880	0.000	1	118.7657	0.650	631	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.0950	0.000	1	118.7657	0.650	631	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	118.6140	0.000	1	118.7657	0.650	631	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8965	0.828	90	118.7657	0.650	631	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<7>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.9635	0.221	2	118.7657	0.650	631	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|C<3>,1|C<5>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<7>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.9748	0.315	4	118.7657	0.650	631	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.1914	1.547	15	118.7657	0.650	631	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<7>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8650	0.000	1	118.7657	0.650	631	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5186	0.476	39	118.7657	0.650	631	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<5>,2|C<3>}	H(C[6]C[6]N[6])	118.0335	0.899	2	118.7657	0.650	631	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.6280	0.000	1	118.7657	0.650	631	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<8>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	119.8100	0.000	1	118.7657	0.650	631	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2525	0.131	2	118.7657	0.650	631	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<5>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	119.0608	0.592	12	118.7657	0.650	631	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.1704	1.833	24	118.7657	0.650	631	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<6>,1|C<2>,1|C<3>}	H(C[6]C[6]N[6])	118.8980	0.000	1	118.7657	0.650	631	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	118.5395	0.447	4	118.7657	0.650	631	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6853	0.564	80	118.7657	0.650	631	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|N<2>}	H(C[6]C[6]N[6])	119.1120	0.000	1	118.7657	0.650	631	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|N<3>}	H(C[6]C[6]N[6])	119.1640	0.350	6	118.7657	0.650	631	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<6>,2|C<3>}	H(C[6]C[6]N[6])	118.5328	0.400	18	118.7657	0.650	631	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5556	0.326	9	118.7657	0.650	631	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	118.6430	0.000	1	118.7657	0.650	631	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8073	0.739	303	118.7657	0.650	631	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|N<3>}	H(C[6]C[6]N[6])	118.7952	0.368	6	118.7657	0.650	631	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|O<2>}	H(C[6]C[6]N[6])	119.4050	1.108	3	118.7657	0.650	631	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<7>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8415	0.175	2	118.7657	0.650	631	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<8>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2670	0.000	1	118.7657	0.650	631	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2450	0.151	2	117.6152	0.479	22	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.5829	0.726	18	117.6152	0.479	22	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Re<8>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.2760	0.177	2	117.6152	0.479	22	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6]N[6])	117.2602	1.241	4	117.2602	1.540	4	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2491	0.240	8	118.2872	0.094	20	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|O<2>,2|C<3>}	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3126	0.353	12	118.2872	0.094	20	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|S<2>,2|C<3>}	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.7600	0.000	1	117.7600	0.000	1	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Re<5>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	119.0733	1.280	6	118.5287	0.495	27	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|H<1>,2|N<2>}	H(C[6]C[6]N[6])	118.2210	0.151	2	118.5287	0.495	27	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Re<6>,1|H<1>,1|N<2>,2|C<3>}	H(C[6]C[6]N[6])	118.2087	0.301	6	118.5287	0.495	27	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Re<6>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.5130	0.459	6	118.5287	0.495	27	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){3|C<3>}	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Re<6>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.4374	0.291	7	118.5287	0.495	27	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]N[6]H)2(H){1|Re<6>,1|C<3>}	H(C[6]C[6]N[6])	119.5301	0.378	18	119.3453	0.308	24	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]N[6]H)2(H){1|Re<6>,1|C<3>}	H(C[6]C[6]N[6])	119.2055	0.206	4	119.3453	0.308	24	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|S<3>}	C[6](C[6]N[6]H)2(H){1|Re<6>,1|C<3>}	H(C[6]C[6]N[6])	117.9740	0.000	1	119.3453	0.308	24	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Re)(C[6]C[6]H)(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Re)(C[6]C[6]H)(H){1|N<2>,2|H<1>}	C[6](C[6]N[6]H)2(H){1|Re<6>,1|C<3>}	H(C[6]C[6]N[6])	117.9490	0.000	1	119.3453	0.308	24	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|Rh<8>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.6258	0.473	22	118.6012	0.214	24	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|Rh<9>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.3310	0.249	2	118.6012	0.214	24	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Rh<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7625	0.262	2	118.6864	0.206	103	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Rh<8>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8602	0.459	12	118.6864	0.206	103	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Rh<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5785	0.046	2	118.6864	0.206	103	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Rh<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5010	0.320	2	118.6864	0.206	103	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Rh<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.0045	0.171	4	118.6864	0.206	103	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Rh<8>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4092	0.463	6	118.6864	0.206	103	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Rh<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6405	0.064	2	118.6864	0.206	103	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Rh<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.9395	0.463	18	118.6864	0.206	103	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Rh<8>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5335	0.087	2	118.6864	0.206	103	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Rh<8>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5868	0.458	51	118.6864	0.206	103	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){3|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Rh<8>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5195	0.193	2	118.6864	0.206	103	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.0514	1.196	7	118.8998	1.014	319	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	120.0126	1.926	20	118.8998	1.014	319	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<7>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6225	0.054	2	118.8998	1.014	319	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<8>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	118.6380	0.163	2	118.8998	1.014	319	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<8>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7695	0.853	13	118.8998	1.014	319	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.0815	0.104	2	118.8998	1.014	319	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.0870	0.061	2	118.8998	1.014	319	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<8>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7140	0.000	1	118.8998	1.014	319	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3709	0.265	19	118.8998	1.014	319	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2260	0.570	8	118.8998	1.014	319	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<6>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	118.3465	0.255	2	118.8998	1.014	319	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<8>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4175	0.321	4	118.8998	1.014	319	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<8>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.4600	0.000	1	118.8998	1.014	319	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<8>,2|C<3>}	H(C[6]C[6]N[6])	118.3555	0.193	2	118.8998	1.014	319	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<8>,1|C<3>,1|O<2>}	H(C[6]C[6]N[6])	119.1070	0.342	6	118.8998	1.014	319	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<4>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5370	0.000	1	118.8998	1.014	319	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<4>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<8>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5790	0.000	1	118.8998	1.014	319	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<8>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2850	0.000	1	118.8998	1.014	319	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<9>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	119.8440	0.467	2	118.8998	1.014	319	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<4>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	118.9800	0.034	2	118.8998	1.014	319	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.0507	1.910	12	118.8998	1.014	319	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<5>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	118.8720	0.000	1	118.8998	1.014	319	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.2657	2.390	7	118.8998	1.014	319	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.0237	1.166	51	118.8998	1.014	319	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<8>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.4478	1.490	9	118.8998	1.014	319	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<8>,2|C<3>}	H(C[6]C[6]N[6])	118.2955	0.030	2	118.8998	1.014	319	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6718	0.739	5	118.8998	1.014	319	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.9962	0.450	12	118.8998	1.014	319	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<6>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	118.9340	0.000	1	118.8998	1.014	319	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.9057	0.410	32	118.8998	1.014	319	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<7>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4278	0.170	6	118.8998	1.014	319	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<8>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7452	0.339	79	118.8998	1.014	319	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<9>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4793	0.344	4	118.8998	1.014	319	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Rh<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.6217	0.418	4	117.6217	0.175	4	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	C[6](C[6]C[6]N[5])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[5])(C[6]N[6]H)(H){2|Rh<8>,3|C<3>}	H(C[6]C[6]N[6])	118.6530	0.000	1	118.6530	0.000	1	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|O<2>,2|C<3>}	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|Rh<8>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3435	0.787	2	118.3435	0.619	2	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Rh<6>,1|C<4>,3|C<3>}	H(C[6]C[6]N[6])	118.8000	0.000	1	118.4447	0.660	13	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Rh<8>,1|C<3>,1|H<1>,2|N<2>}	H(C[6]C[6]N[6])	118.8120	0.300	4	118.4447	0.660	13	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Rh<8>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.2166	0.968	8	118.4447	0.660	13	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]N[6]H)2(H){1|Rh<6>,1|C<3>}	H(C[6]C[6]N[6])	119.7060	0.023	2	119.1226	0.521	7	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Rh)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]N[6]H)2(H){1|Rh<8>,1|C<3>}	H(C[6]C[6]N[6])	118.8892	0.737	5	119.1226	0.521	7	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|Ru<6>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	117.9964	0.333	10	118.1099	0.169	12	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){3|C<3>}	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|Ru<6>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.6775	0.289	2	118.1099	0.169	12	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2400	0.640	4	118.6800	0.686	154	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ru<9>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5172	0.263	4	118.6800	0.686	154	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<2>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6640	0.000	1	118.6800	0.686	154	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8398	0.589	19	118.6800	0.686	154	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ru<9>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4608	0.263	4	118.6800	0.686	154	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<2>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.8455	0.035	2	118.6800	0.686	154	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<2>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ru<9>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.9480	0.000	2	118.6800	0.686	154	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ru<10>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	119.2970	0.168	2	118.6800	0.686	154	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ru<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3970	0.267	2	118.6800	0.686	154	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.0590	0.000	1	118.6800	0.686	154	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<4>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.4990	0.000	1	118.6800	0.686	154	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,2|C<4>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ru<8>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	122.2385	2.258	2	118.6800	0.686	154	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5369	0.549	57	118.6800	0.686	154	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ru<8>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7185	0.054	2	118.6800	0.686	154	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ru<9>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7705	0.069	2	118.6800	0.686	154	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6170	0.171	3	118.6800	0.686	154	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ru<9>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7440	0.087	4	118.6800	0.686	154	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){3|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7810	1.005	42	118.6800	0.686	154	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6]Cl)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|Cl<1>,1|C<3>,1|H<1>}	C[6](C[6]C[6]Cl)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.0645	0.436	2	118.8683	2.034	3	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6]Cl)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|Cl<1>,2|C<3>}	C[6](C[6]C[6]Cl)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	120.4760	0.000	1	118.8683	2.034	3	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4377	0.184	8	118.7923	0.844	1716	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<9>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4070	0.042	2	118.7923	0.844	1716	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<2>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<9>,1|C<3>}	H(C[6]C[6]N[6])	125.3420	0.000	2	118.7923	0.844	1716	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<10>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	119.5340	0.000	1	118.7923	0.844	1716	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<10>,2|C<4>}	H(C[6]C[6]N[6])	119.7870	0.093	2	118.7923	0.844	1716	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.0583	1.911	23	118.7923	0.844	1716	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5997	0.729	123	118.7923	0.844	1716	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<7>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.7416	2.060	7	118.7923	0.844	1716	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<8>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5540	0.281	2	118.7923	0.844	1716	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<8>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	119.6873	0.088	3	118.7923	0.844	1716	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<9>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.0500	1.469	22	118.7923	0.844	1716	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,1|C<5>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<10>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.2960	0.397	2	118.7923	0.844	1716	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.1181	0.984	15	118.7923	0.844	1716	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<8>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3050	0.049	2	118.7923	0.844	1716	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<9>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.9857	0.605	3	118.7923	0.844	1716	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5312	0.968	39	118.7923	0.844	1716	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5407	0.624	23	118.7923	0.844	1716	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<6>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	118.3960	0.000	1	118.7923	0.844	1716	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<7>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.0051	0.795	10	118.7923	0.844	1716	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<7>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	119.3315	0.107	2	118.7923	0.844	1716	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<8>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.3207	1.746	18	118.7923	0.844	1716	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<9>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7258	0.467	21	118.7923	0.844	1716	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<4>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<7>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	119.6040	0.000	1	118.7923	0.844	1716	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<4>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<9>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	120.5180	0.000	1	118.7923	0.844	1716	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<7>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	119.6420	0.000	1	118.7923	0.844	1716	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<7>,1|C<4>,1|O<2>}	H(C[6]C[6]N[6])	119.0335	0.332	2	118.7923	0.844	1716	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<9>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5470	0.025	2	118.7923	0.844	1716	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<4>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<9>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4400	0.000	1	118.7923	0.844	1716	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5798	0.496	5	118.7923	0.844	1716	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cl<1>,1|Ru<6>,1|C<3>}	H(C[6]C[6]N[6])	118.8010	0.000	1	118.7923	0.844	1716	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<5>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	116.1947	2.450	4	118.7923	0.844	1716	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8273	0.748	32	118.7923	0.844	1716	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	119.2345	0.353	4	118.7923	0.844	1716	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7855	0.763	183	118.7923	0.844	1716	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|N<3>}	H(C[6]C[6]N[6])	118.9607	0.201	3	118.7923	0.844	1716	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<6>,2|C<3>}	H(C[6]C[6]N[6])	118.8246	0.881	5	118.7923	0.844	1716	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<7>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2185	0.186	2	118.7923	0.844	1716	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<8>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3479	0.171	11	118.7923	0.844	1716	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<9>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	118.4930	0.000	1	118.7923	0.844	1716	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<9>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6472	0.547	12	118.7923	0.844	1716	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<9>,2|C<3>}	H(C[6]C[6]N[6])	118.6251	0.531	7	118.7923	0.844	1716	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<10>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7005	0.103	2	118.7923	0.844	1716	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5003	0.448	12	118.7923	0.844	1716	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	118.8050	0.008	2	118.7923	0.844	1716	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8223	0.885	940	118.7923	0.844	1716	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|O<2>}	H(C[6]C[6]N[6])	119.5010	0.000	1	118.7923	0.844	1716	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<7>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8633	1.104	30	118.7923	0.844	1716	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<8>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6031	0.382	31	118.7923	0.844	1716	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<9>,1|C<3>,1|F<1>}	H(C[6]C[6]N[6])	118.7673	0.149	6	118.7923	0.844	1716	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<9>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8842	0.320	80	118.7923	0.844	1716	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<9>,1|C<3>,1|O<2>}	H(C[6]C[6]N[6])	119.4807	0.460	3	118.7923	0.844	1716	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6]I)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|I<1>,2|C<3>}	C[6](C[6]C[6]I)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2270	0.297	2	118.2270	0.088	2	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.7629	0.375	42	117.8317	0.172	55	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Ru<8>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.7005	0.059	4	117.8317	0.172	55	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Ru<9>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.9442	0.168	6	117.8317	0.172	55	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.0445	0.090	2	117.8317	0.172	55	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Ru<9>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.1470	0.000	1	117.8317	0.172	55	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6]N[5])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[5])(C[6]N[6]H)(H){2|Ru<9>,3|C<3>}	H(C[6]C[6]N[6])	118.5880	0.420	2	118.5880	0.176	2	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.0970	0.419	18	118.2557	0.246	38	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,1|N<2>,1|O<2>}	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.1535	0.101	2	118.2557	0.246	38	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|O<2>,2|C<3>}	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7048	0.134	6	118.2557	0.246	38	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|O<2>,2|C<3>}	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|Ru<9>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4530	0.364	12	118.2557	0.246	38	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6]P)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|P<4>,2|C<3>}	C[6](C[6]C[6]P)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8890	0.371	4	118.8890	0.138	4	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|Ru<9>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3523	0.270	12	118.3523	0.073	12	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Ru<9>,1|C<3>,1|H<1>,2|N<2>}	H(C[6]C[6]N[6])	118.6441	0.335	22	118.6524	0.098	26	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){3|C<3>}	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Ru<6>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.6983	0.165	4	118.6524	0.098	26	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]N[5a]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[5a]C[6])(C[6]N[6]H)(H){1|Ru<9>,1|H<1>,1|N<2>,2|C<3>}	H(C[6]C[6]N[6])	119.3067	0.593	4	119.3067	0.352	4	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]N[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<2>}	C[6](C[6]N[6]C)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>}	H(C[6]C[6]N[6])	119.2075	0.004	2	119.0128	0.366	5	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]N[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<2>}	C[6](C[6]N[6]C)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>}	H(C[6]C[6]N[6])	117.9400	0.000	1	119.0128	0.366	5	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]N[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|N<2>,2|C<3>}	C[6](C[6]N[6]C)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>}	H(C[6]C[6]N[6])	119.3545	0.050	2	119.0128	0.366	5	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]N[6]H)2(H){1|Ru<6>,1|C<3>}	H(C[6]C[6]N[6])	119.2837	0.787	4	119.3996	0.237	22	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6]H)2(H){2|Ru<6>,1|C<3>}	H(C[6]C[6]N[6])	119.7270	0.334	2	119.3996	0.237	22	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]N[6]H)2(H){1|Ru<6>,1|C<3>}	H(C[6]C[6]N[6])	119.3213	0.522	8	119.3996	0.237	22	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]N[6]H)2(H){1|Ru<9>,1|C<3>}	H(C[6]C[6]N[6])	119.1990	0.000	1	119.3996	0.237	22	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|S<2>}	C[6](C[6]N[6]H)2(H){1|Ru<8>,1|C<4>}	H(C[6]C[6]N[6])	119.4904	0.338	7	119.3996	0.237	22	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Sb)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Sb)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sb<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.3650	0.484	2	119.3650	0.234	2	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Sc)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Sc)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sc<13>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	122.6690	0.000	1	118.9964	2.627	7	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Sc)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Sc)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sc<8>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4008	0.082	4	118.9964	2.627	7	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Sc)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Sc)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sc<9>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3515	0.025	2	118.9964	2.627	7	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Si)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Si)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Si<4>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	118.8310	0.000	1	118.7065	0.039	19	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Si)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Si)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Si<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.9800	0.100	2	118.7065	0.039	19	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Si)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Si)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Si<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6720	0.140	4	118.7065	0.039	19	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Si)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Si)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Si<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6621	0.201	12	118.7065	0.039	19	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Si)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Si)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Si<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8370	0.000	1	119.0215	0.290	8	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Si)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Si)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Si<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.9868	0.779	4	119.0215	0.290	8	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Si)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Si)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Si<6>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	119.2780	0.059	2	119.0215	0.290	8	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Si)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Si)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Si<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8320	0.000	1	119.0215	0.290	8	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Si)(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Si)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>,1|P<4>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Si<4>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	117.5760	0.000	1	118.0087	0.241	17	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Si)(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Si)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Si<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.0493	0.576	12	118.0087	0.241	17	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Si)(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Si)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Si<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.9952	0.021	4	118.0087	0.241	17	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Sm)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Sm)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Sm<11>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.9963	0.217	3	117.9963	0.047	3	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Sm)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Sm)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sm<12>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.1118	0.454	4	118.2168	0.121	18	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Sm)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Sm)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sm<14>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3040	0.181	4	118.2168	0.121	18	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Sm)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Sm)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sm<10>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2505	0.527	2	118.2168	0.121	18	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Sm)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Sm)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sm<13>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6615	0.179	2	118.2168	0.121	18	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Sm)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Sm)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sm<14>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3440	0.000	1	118.2168	0.121	18	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Sm)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Sm)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sm<15>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.8610	0.385	2	118.2168	0.121	18	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Sm)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Sm)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sm<9>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.1167	0.241	3	118.2168	0.121	18	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Sm)(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Sm)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Sm<12>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.3437	0.086	3	118.3437	0.007	3	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Sn)(C[6]C[6]H)(H)	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Sn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|Sn<5>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	117.8935	0.070	2	117.8935	0.005	2	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Sn)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Sn)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Sn<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.0900	0.132	2	118.3090	0.120	12	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Sn)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Sn)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Sn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7895	0.152	2	118.3090	0.120	12	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Sn)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Sn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Sn<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2436	0.313	8	118.3090	0.120	12	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Sn)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Sn)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5097	0.557	9	118.7811	0.209	101	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Sn)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Sn)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8210	0.486	2	118.7811	0.209	101	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Sn)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Sn)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7567	0.244	9	118.7811	0.209	101	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Sn)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Sn)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sn<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7245	0.283	6	118.7811	0.209	101	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Sn)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Sn)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.2960	0.031	3	118.7811	0.209	101	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Sn)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Sn)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7715	0.268	6	118.7811	0.209	101	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Sn)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Sn)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sn<9>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6243	0.152	4	118.7811	0.209	101	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Sn)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Sn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sn<3>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5169	0.528	14	118.7811	0.209	101	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Sn)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Sn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7740	0.310	10	118.7811	0.209	101	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Sn)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Sn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.9228	0.458	26	118.7811	0.209	101	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Sn)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Sn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sn<6>,1|C<3>,1|O<2>}	H(C[6]C[6]N[6])	120.3300	0.000	1	118.7811	0.209	101	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Sn)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Sn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sn<7>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4518	0.353	4	118.7811	0.209	101	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Sn)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Sn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sn<8>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.1215	0.016	4	118.7811	0.209	101	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Sn)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Sn)(C[6]C[6]H)(H){1|Se<2>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.9673	0.365	3	118.7811	0.209	101	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Sn)(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Sn)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Sn<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.8870	0.126	8	117.8870	0.016	8	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Sn)(C[6]C[6]H)(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Sn)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|S<2>}	C[6](C[6]N[6]H)2(H){1|Sn<7>,1|C<3>}	H(C[6]C[6]N[6])	119.4067	0.152	3	119.4067	0.023	3	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Sr)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Sr)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sr<10>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.0030	0.006	2	118.1126	0.034	15	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Sr)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Sr)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sr<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.0752	0.205	6	118.1126	0.034	15	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Sr)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Sr)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sr<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2260	0.196	5	118.1126	0.034	15	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Sr)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Sr)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Sr<12>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.0510	0.091	2	118.1126	0.034	15	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ta)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ta)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ta<10>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4890	0.000	1	118.7995	0.473	13	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ta)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ta)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ta<10>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	119.5075	0.305	2	118.7995	0.473	13	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ta)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ta)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ta<13>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	119.7060	0.430	2	118.7995	0.473	13	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ta)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ta)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ta<10>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3680	0.953	2	118.7995	0.473	13	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ta)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ta)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ta<8>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4570	0.367	6	118.7995	0.473	13	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Tc)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Tc)(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Tc<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.9360	0.167	2	118.3840	0.133	6	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Tc)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Tc)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Tc<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6080	0.112	4	118.3840	0.133	6	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Tc)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Tc)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Tc<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5915	0.052	2	118.9543	0.748	26	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Tc)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Tc)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Tc<7>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.5760	1.952	4	118.9543	0.748	26	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Tc)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Tc)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Tc<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8662	0.528	20	118.9543	0.748	26	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Te)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Te)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Te<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.1190	0.000	1	119.1780	0.054	3	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Te)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Te)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Te<7>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.2075	0.322	2	119.1780	0.054	3	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Te)(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Te)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Te<3>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2970	0.167	2	118.2970	0.028	2	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Th)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Th)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Th<14>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.4140	0.000	1	119.4140	0.000	1	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Th)(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Th)(C[6]C[6]H)(H){1|C<3>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Th<13>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7950	0.000	1	118.7950	0.000	1	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ti)(C[6]C[6]H)(H)	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ti)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|Ti<12>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.0640	0.296	4	118.0640	0.088	4	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ti)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ti)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ti<6>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	118.8070	0.000	1	118.5603	0.048	3	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ti)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ti)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ti<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4370	0.071	2	118.5603	0.048	3	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ti)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ti)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ti<11>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	117.8190	0.024	2	118.5745	0.139	88	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ti)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ti)(C[6]C[6]H)(H){1|C<3>,1|C<5>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ti<10>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8220	0.000	1	118.5745	0.139	88	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ti)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ti)(C[6]C[6]H)(H){1|C<3>,1|C<5>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ti<10>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	118.7650	0.000	1	118.5745	0.139	88	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ti)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ti)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ti<9>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	119.5610	0.188	2	118.5745	0.139	88	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ti)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ti)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ti<9>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	119.2275	0.233	2	118.5745	0.139	88	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ti)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ti)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ti<10>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6548	0.317	5	118.5745	0.139	88	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ti)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ti)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ti<12>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5426	0.245	10	118.5745	0.139	88	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ti)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ti)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ti<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4596	0.215	11	118.5745	0.139	88	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ti)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ti)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ti<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6077	0.314	28	118.5745	0.139	88	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ti)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ti)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ti<7>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4905	0.117	8	118.5745	0.139	88	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ti)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ti)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ti<8>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6237	0.277	13	118.5745	0.139	88	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ti)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ti)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ti<9>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5285	0.107	2	118.5745	0.139	88	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ti)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ti)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ti<11>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.4700	0.082	2	118.5745	0.139	88	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ti)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ti)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ti<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.9520	0.000	1	118.5745	0.139	88	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ti)(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ti)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Ti<10>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.8255	0.120	4	117.8255	0.014	4	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ti)(C[6]C[6]H)(H)	C[6](C[6]N[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ti)(C[6]C[6]H)(H){1|N<2>,2|C<3>}	C[6](C[6]N[6]C)(C[6]N[6]H)(H){1|Ti<10>,1|C<3>}	H(C[6]C[6]N[6])	119.4630	0.000	1	119.4630	0.000	1	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Yb)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Yb)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Yb<15>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	118.7490	0.000	1	118.7490	0.000	1	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H){1|Zn<4>,1|C<3>,1|H<1>,2|N<3>}	H(C[6]C[6]N[6])	118.1930	0.274	2	118.1754	0.036	8	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H){1|Zn<6>,1|C<3>,1|H<1>,2|N<2>}	H(C[6]C[6]N[6])	118.3450	0.054	2	118.1754	0.036	8	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H){1|Zn<6>,1|C<3>,1|H<1>,2|N<3>}	H(C[6]C[6]N[6])	118.0817	0.164	4	118.1754	0.036	8	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H){1|Zn<4>,1|H<1>,1|N<2>,2|C<3>}	H(C[6]C[6]N[6])	118.1990	0.492	4	118.1990	0.242	4	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|Zn<4>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.7225	0.390	16	118.6457	0.138	23	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|Zn<5>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.5425	0.211	6	118.6457	0.138	23	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|Zn<6>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.0350	0.000	1	118.6457	0.138	23	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Zn<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5453	0.178	3	118.5113	0.185	123	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Zn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5794	0.393	27	118.5113	0.185	123	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Zn<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4517	0.150	6	118.5113	0.185	123	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Zn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3365	0.028	2	118.5113	0.185	123	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Zn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6670	0.157	4	118.5113	0.185	123	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Zn<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5995	0.223	4	118.5113	0.185	123	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Zn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4630	0.326	12	118.5113	0.185	123	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Zn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7231	0.535	24	118.5113	0.185	123	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Zn<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3043	0.497	29	118.5113	0.185	123	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Zn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4445	0.276	11	118.5113	0.185	123	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){3|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Zn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5360	0.000	1	118.5113	0.185	123	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<2>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<4>,1|C<2>}	H(C[6]C[6]N[6])	121.4110	0.000	1	118.7316	0.501	1100	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5944	0.356	63	118.7316	0.501	1100	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.0566	0.989	135	118.7316	0.501	1100	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7531	0.660	75	118.7316	0.501	1100	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3466	0.341	7	118.7316	0.501	1100	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6245	0.426	2	118.7316	0.501	1100	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.9740	0.298	2	118.7316	0.501	1100	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4903	0.744	37	118.7316	0.501	1100	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2246	0.432	13	118.7316	0.501	1100	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.9748	0.200	4	118.7316	0.501	1100	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<4>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5780	0.000	1	118.7316	0.501	1100	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5850	0.000	1	118.7316	0.501	1100	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3400	0.000	1	118.7316	0.501	1100	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6820	0.000	1	118.7316	0.501	1100	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<6>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	118.5620	0.113	2	118.7316	0.501	1100	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<5>,1|C<2>,1|H<1>}	H(C[6]C[6]N[6])	117.6820	0.000	1	118.7316	0.501	1100	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Cl<1>,1|Zn<4>,1|C<3>}	H(C[6]C[6]N[6])	118.8680	0.166	6	118.7316	0.501	1100	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<4>,1|C<2>,1|C<3>}	H(C[6]C[6]N[6])	118.8415	0.098	2	118.7316	0.501	1100	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<4>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	118.9764	0.088	9	118.7316	0.501	1100	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<4>,1|C<3>,1|F<1>}	H(C[6]C[6]N[6])	118.9637	0.092	3	118.7316	0.501	1100	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5859	0.605	72	118.7316	0.501	1100	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<4>,1|C<3>,1|I<1>}	H(C[6]C[6]N[6])	119.1925	0.723	2	118.7316	0.501	1100	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<4>,1|C<3>,1|N<3>}	H(C[6]C[6]N[6])	119.1712	0.351	13	118.7316	0.501	1100	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<4>,1|C<3>,1|O<2>}	H(C[6]C[6]N[6])	119.3670	0.000	1	118.7316	0.501	1100	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<4>,1|C<3>,1|S<2>}	H(C[6]C[6]N[6])	118.4600	0.000	1	118.7316	0.501	1100	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<4>,2|C<3>}	H(C[6]C[6]N[6])	118.3864	0.572	5	118.7316	0.501	1100	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<5>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	118.8213	0.069	3	118.7316	0.501	1100	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7531	0.796	116	118.7316	0.501	1100	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<5>,1|C<3>,1|N<3>}	H(C[6]C[6]N[6])	118.8353	0.192	3	118.7316	0.501	1100	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<5>,2|C<3>}	H(C[6]C[6]N[6])	118.9085	0.121	4	118.7316	0.501	1100	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<6>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	118.4490	0.000	1	118.7316	0.501	1100	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4374	0.323	24	118.7316	0.501	1100	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<6>,2|C<3>}	H(C[6]C[6]N[6])	118.6286	0.116	9	118.7316	0.501	1100	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<3>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	122.0850	0.000	1	118.7316	0.501	1100	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7247	0.534	118	118.7316	0.501	1100	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<5>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	118.7650	0.239	2	118.7316	0.501	1100	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6614	0.427	171	118.7316	0.501	1100	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<5>,1|C<3>,1|N<3>}	H(C[6]C[6]N[6])	119.0510	0.000	1	118.7316	0.501	1100	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<5>,1|C<3>,1|O<2>}	H(C[6]C[6]N[6])	119.0710	0.000	1	118.7316	0.501	1100	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7150	0.855	179	118.7316	0.501	1100	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<6>,1|C<3>,1|N<2>}	H(C[6]C[6]N[6])	118.7940	0.000	1	118.7316	0.501	1100	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<6>,1|C<3>,1|N<3>}	H(C[6]C[6]N[6])	119.1200	0.427	2	118.7316	0.501	1100	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<6>,1|C<3>,1|O<2>}	H(C[6]C[6]N[6])	119.4550	0.068	3	118.7316	0.501	1100	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<6>,2|C<3>}	H(C[6]C[6]N[6])	118.7470	0.000	1	118.7316	0.501	1100	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Zn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.9000	0.882	4	118.0193	0.292	62	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Zn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.1121	0.142	8	118.0193	0.292	62	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Zn<4>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	118.3430	0.000	1	118.0193	0.292	62	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Zn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.1240	0.674	30	118.0193	0.292	62	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Zn<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.8429	0.258	14	118.0193	0.292	62	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Zn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.7763	0.086	4	118.0193	0.292	62	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Zn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.7310	0.000	1	118.0193	0.292	62	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	C[6](C[6]C[6]N[5])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[5])(C[6]N[6]H)(H){1|Zn<3>,1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6]N[6])	117.8965	0.371	2	117.6735	0.120	4	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	C[6](C[6]C[6]N[5])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[5])(C[6]N[6]H)(H){1|Zn<5>,1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6]N[6])	117.4505	0.148	2	117.6735	0.120	4	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H){1|Zn<4>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.3255	0.071	4	118.3255	0.005	4	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<3>,1|N<2>,1|O<2>}	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|Zn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.6755	0.295	4	117.9502	0.118	10	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|O<2>,2|C<3>}	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|Zn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.1333	0.243	6	117.9502	0.118	10	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|Zn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5130	0.227	4	118.3878	1.404	6	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|Zn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.1375	2.584	2	118.3878	1.404	6	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Zn<6>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.7360	0.000	1	118.3310	0.313	41	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Zn<4>,1|H<1>,1|N<2>,2|C<3>}	H(C[6]C[6]N[6])	118.4402	0.232	4	118.3310	0.313	41	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Zn<4>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.1672	0.244	4	118.3310	0.313	41	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Zn<5>,1|H<1>,1|N<2>,2|C<3>}	H(C[6]C[6]N[6])	118.3489	0.334	8	118.3310	0.313	41	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Zn<5>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.2898	0.874	14	118.3310	0.313	41	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Zn<6>,1|H<1>,1|N<2>,2|C<3>}	H(C[6]C[6]N[6])	118.0662	0.202	4	118.3310	0.313	41	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Zn<6>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.3872	0.155	4	118.3310	0.313	41	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){3|C<3>}	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Zn<6>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.8715	0.267	2	118.3310	0.313	41	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	C[6](C[6]N[5a]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[5a]C[6])(C[6]N[6]H)(H){1|Zn<4>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.0420	0.148	2	118.0420	0.022	2	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]N[6]H)2(H){1|Zn<5>,1|C<3>}	H(C[6]C[6]N[6])	119.0710	0.202	2	119.0363	0.078	10	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]N[6]H)2(H){1|Zn<6>,1|C<3>}	H(C[6]C[6]N[6])	119.1587	0.145	3	119.0363	0.078	10	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6]H)2(H){2|Zn<6>,1|C<3>}	H(C[6]C[6]N[6])	119.3065	0.185	2	119.0363	0.078	10	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]N[6]H)2(H){1|Zn<4>,1|C<3>}	H(C[6]C[6]N[6])	118.5420	0.000	1	119.0363	0.078	10	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]H)(H){1|H<1>,2|N<2>}	C[6](C[6]N[6]H)2(H){1|Zn<4>,1|C<3>}	H(C[6]C[6]N[6])	118.7950	0.181	2	119.0363	0.078	10	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zr)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zr)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Zr<12>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	118.6274	0.105	7	118.6274	0.011	7	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zr)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zr)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zr<8>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	118.7310	0.308	2	118.6510	0.194	20	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zr)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zr)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zr<13>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	120.2120	0.000	1	118.6510	0.194	20	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zr)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zr)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zr<10>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4935	0.037	2	118.6510	0.194	20	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zr)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zr)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zr<7>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4725	0.140	4	118.6510	0.194	20	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zr)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zr)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zr<9>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6082	0.153	4	118.6510	0.194	20	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zr)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zr)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zr<13>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.1680	0.000	1	118.6510	0.194	20	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zr)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zr)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zr<14>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	118.8840	0.275	3	118.6510	0.194	20	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zr)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zr)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zr<8>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4053	0.216	3	118.6510	0.194	20	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zr)(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zr)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Zr<13>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	117.7150	0.000	1	119.0847	4.153	6	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zr)(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zr)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Zr<14>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.4375	0.363	2	119.0847	4.153	6	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zr)(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zr)(C[6]C[6]H)(H){1|C<3>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Zr<12>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.6350	0.173	2	119.0847	4.153	6	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zr)(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zr)(C[6]C[6]H)(H){1|C<3>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Zr<13>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	122.6480	0.000	1	119.0847	4.153	6	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6a]B[6])(C[6]C[6]H)(H)	C[6](C[6]C[6a]O[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6a]B[6])(C[6]C[6]H)(H){1|O<2>,2|F<1>,3|C<3>}	C[6](C[6]C[6a]O[6])(C[6]N[6]H)(H){1|B<4>,3|C<3>}	H(C[6]C[6]N[6])	120.7980	0.000	1	120.7980	0.000	1	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<2>}	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|H<1>,4|C<3>}	H(C[6]C[6]N[6])	119.5888	1.087	4	120.0216	2.184	63	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,4|C<3>}	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|H<1>,4|C<3>}	H(C[6]C[6]N[6])	120.0509	1.503	59	120.0216	2.184	63	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<2>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]N[6])	119.6530	0.232	2	119.5776	0.089	18	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,4|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]N[6])	119.5681	0.310	16	119.5776	0.089	18	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|P<3>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]N[6])	120.6073	1.836	3	119.9692	0.521	23	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]N[6])	119.4490	0.000	1	119.9692	0.521	23	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,1|P<3>,3|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]N[6])	119.6380	0.000	1	119.9692	0.521	23	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,1|P<4>,3|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]N[6])	119.4400	0.000	1	119.9692	0.521	23	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(H){2|H<1>,3|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]N[6])	119.9378	0.419	17	119.9692	0.521	23	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]N[6])	119.1960	0.102	2	119.0847	0.031	4	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]N[6])	118.9735	0.179	2	119.0847	0.031	4	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[5])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6]N[5])(C[6]N[6]H)(H){1|H<1>,2|C<3>,2|C<4>}	H(C[6]C[6]N[6])	119.4165	0.158	2	119.4165	0.025	2	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H){1|H<1>,2|C<3>,2|C<4>}	H(C[6]C[6]N[6])	119.3120	0.055	2	119.3120	0.003	2	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,1|O<2>,3|C<3>}	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]N[6])	119.3655	0.121	2	118.9953	0.418	3	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(H){2|O<1>,3|C<3>}	C[6](C[6]C[6]O)(C[6]N[6]H)(H){3|C<3>}	H(C[6]C[6]N[6])	118.2550	0.000	1	118.9953	0.418	3	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<2>}	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|H<1>,4|C<3>}	H(C[6]C[6]N[6])	125.5985	1.056	2	120.5361	4.723	14	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,4|C<3>}	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|H<1>,4|C<3>}	H(C[6]C[6]N[6])	119.6923	0.210	12	120.5361	4.723	14	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6a]N[6])(C[6]C[6]H)(H){4|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]N[6])	119.2930	0.000	1	119.2930	0.000	1	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(H){2|Cl<1>,1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]N[6]H)2(H){1|Si<5>,2|C<3>}	H(C[6]C[6]N[6])	117.5670	1.681	2	117.5670	2.827	2	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]Ga[3x6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]Ga[3x6]C[6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,3|S<2>}	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|Ga<4>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	119.0525	0.821	2	119.0525	0.674	2	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]Ga[3x6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]Ga[3x6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,3|S<2>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ga<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.1025	0.636	4	119.1025	0.404	4	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]Ga[3x6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]Ga[3x6]C[6])(C[6]C[6]H)(H){1|C<3>,2|H<1>,2|N<3>,2|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ga<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6515	0.056	2	118.6515	0.003	2	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]Ga[3x6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]Ga[3x6]C[6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,3|S<2>}	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Ga<4>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.5760	0.636	3	118.5760	0.404	3	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]Ga[5]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]Ga[5]C[6])(C[6]C[6]H)(H){1|C<3>,1|I<1>,2|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ga<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.0355	0.136	2	118.9389	0.013	8	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]Ga[5]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]Ga[5]C[6])(C[6]C[6]H)(H){1|C<3>,1|P<2>,2|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ga<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.9067	0.096	6	118.9389	0.013	8	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]Ga[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]Ga[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>,3|S<2>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Ga<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2050	0.491	2	118.2050	0.241	2	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]Ga[6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]Ga[6]C[6])(C[6]C[6]H)(H){1|Br<1>,1|C<3>,1|C<4>,1|H<1>,2|S<2>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ga<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8867	0.286	6	118.8867	0.082	6	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]Ga[6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]Ga[6]C[6])(C[6]C[6]H)(H){1|C<3>,1|P<2>,2|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ga<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7885	0.100	2	118.7320	0.051	5	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]Ga[6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]Ga[6]C[6])(C[6]C[6]H)(H){1|Cl<1>,2|H<1>,3|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ga<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8560	0.164	2	118.7320	0.051	5	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]Ga[6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]Ga[6]C[6])(C[6]C[6]H)(H){2|Cl<1>,1|C<3>,1|C<4>,1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ga<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3710	0.000	1	118.7320	0.051	5	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]Ga[6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]Ga[6]C[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,2|N<3>,2|S<2>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Ga<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2475	0.548	4	118.2475	0.300	4	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]Ge[4,6]C[6a])(C[6]C[6]H)(H)	C[6](C[6]N[6]H)2(H)	H(C[6]C[6]N[6])	C[6](N[6]Ge[4,6]C[6a])(C[6]C[6]H)(H){2|As<2>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]N[6]H)2(H){1|Ge<4>,2|C<3>}	H(C[6]C[6]N[6])	116.9450	0.245	4	116.9450	0.060	4	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]Ge[4]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]Ge[4]C[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,3|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Ge<3>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.0960	0.117	2	118.0960	0.014	2	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]Ge[4x6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]Ge[4x6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,5|N<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ge<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5295	0.224	2	118.5295	0.050	2	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]Ge[4x6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]Ge[4x6]C[6])(C[6]C[6]H)(H){1|C<3>,2|H<1>,4|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ge<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.9065	0.111	2	118.9065	0.012	2	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]In[3x5]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]In[3x5]C[6])(C[6]C[6]H)(H){1|Cl<1>,1|C<3>,1|N<4>,2|H<1>,3|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|In<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.1570	0.465	2	119.1570	0.216	2	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]In[5]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]In[5]C[6])(C[6]C[6]H)(H){1|Cl<1>,1|C<3>,2|H<1>,2|N<3>,2|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|In<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7180	0.169	4	118.7180	0.029	4	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]In[6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]In[6]C[6])(C[6]C[6]H)(H){1|C<4>,2|H<1>,3|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|In<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5970	0.197	2	118.5970	0.039	2	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]N[6]Ce)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]N[6]Ce)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ce<17>,1|H<1>,1|N<3>}	H(C[6]C[6]N[6])	118.8090	0.035	2	118.8090	0.001	2	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]N[6]Co)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]N[6]Co)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Co<6>,1|H<1>,1|N<2>}	H(C[6]C[6]N[6])	118.5927	0.184	4	118.5927	0.034	4	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]N[6]Ni)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]N[6]Ni)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<6>,1|H<1>,1|N<2>}	H(C[6]C[6]N[6])	118.6096	0.290	10	118.5670	0.067	14	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]N[6]Ni)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]N[6]Ni)(C[6]C[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ni<6>,1|H<1>,1|N<3>}	H(C[6]C[6]N[6])	118.4605	0.135	4	118.5670	0.067	14	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]N[6]Pd)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]N[6]Pd)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Pd<4>,1|H<1>,1|N<2>}	H(C[6]C[6]N[6])	119.1245	0.147	4	119.1245	0.022	4	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]N[6]Re)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]N[6]Re)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<6>,1|H<1>,1|N<2>}	H(C[6]C[6]N[6])	119.6950	0.000	1	118.6827	0.225	7	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]N[6]Re)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]N[6]Re)(C[6]C[6]H)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Re<6>,1|H<1>,1|N<3>}	H(C[6]C[6]N[6])	118.5140	0.175	6	118.6827	0.225	7	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]N[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]N[6]Ru)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<6>,1|H<1>,1|N<2>}	H(C[6]C[6]N[6])	118.6500	0.000	1	118.6500	0.000	1	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]N[6]Zn)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]N[6]Zn)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zn<4>,1|H<1>,1|N<2>}	H(C[6]C[6]N[6])	118.8880	0.227	4	118.8880	0.052	4	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]Nb[3,3,3x6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]Nb[3,3,3x6]C[6])(C[6]C[6]H)(H){2|C<4>,2|H<1>,3|C<3>,3|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Nb<8>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4050	0.134	2	118.4050	0.018	2	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]Nb[3,3]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]Nb[3,3]C[6])(C[6]C[6]H)(H){1|Nb<6>,1|C<3>,1|N<2>,1|N<3>,2|H<1>,2|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Nb<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5360	0.331	2	118.5360	0.110	2	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]Nb[3x3]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]Nb[3x3]C[6])(C[6]C[6]H)(H){1|Cl<1>,1|Cl<2>,1|Nb<7>,1|C<3>,2|H<1>,3|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Nb<7>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2010	0.397	4	118.5205	0.218	12	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]Nb[3x3]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]Nb[3x3]C[6])(C[6]C[6]H)(H){1|Cl<1>,1|Nb<7>,3|Cl<2>,1|C<3>,1|N<2>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Nb<7>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5140	0.707	2	118.5205	0.218	12	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]Nb[3x3]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]Nb[3x3]C[6])(C[6]C[6]H)(H){1|Cl<2>,1|Nb<7>,2|Cl<1>,1|C<3>,2|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Nb<7>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7365	0.381	2	118.5205	0.218	12	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]Nb[3x3]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]Nb[3x3]C[6])(C[6]C[6]H)(H){1|Nb<7>,3|Cl<2>,1|C<3>,1|N<2>,1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Nb<7>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7352	0.444	4	118.5205	0.218	12	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]Nb[3x5]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]Nb[3x5]C[6])(C[6]C[6]H)(H){1|C<3>,2|H<1>,6|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Nb<7>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8850	0.010	2	118.8850	0.000	2	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]Nb[3x6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]Nb[3x6]C[6])(C[6]C[6]H)(H){1|C<3>,1|N<2>,1|P<4>,2|H<1>,3|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Nb<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6700	0.023	2	118.6260	0.187	4	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]Nb[3x6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]Nb[3x6]C[6])(C[6]C[6]H)(H){1|Cl<1>,1|C<3>,1|N<2>,2|H<1>,3|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Nb<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5820	0.742	2	118.6260	0.187	4	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]Nb[5]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]Nb[5]C[6])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>,2|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Nb<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2820	0.088	2	118.2820	0.008	2	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]Nb[6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]Nb[6]C[6])(C[6]C[6]H)(H){1|C<3>,1|N<2>,2|C<2>,2|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Nb<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4740	0.000	1	118.4740	0.000	1	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]Nb[6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]Nb[6]C[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>,1|O<1>,3|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Nb<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.7335	0.103	2	117.7335	0.011	2	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]Si[4]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]Si[4]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,1|S<1>,1|S<2>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Si<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.7903	0.138	3	119.7903	0.019	3	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]Si[4]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]Si[4]C[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|W<6>,3|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Si<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3095	0.156	2	118.3095	0.024	2	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]Si[5]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]Si[5]C[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>,1|O<1>,2|C<4>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Si<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2735	0.029	2	118.2735	0.001	2	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]Si[6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]Si[6]C[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>,3|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Si<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3990	0.016	2	118.3235	0.020	6	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]Si[6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]Si[6]C[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>,3|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Si<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4060	0.150	2	118.3235	0.020	6	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]Si[6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]Si[6]C[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<3>,3|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Si<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.1655	0.008	2	118.3235	0.020	6	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]Si[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]Si[6a]C[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,3|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Si<3>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.9020	0.109	2	117.9020	0.012	2	118.7654	0.801	27370	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:I-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]I)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(I)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]I)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(I){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7820	0.000	1	118.7820	0.000	1	118.8736	0.152	5	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:I-1:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]C[6]I)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(I)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]C[6]I)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(I){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6590	0.000	1	118.6590	0.000	1	118.8736	0.152	5	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:I-1:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]I)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(I)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]I)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(I){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.5570	0.000	1	119.5570	0.000	1	118.8736	0.152	5	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:I-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]I)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(I)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]I)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(I){1|Zn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6850	0.130	2	118.6850	0.017	2	118.8736	0.152	5	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](N[6]B[5,6]C)(C[6]N[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]N[6])	C[6](N[6]B[5,6]C)(C[6]N[6]H)(H){1|C<3>,1|C<4>,2|O<2>}	C[6](C[6]N[6]H)(N[6]C[6]C)(H){1|C<4>,2|B<4>}	H(C[6]C[6]N[6])	117.9700	0.315	2	117.9700	0.099	2	118.6010	0.489	5	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](N[6]B[5]C[6])(C[6]N[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6]B)(H)	H(C[6]C[6]N[6])	C[6](N[6]B[5]C[6])(C[6]N[6]H)(H){1|B<3>,1|C<3>,1|H<1>,2|O<2>}	C[6](C[6]N[6]H)(N[6]C[6]B)(H){1|B<3>,2|C<3>}	H(C[6]C[6]N[6])	119.3530	0.000	1	119.3530	0.000	1	118.6010	0.489	5	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Fe)(C[6]N[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Fe)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]N[6]H)(N[6]C[6]H)(H){1|Fe<6>,1|C<3>,1|N<3>}	H(C[6]C[6]N[6])	119.2820	0.000	1	119.2820	0.000	1	118.6010	0.489	5	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]N[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6]O)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]N[6]H)(H){1|O<1>,2|C<3>}	C[6](C[6]N[6]H)(N[6]C[6]O)(H){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4300	0.000	1	118.4300	0.000	1	118.6010	0.489	5	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:O-1:	C[6]-3:	C[6](N[6]N[6]Ru)(C[6]N[6]O)(H)	C[6](C[6]N[6]H)(N[6]C[6]H)(O)	H(C[6]C[6]N[6])	C[6](N[6]N[6]Ru)(C[6]N[6]O)(H){1|C<3>,2|H<1>}	C[6](C[6]N[6]H)(N[6]C[6]H)(O){1|Ru<9>,1|N<3>,1|O<1>}	H(C[6]C[6]N[6])	117.6510	0.000	1	117.6510	0.000	1	117.6510	0.000	1	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[4,6]C)(C[6]N[6]H)(H)	C[6](N[6]C[4,6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[4,6]C)(C[6]N[6]H)(H){1|C<3>,1|H<1>,2|C<4>}	C[6](N[6]C[4,6]C)(C[6]N[6]H)(H){1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6]N[6])	118.4417	0.616	8	118.4417	0.379	8	119.1214	1.091	180	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]O)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]O)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]O)(C[6]N[6]H)(H){1|O<1>,2|C<3>}	C[6](N[6]C[6,6a]O)(C[6]N[6]H)(H){1|O<1>,2|C<3>}	H(C[6]C[6]N[6])	119.0425	0.157	4	119.0425	0.025	4	119.1214	1.091	180	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]Pt)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]Pt)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Pt)(C[6]N[6]H)(H){1|Pt<4>,2|C<3>}	C[6](N[6]C[6,6a]Pt)(C[6]N[6]H)(H){1|Pt<4>,2|C<3>}	H(C[6]C[6]N[6])	118.3036	1.211	8	118.3036	1.467	8	119.1214	1.091	180	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]N[6]H)(H)	C[6](N[6]C[6]Co)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]N[6]H)(H){1|Co<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]N[6]H)(H){1|Co<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8045	0.258	2	120.8445	17.965	6	119.1214	1.091	180	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]N[6]H)(H)	C[6](N[6]C[6]Co)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]N[6]H)(H){1|Co<6>,2|C<3>}	C[6](N[6]C[6]Co)(C[6]N[6]H)(H){1|Co<6>,2|C<3>}	H(C[6]C[6]N[6])	124.8330	6.481	2	120.8445	17.965	6	119.1214	1.091	180	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]N[6]H)(H)	C[6](N[6]C[6]Co)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]N[6]H)(H){1|Co<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]N[6]H)(H){1|Co<8>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8960	0.124	2	120.8445	17.965	6	119.1214	1.091	180	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]N[6]H)(H)	C[6](N[6]C[6]Re)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]N[6]H)(H){1|Re<6>,2|C<3>}	C[6](N[6]C[6]Re)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.1600	0.000	1	119.1600	0.000	1	119.1214	1.091	180	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H){1|Cu<3>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7535	0.098	2	119.0257	0.244	18	119.1214	1.091	180	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H){1|Cu<3>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.0980	0.287	2	119.0257	0.244	18	119.1214	1.091	180	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6197	0.873	4	119.0257	0.244	18	119.1214	1.091	180	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|O<2>}	H(C[6]C[6]N[6])	119.3240	0.000	1	119.0257	0.244	18	119.1214	1.091	180	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|O<2>}	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8060	0.000	1	119.0257	0.244	18	119.1214	1.091	180	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.2687	0.222	8	119.0257	0.244	18	119.1214	1.091	180	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H)	C[6](N[6]C[6]Re)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Re)(C[6]N[6]H)(H){1|Cu<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6500	0.061	2	118.6500	0.004	2	119.1214	1.091	180	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ga)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ga)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ga)(C[6]N[6]H)(H){1|Ga<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ga)(C[6]N[6]H)(H){1|Ga<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.6970	0.243	2	119.6970	0.059	2	119.1214	1.091	180	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]N[6]H)(H){1|Ir<6>,2|C<3>}	C[6](N[6]C[6]Ir)(C[6]N[6]H)(H){1|Ir<6>,2|C<3>}	H(C[6]C[6]N[6])	119.5170	0.875	2	119.0515	0.483	58	119.1214	1.091	180	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]N[6]H)(H){1|Ir<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]N[6]H)(H){1|Ir<7>,1|Ir<8>,1|C<3>}	H(C[6]C[6]N[6])	119.2728	0.803	4	119.0515	0.483	58	119.1214	1.091	180	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]N[6]H)(H){1|Ir<7>,1|Ir<8>,1|C<3>}	C[6](N[6]C[6]Ir)(C[6]N[6]H)(H){1|Ir<7>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.4060	0.611	4	119.0515	0.483	58	119.1214	1.091	180	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.9997	0.694	46	119.0515	0.483	58	119.1214	1.091	180	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|N<3>}	C[6](N[6]C[6]Ir)(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|N<3>}	H(C[6]C[6]N[6])	118.6250	0.665	2	119.0515	0.483	58	119.1214	1.091	180	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mn)(C[6]N[6]H)(H)	C[6](N[6]C[6]Mn)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mn)(C[6]N[6]H)(H){1|Mn<6>,2|C<3>}	C[6](N[6]C[6]Mn)(C[6]N[6]H)(H){1|Mn<6>,2|C<3>}	H(C[6]C[6]N[6])	122.0390	1.899	2	122.0390	3.607	2	119.1214	1.091	180	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pd)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8785	0.411	4	118.8785	0.169	4	119.1214	1.091	180	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pt)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.2874	0.349	8	119.2678	0.099	10	119.1214	1.091	180	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pt)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]N[6]H)(H){1|Pt<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]N[6]H)(H){1|Pt<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.1895	0.139	2	119.2678	0.099	10	119.1214	1.091	180	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.4300	0.189	4	119.4300	0.036	4	119.1214	1.091	180	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Re)(C[6]N[6]H)(H)	C[6](N[6]C[6]Co)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Re)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]N[6]H)(H){1|Re<6>,2|C<3>}	H(C[6]C[6]N[6])	119.2580	0.000	1	119.2580	0.000	1	119.1214	1.091	180	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Re)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Re)(C[6]N[6]H)(H){1|Cu<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.4605	0.053	2	119.4605	0.003	2	119.1214	1.091	180	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Re)(C[6]N[6]H)(H)	C[6](N[6]C[6]Re)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Re)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Re)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.0021	0.562	10	119.0021	0.315	10	119.1214	1.091	180	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Rh)(C[6]N[6]H)(H)	C[6](N[6]C[6]Rh)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Rh)(C[6]N[6]H)(H){1|Rh<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]N[6]H)(H){1|Rh<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.6760	0.099	2	119.2979	0.131	18	119.1214	1.091	180	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Rh)(C[6]N[6]H)(H)	C[6](N[6]C[6]Rh)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Rh)(C[6]N[6]H)(H){1|Rh<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]N[6]H)(H){1|Rh<8>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.2506	0.355	16	119.2979	0.131	18	119.1214	1.091	180	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pt)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.9865	0.190	4	118.9865	0.036	4	119.1214	1.091	180	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4775	0.031	4	118.8686	0.242	8	119.1214	1.091	180	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]N[6]H)(H){1|Ru<9>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]N[6]H)(H){1|Ru<9>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.9800	0.247	2	118.8686	0.242	8	119.1214	1.091	180	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]N[6]H)(H){1|Ru<9>,2|C<3>}	C[6](N[6]C[6]Ru)(C[6]N[6]H)(H){1|Ru<9>,2|C<3>}	H(C[6]C[6]N[6])	119.5395	0.301	2	118.8686	0.242	8	119.1214	1.091	180	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]N[6]H)(H)	C[6](N[6]C[6]Zn)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]N[6]H)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]N[6]H)(H){1|Zn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.9380	0.266	4	119.0903	0.100	10	119.1214	1.091	180	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]N[6]H)(H)	C[6](N[6]C[6]Zn)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]N[6]H)(H){1|Zn<4>,2|C<3>}	C[6](N[6]C[6]Zn)(C[6]N[6]H)(H){1|Zn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.4290	0.000	1	119.0903	0.100	10	119.1214	1.091	180	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]N[6]H)(H)	C[6](N[6]C[6]Zn)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]N[6]H)(H){1|Zn<6>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Zn)(C[6]N[6]H)(H){1|Zn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8845	0.333	2	119.0903	0.100	10	119.1214	1.091	180	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]N[6]H)(H)	C[6](N[6]C[6]Zn)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]N[6]H)(H){1|Zn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]N[6]H)(H){1|Zn<4>,2|C<3>}	H(C[6]C[6]N[6])	119.0460	0.000	1	119.0903	0.100	10	119.1214	1.091	180	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	N[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]N[6]H)(H)	C[6](N[6]C[6]Zn)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]N[6]H)(H){1|Zn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]N[6]H)(H){1|Zn<6>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	119.4535	0.120	2	119.0903	0.100	10	119.1214	1.091	180	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	P[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](P[6]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]P[6]H)(H)	H(C[6]C[6]P[6])	C[6](P[6]C[6]Cu)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]P[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>}	H(C[6]C[6]P[6])	118.0780	0.000	1	118.0780	0.000	1	118.7460	0.628	6	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:1:	3:	P[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](P[6]C[6]Re)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]P[6]H)(H)	H(C[6]C[6]P[6])	C[6](P[6]C[6]Re)(C[6]C[6]H)(H){1|Cl<1>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]P[6]H)(H){1|Re<6>,1|C<3>,1|H<1>}	H(C[6]C[6]P[6])	118.8796	0.807	5	118.8796	0.651	5	118.7460	0.628	6	120.0624	1.251	191394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]C)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]C)(CN)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]C)(H){1|C<2>,2|C<4>,3|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]C)(CN){1|C<4>,1|N<2>,1|N<3>}	H(C[6]C[5,6]C[6])	121.1060	0.000	1	121.1260	0.001	2	121.1260	0.001	2	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]C)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]C)(CN)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]C)(H){1|C<2>,2|C<4>,3|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]C)(CN){1|C<4>,2|N<3>}	H(C[6]C[5,6]C[6])	121.1460	0.000	1	121.1260	0.001	2	121.1260	0.001	2	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[5,6]C[5,6]N[5,6])(C[6]C[6]O)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(OC)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]N[5,6])(C[6]C[6]O)(H){1|C<3>,1|N<3>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(OC){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[5,6]C[6])	125.3570	0.000	1	125.3570	0.000	1	125.3570	0.000	1	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6a]-3:C[6]-2:	C[6]-3:	C[6](C[5,6]C[5,5]C[5,6])(C[6]C[6a]C[6])(H)	C[6](C[6]C[5,6]H)(C[6a]C[6a]2)(C[6]C[6])	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,5]C[5,6])(C[6]C[6a]C[6])(H){7|C<3>}	C[6](C[6]C[5,6]H)(C[6a]C[6a]2)(C[6]C[6]){1|C<4>,3|C<3>,3|H<1>}	H(C[6]C[5,6]C[6])	120.1920	0.000	1	120.1920	0.000	1	120.1920	0.000	1	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6a]-3:O[6]-2:	C[6]-3:	C[6](C[5,6]N[5,6]O[5])(C[6]C[6a]O[6])(H)	C[6](C[6]C[5,6]H)(C[6a]C[6a]2)(O[6]B[6])	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]O[5])(C[6]C[6a]O[6])(H){1|B<4>,4|C<3>}	C[6](C[6]C[5,6]H)(C[6a]C[6a]2)(O[6]B[6]){1|H<1>,1|N<3>,2|C<3>,2|F<1>,2|O<2>}	H(C[6]C[5,6]C[6])	121.1580	0.206	3	121.1453	0.022	6	121.4047	0.600	9	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6a]-3:O[6]-2:	C[6]-3:	C[6](C[5,6]N[5,6]O[5])(C[6]C[6a]O[6])(H)	C[6](C[6]C[5,6]H)(C[6a]C[6a]2)(O[6]B[6])	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]O[5])(C[6]C[6a]O[6])(H){1|B<4>,4|C<3>}	C[6](C[6]C[5,6]H)(C[6a]C[6a]2)(O[6]B[6]){1|N<3>,1|O<2>,2|C<3>,2|F<1>,2|H<1>}	H(C[6]C[5,6]C[6])	121.1327	0.115	3	121.1453	0.022	6	121.4047	0.600	9	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6a]-3:O[6]-2:	C[6]-3:	C[6](C[5,6]N[5,6]S[5])(C[6]C[6a]O[6])(H)	C[6](C[6]C[5,6]H)(C[6a]C[6a]2)(O[6]B[6])	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]S[5])(C[6]C[6a]O[6])(H){1|B<4>,4|C<3>}	C[6](C[6]C[5,6]H)(C[6a]C[6a]2)(O[6]B[6]){1|N<3>,1|S<2>,2|C<3>,2|F<1>,2|H<1>}	H(C[6]C[5,6]C[6])	122.6820	0.167	2	121.9233	1.741	3	121.4047	0.600	9	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6a]-3:O[6]-2:	C[6]-3:	C[6](C[5,6]N[5,6]S[5])(C[6]C[6a]O[6])(H)	C[6](C[6]C[5,6]H)(C[6a]C[6a]2)(O[6]B[6])	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]S[5])(C[6]C[6a]O[6])(H){1|B<4>,4|C<3>}	C[6](C[6]C[5,6]H)(C[6a]C[6a]2)(O[6]B[6]){1|N<3>,1|S<2>,2|H<1>,4|C<3>}	H(C[6]C[5,6]C[6])	120.4060	0.000	1	121.9233	1.741	3	121.4047	0.600	9	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6a]-3:O[6]-2:	C[6]-3:	C[6](C[5a,6]N[5a,6]C[5a])(C[6]C[6a]O[6])(H)	C[6](C[6]C[5a,6]H)(C[6a]C[6a]2)(O[6]C[6])	H(C[6]C[5a,6]C[6])	C[6](C[5a,6]N[5a,6]C[5a])(C[6]C[6a]O[6])(H){1|H<1>,5|C<3>}	C[6](C[6]C[5a,6]H)(C[6a]C[6a]2)(O[6]C[6]){1|N<2>,1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[5a,6]C[6])	119.6790	0.000	1	119.6790	0.000	1	119.6790	0.000	1	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6,6]C[3x6]C[6])(C[6]C[6]O)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(OC)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[3x6]C[6])(C[6]C[6]O)(H){1|H<1>,1|O<1>,2|C<3>,2|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]O)(OC){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6,6]C[6])	119.1990	0.000	1	119.1990	0.000	1	119.1464	0.215	5	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(OC)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){1|C<2>,1|H<1>,2|C<4>,2|O<2>}	C[6](C[6]C[6,6]H)(C[6]C[6]O)(OC){1|C<3>,1|C<4>}	H(C[6]C[6,6]C[6])	119.4980	0.000	1	118.9510	0.229	3	119.1464	0.215	5	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(OC)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){1|O<2>,2|C<4>,2|O<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]O)(OC){2|C<3>,2|C<4>}	H(C[6]C[6,6]C[6])	118.6775	0.093	2	118.9510	0.229	3	119.1464	0.215	5	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(OH)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){1|C<4>,1|O<1>,3|C<3>}	C[6](C[6]C[6,6]H)(C[6]C[6]O)(OH){1|H<1>,2|C<3>}	H(C[6]C[6,6]C[6])	119.6800	0.000	1	119.6800	0.000	1	119.1464	0.215	5	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6a]-3:O[6]-2:	C[6]-3:	C[6](C[6,6]C[6,6,6a]O[6])(C[6]C[6a]O[6])(H)	C[6](C[6]C[6,6]H)(C[6a]C[6a]2)(O[6]C[6,6a])	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6,6a]O[6])(C[6]C[6a]O[6])(H){1|Ga<6>,4|C<3>}	C[6](C[6]C[6,6]H)(C[6a]C[6a]2)(O[6]C[6,6a]){1|O<2>,2|H<1>,4|C<3>}	H(C[6]C[6,6]C[6])	120.1470	0.702	3	120.1470	0.493	3	119.0157	0.494	40	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6a]-3:O[6]-2:	C[6]-3:	C[6](C[6,6]C[6,6a]C[6,6])(C[6]C[6a]O[6])(H)	C[6](C[6]C[6,6]H)(C[6a]C[6a]2)(O[6]C[6])	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]C[6,6])(C[6]C[6a]O[6])(H){1|C<4>,5|C<3>}	C[6](C[6]C[6,6]H)(C[6a]C[6a]2)(O[6]C[6]){2|H<1>,5|C<3>}	H(C[6]C[6,6]C[6])	116.8600	0.000	1	116.8600	0.000	1	119.0157	0.494	40	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6a]-3:O[6]-2:	C[6]-3:	C[6](C[6,6]C[6,6a]N[6,6])(C[6]C[6a]O[6])(H)	C[6](C[6]C[6,6]H)(C[6a]C[6a]2)(O[6]B[6])	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]N[6,6])(C[6]C[6a]O[6])(H){1|B<4>,5|C<3>}	C[6](C[6]C[6,6]H)(C[6a]C[6a]2)(O[6]B[6]){1|N<3>,2|F<1>,2|H<1>,3|C<3>}	H(C[6]C[6,6]C[6])	118.2362	0.276	4	118.2362	0.076	4	119.0157	0.494	40	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6a]-3:O[6]-2:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]C[6a]O[6])(H)	C[6](C[6]C[6,6]H)(C[6a]C[6a]2)(O[6]B[6])	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]C[6a]O[6])(H){1|B<4>,1|C<4>,1|N<2>,3|C<3>}	C[6](C[6]C[6,6]H)(C[6a]C[6a]2)(O[6]B[6]){1|N<3>,2|F<1>,2|H<1>,3|C<3>}	H(C[6]C[6,6]C[6])	119.0290	0.024	2	119.0744	0.226	32	119.0157	0.494	40	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6a]-3:O[6]-2:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]C[6a]O[6])(H)	C[6](C[6]C[6,6]H)(C[6a]C[6a]2)(O[6]B[6])	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]C[6a]O[6])(H){1|B<4>,1|H<1>,1|N<2>,3|C<3>}	C[6](C[6]C[6,6]H)(C[6a]C[6a]2)(O[6]B[6]){1|N<3>,2|F<1>,2|H<1>,3|C<3>}	H(C[6]C[6,6]C[6])	119.2180	0.050	4	119.0744	0.226	32	119.0157	0.494	40	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6a]-3:O[6]-2:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]C[6a]O[6])(H)	C[6](C[6]C[6,6]H)(C[6a]C[6a]2)(O[6]B[6])	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]C[6a]O[6])(H){1|B<4>,1|H<1>,1|N<2>,3|C<3>}	C[6](C[6]C[6,6]H)(C[6a]C[6a]2)(O[6]B[6]){1|N<3>,2|H<1>,5|C<3>}	H(C[6]C[6,6]C[6])	120.5490	0.064	2	119.0744	0.226	32	119.0157	0.494	40	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6a]-3:O[6]-2:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]C[6a]O[6])(H)	C[6](C[6]C[6,6]H)(C[6a]C[6a]2)(O[6]B[6])	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]C[6a]O[6])(H){1|B<4>,1|H<1>,4|C<3>}	C[6](C[6]C[6,6]H)(C[6a]C[6a]2)(O[6]B[6]){1|N<3>,2|F<1>,2|H<1>,3|C<3>}	H(C[6]C[6,6]C[6])	118.8535	0.278	17	119.0744	0.226	32	119.0157	0.494	40	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6a]-3:O[6]-2:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]C[6a]O[6])(H)	C[6](C[6]C[6,6]H)(C[6a]C[6a]2)(O[6]B[6])	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]C[6a]O[6])(H){1|B<4>,1|H<1>,4|C<3>}	C[6](C[6]C[6,6]H)(C[6a]C[6a]2)(O[6]B[6]){1|N<3>,2|H<1>,5|C<3>}	H(C[6]C[6,6]C[6])	119.2544	0.168	5	119.0744	0.226	32	119.0157	0.494	40	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6a]-3:O[6]-2:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]C[6a]O[6])(H)	C[6](C[6]C[6,6]H)(C[6a]C[6a]2)(O[6]B[6])	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]C[6a]O[6])(H){1|B<4>,1|N<2>,4|C<3>}	C[6](C[6]C[6,6]H)(C[6a]C[6a]2)(O[6]B[6]){1|N<3>,2|F<1>,2|H<1>,3|C<3>}	H(C[6]C[6,6]C[6])	118.7855	0.252	2	119.0744	0.226	32	119.0157	0.494	40	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6,6a]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:O[6]-2:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5a]O[6])(H)	C[6](C[5a]C[5a]O[5a])(C[6]C[6,6a]H)(O[6]C[6])	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5a]O[6])(H){1|H<1>,1|O<2>,4|C<3>}	C[6](C[5a]C[5a]O[5a])(C[6]C[6,6a]H)(O[6]C[6]){1|H<1>,1|S<1>,4|C<3>}	H(C[6]C[6,6a]C[6])	123.0420	0.000	2	123.0420	0.000	2	123.0420	0.000	2	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(CC)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(CC){1|C<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.8280	0.071	3	119.9767	0.136	7	119.9137	0.118	9	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(CC)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(CC){1|Ir<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.8205	0.630	2	119.9767	0.136	7	119.9137	0.118	9	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(CC)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(CC){1|Ru<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.3560	0.079	2	119.9767	0.136	7	119.9137	0.118	9	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H)	C[6](C[6]C[6,6a]H)(C[6]O[6]N)(CN)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H){1|H<1>,1|N<1>,1|O<2>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]O[6]N)(CN){2|C<3>}	H(C[6]C[6,6a]C[6])	119.6460	0.000	1	119.6460	0.000	1	119.9137	0.118	9	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(CC)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(CC){1|Cu<4>,4|C<3>}	H(C[6]C[6,6a]C[6])	119.7400	0.000	1	119.7400	0.000	1	119.9137	0.118	9	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]O)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(OC)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]O)(H){1|O<1>,4|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(OC){1|O<1>,2|C<3>}	H(C[6]C[6,6a]C[6])	118.8820	0.167	2	118.8820	0.028	2	118.8820	0.028	2	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6a]-3:C[6]-2:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]C[6])(H)	C[6](C[6]C[6,6a]H)(C[6a]C[6a]2)(C[6]N[6])	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]C[6])(H){1|H<1>,1|N<3>,4|C<3>}	C[6](C[6]C[6,6a]H)(C[6a]C[6a]2)(C[6]N[6]){1|Ir<6>,2|H<1>,4|C<3>}	H(C[6]C[6,6a]C[6])	120.1020	0.221	2	120.1020	0.049	2	120.1020	0.049	2	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6a]-3:N[6]-2:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]N[6])(H)	C[6](C[6]C[6,6a]H)(C[6a]C[6a]2)(N[6]S[6])	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]N[6])(H){1|H<1>,1|S<4>,4|C<3>}	C[6](C[6]C[6,6a]H)(C[6a]C[6a]2)(N[6]S[6]){1|C<4>,1|O<1>,2|H<1>,4|C<3>}	H(C[6]C[6,6a]C[6])	118.5140	0.000	1	118.5140	0.000	1	118.5140	0.000	1	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6a]-3:O[6]-2:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]O[6])(H)	C[6](C[6]C[6,6a]H)(C[6a]C[6a]2)(O[6]C[6,6])	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]O[6])(H){1|C<4>,1|H<1>,4|C<3>}	C[6](C[6]C[6,6a]H)(C[6a]C[6a]2)(O[6]C[6,6]){1|C<4>,1|O<2>,2|H<1>,4|C<3>}	H(C[6]C[6,6a]C[6])	119.3895	0.128	2	119.3895	0.016	2	119.5561	1.159	25	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6a]-3:O[6]-2:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]O[6])(H)	C[6](C[6]C[6,6a]H)(C[6a]C[6a]2)(O[6]C[6])	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]O[6])(H){1|C<4>,1|H<1>,4|C<3>}	C[6](C[6]C[6,6a]H)(C[6a]C[6a]2)(O[6]C[6]){1|C<4>,3|H<1>,4|C<3>}	H(C[6]C[6,6a]C[6])	119.6700	0.146	4	119.6860	0.999	22	119.5561	1.159	25	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6a]-3:O[6]-2:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]O[6])(H)	C[6](C[6]C[6,6a]H)(C[6a]C[6a]2)(O[6]C[6])	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]O[6])(H){1|C<4>,1|H<1>,4|C<3>}	C[6](C[6]C[6,6a]H)(C[6a]C[6a]2)(O[6]C[6]){3|H<1>,5|C<3>}	H(C[6]C[6,6a]C[6])	120.2310	0.000	1	119.6860	0.999	22	119.5561	1.159	25	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6a]-3:O[6]-2:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]O[6])(H)	C[6](C[6]C[6,6a]H)(C[6a]C[6a]2)(O[6]C[6])	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]O[6])(H){1|C<4>,1|H<1>,4|C<3>}	C[6](C[6]C[6,6a]H)(C[6a]C[6a]2)(O[6]C[6]){4|C<3>,4|H<1>}	H(C[6]C[6,6a]C[6])	119.4815	0.067	2	119.6860	0.999	22	119.5561	1.159	25	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6a]-3:O[6]-2:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]O[6])(H)	C[6](C[6]C[6,6a]H)(C[6a]C[6a]2)(O[6]C[6])	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]O[6])(H){1|H<1>,5|C<3>}	C[6](C[6]C[6,6a]H)(C[6a]C[6a]2)(O[6]C[6]){1|Cl<1>,1|H<1>,1|S<1>,4|C<3>}	H(C[6]C[6,6a]C[6])	118.3920	0.000	1	119.6860	0.999	22	119.5561	1.159	25	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6a]-3:O[6]-2:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]O[6])(H)	C[6](C[6]C[6,6a]H)(C[6a]C[6a]2)(O[6]C[6])	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]O[6])(H){1|H<1>,5|C<3>}	C[6](C[6]C[6,6a]H)(C[6a]C[6a]2)(O[6]C[6]){1|N<2>,2|H<1>,4|C<3>}	H(C[6]C[6,6a]C[6])	119.4240	0.408	3	119.6860	0.999	22	119.5561	1.159	25	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6a]-3:O[6]-2:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]O[6])(H)	C[6](C[6]C[6,6a]H)(C[6a]C[6a]2)(O[6]C[6])	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]O[6])(H){1|H<1>,5|C<3>}	C[6](C[6]C[6,6a]H)(C[6a]C[6a]2)(O[6]C[6]){1|S<1>,2|H<1>,4|C<3>}	H(C[6]C[6,6a]C[6])	120.0053	1.541	8	119.6860	0.999	22	119.5561	1.159	25	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6a]-3:O[6]-2:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]O[6])(H)	C[6](C[6]C[6,6a]H)(C[6a]C[6a]2)(O[6]C[6])	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]O[6])(H){1|H<1>,5|C<3>}	C[6](C[6]C[6,6a]H)(C[6a]C[6a]2)(O[6]C[6]){2|H<1>,5|C<3>}	H(C[6]C[6,6a]C[6])	119.7475	0.655	2	119.6860	0.999	22	119.5561	1.159	25	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6a]-3:O[6]-2:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]O[6])(H)	C[6](C[6]C[6,6a]H)(C[6a]C[6a]2)(O[6]C[6])	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]O[6])(H){1|H<1>,5|C<3>}	C[6](C[6]C[6,6a]H)(C[6a]C[6a]2)(O[6]C[6]){3|H<1>,4|C<3>}	H(C[6]C[6,6a]C[6])	119.0170	0.000	1	119.6860	0.999	22	119.5561	1.159	25	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6a]-3:O[6]-2:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]O[6])(H)	C[6](C[6]C[6,6a]H)(C[6a]C[6a]2)(O[6]P[6])	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]O[6])(H){1|H<1>,1|P<4>,4|C<3>}	C[6](C[6]C[6,6a]H)(C[6a]C[6a]2)(O[6]P[6]){1|O<1>,1|O<2>,2|H<1>,4|C<3>}	H(C[6]C[6,6a]C[6])	117.0310	0.000	1	117.0310	0.000	1	119.5561	1.159	25	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6a]-3:S[6]-2:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]S[6])(H)	C[6](C[6]C[6,6a]H)(C[6a]C[6a]2)(S[6]C[6])	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]S[6])(H){1|H<1>,5|C<3>}	C[6](C[6]C[6,6a]H)(C[6a]C[6a]2)(S[6]C[6]){1|S<1>,2|H<1>,4|C<3>}	H(C[6]C[6,6a]C[6])	116.9880	0.000	1	116.9880	0.000	1	116.9880	0.000	1	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:O-2:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]O)(H)	C[6](C[6]C[6,6a]H)(N[6]C[6]S)(OC)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]O)(H){1|C<4>,1|H<1>,1|S<4>,2|C<3>}	C[6](C[6]C[6,6a]H)(N[6]C[6]S)(OC){1|H<1>,1|O<2>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.0120	0.000	1	120.0120	0.000	1	120.0120	0.000	1	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:S-2:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]S)(H)	C[6](C[6]C[6,6a]H)(N[6]C[6]S)(SC)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]S)(H){1|C<4>,1|H<1>,1|S<4>,2|C<3>}	C[6](C[6]C[6,6a]H)(N[6]C[6]S)(SC){1|H<1>,3|C<3>}	H(C[6]C[6,6a]C[6])	119.4600	0.000	1	119.4600	0.000	1	119.4600	0.000	1	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6,6a]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]N)(H)	C[6](N[6]C[6a]C[6])(C[6]C[6,6a]H)(NS)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]N)(H){1|H<1>,4|C<3>}	C[6](N[6]C[6a]C[6])(C[6]C[6,6a]H)(NS){1|H<1>,1|N<2>,3|C<3>}	H(C[6]C[6,6a]C[6])	118.5460	0.000	1	118.5460	0.000	1	118.5460	0.000	1	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C-3:C[6]-3:C[6]-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](CC[5a]C[5])(C[6]C[6]H)(C[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](CC[5a]C[5])(C[6]C[6]H)(C[6]C[6]){1|C<3>,2|H<1>}	H(C[6]C[6]2)	116.6150	0.000	1	112.4525	34.653	2	112.4525	34.653	2	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C-3:C[6]-3:C[6]-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](CC[5a]C[5])(C[6]C[6]H)(C[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|O<2>}	C[6](CC[5a]C[5])(C[6]C[6]H)(C[6]C[6]){1|C<3>,2|H<1>}	H(C[6]C[6]2)	108.2900	0.000	1	112.4525	34.653	2	112.4525	34.653	2	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[5,6]O)(C[6]C[6]O)(H)	C[6](C[5,6]C[5,6]2)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[5,6]O)(C[6]C[6]O)(H){1|C<4>,2|C<3>}	C[6](C[5,6]C[5,6]2)(C[6]C[6]H)(OC){1|C<3>,1|H<1>,1|O<1>,1|O<2>,2|C<4>}	H(C[6]C[6]2)	120.2760	0.000	1	120.2760	0.000	1	120.2760	0.000	1	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:C[6]-3:N[6]-2:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]N[5])(C[6]C[6]H)(N[6]N[6])	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,2|N<3>}	C[6](C[5]C[5]N[5])(C[6]C[6]H)(N[6]N[6]){1|C<2>,1|C<4>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	122.8450	0.000	1	122.8450	0.000	1	122.8450	0.000	1	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:C[6]-3:O[6]-2:	C[6]-3:	C[6](C[6]C[5]O[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]2)(C[6]C[6]H)(O[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[5]O[6])(C[6]C[6]H)(H){1|C<4>,3|C<3>}	C[6](C[5]C[5]2)(C[6]C[6]H)(O[6]C[6]){1|C<3>,1|C<4>,1|O<2>,2|O<1>,3|H<1>}	H(C[6]C[6]2)	119.9843	0.137	3	119.9843	0.019	3	120.0054	0.010	5	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:C[6]-3:O[6]-2:	C[6]-3:	C[6](C[6]C[5a]O[6])(C[6]C[5]O[6])(H)	C[6](C[5]C[5]N[5])(C[6]C[6]H)(O[6]B[6])	H(C[6]C[6]2)	C[6](C[6]C[5a]O[6])(C[6]C[5]O[6])(H){1|B<4>,1|N<2>,1|N<3>,2|C<3>}	C[6](C[5]C[5]N[5])(C[6]C[6]H)(O[6]B[6]){1|O<2>,3|C<3>,3|F<1>}	H(C[6]C[6]2)	120.0370	0.028	2	120.0370	0.001	2	120.0054	0.010	5	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[5a,6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[5a,6]O)(C[6]N[6]H)(H)	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(OC[6a])	H(C[6]C[6]2)	C[6](C[6]C[5a,6]O)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(OC[6a]){1|H<1>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	119.7600	0.130	2	119.7600	0.017	2	119.7600	0.017	2	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-2:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H)	C[6](C[5a]C[5a]N[5a])(C[6]C[6]H)(C[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<2>,2|C<3>}	C[6](C[5a]C[5a]N[5a])(C[6]C[6]H)(C[6]C[6]){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	121.0220	0.000	1	121.0220	0.000	1	117.0187	34.649	3	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-2:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H)	C[6](C[5a]C[5a]O[5a])(C[6]C[6]H)(C[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H){1|H<1>,1|O<2>,2|C<3>}	C[6](C[5a]C[5a]O[5a])(C[6]C[6]H)(C[6]C[6]){3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.7740	0.000	1	119.7740	0.000	1	117.0187	34.649	3	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-2:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H)	C[6](C[5a]N[5a]2)(C[6]C[6]H)(C[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H){1|C<2>,1|N<2>,2|N<3>}	C[6](C[5a]N[5a]2)(C[6]C[6]H)(C[6]C[6]){2|H<1>,3|C<3>}	H(C[6]C[6]2)	110.2600	0.000	1	110.2600	0.000	1	117.0187	34.649	3	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:N[6]-2:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]C[5a]N[5a])(C[6]C[6]H)(N[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|N<3>,1|O<1>,2|C<3>}	C[6](C[5a]C[5a]N[5a])(C[6]C[6]H)(N[6]C[6]){1|C<4>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.0810	0.000	1	120.0810	0.000	1	116.6600	23.406	2	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:N[6]-2:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]N[5a]S[5a])(C[6]C[6]H)(N[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|C<2>,1|H<1>,1|N<2>,1|S<2>}	C[6](C[5a]N[5a]S[5a])(C[6]C[6]H)(N[6]C[6]){1|H<1>,3|C<3>}	H(C[6]C[6]2)	113.2390	0.000	1	113.2390	0.000	1	116.6600	23.406	2	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:O[6]-2:	C[6]-3:	C[6](C[6]C[5a]O[6])(C[6]C[5]O[6])(H)	C[6](C[5a]C[5a]N[5a])(C[6]C[6]H)(O[6]B[6])	H(C[6]C[6]2)	C[6](C[6]C[5a]O[6])(C[6]C[5]O[6])(H){1|B<4>,1|N<2>,1|N<3>,2|C<3>}	C[6](C[5a]C[5a]N[5a])(C[6]C[6]H)(O[6]B[6]){1|H<1>,1|O<2>,3|C<3>,3|F<1>}	H(C[6]C[6]2)	120.0235	0.013	2	120.0235	0.000	2	120.0619	0.119	119	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:O[6]-2:	C[6]-3:	C[6](C[6]C[5a]O[6])(C[6]C[6]O)(H)	C[6](C[5a]C[5a]2)(C[6]C[6]H)(O[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[5a]O[6])(C[6]C[6]O)(H){3|C<3>}	C[6](C[5a]C[5a]2)(C[6]C[6]H)(O[6]C[6]){1|C<2>,1|C<3>,1|C<4>,1|O<1>,1|S<2>,2|H<1>}	H(C[6]C[6]2)	119.1930	0.000	1	119.1930	0.000	1	120.0619	0.119	119	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:O[6]-2:	C[6]-3:	C[6](C[6]C[5a]O[6])(C[6]C[6a]O[6])(H)	C[6](C[5a]C[5a]2)(C[6]C[6]H)(O[6]B[6])	H(C[6]C[6]2)	C[6](C[6]C[5a]O[6])(C[6]C[6a]O[6])(H){1|B<4>,4|C<3>}	C[6](C[5a]C[5a]2)(C[6]C[6]H)(O[6]B[6]){2|C<3>,2|F<1>,2|H<1>,2|O<2>}	H(C[6]C[6]2)	119.7717	0.082	3	119.7717	0.007	3	120.0619	0.119	119	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:O[6]-2:	C[6]-3:	C[6](C[6]C[5a]O[6])(C[6]C[6a]O[6])(H)	C[6](C[5a]C[5a]O[5a])(C[6]C[6]H)(O[6]B[6])	H(C[6]C[6]2)	C[6](C[6]C[5a]O[6])(C[6]C[6a]O[6])(H){1|B<4>,1|O<2>,3|C<3>}	C[6](C[5a]C[5a]O[5a])(C[6]C[6]H)(O[6]B[6]){1|H<1>,1|O<2>,2|F<1>,3|C<3>}	H(C[6]C[6]2)	120.5090	0.237	3	120.5090	0.056	3	120.0619	0.119	119	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:O[6]-2:	C[6]-3:	C[6](C[6]C[5a]O[6])(C[6]O[6]C)(H)	C[6](C[5a]C[5a]N[5a])(C[6]C[6]H)(O[6]B[6])	H(C[6]C[6]2)	C[6](C[6]C[5a]O[6])(C[6]O[6]C)(H){1|B<4>,1|C<3>,1|N<3>}	C[6](C[5a]C[5a]N[5a])(C[6]C[6]H)(O[6]B[6]){1|C<4>,1|O<2>,2|C<3>,2|F<1>,2|H<1>}	H(C[6]C[6]2)	120.1790	0.000	1	120.1790	0.000	1	120.0619	0.119	119	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:O[6]-2:	C[6]-3:	C[6](C[6]C[5a]O[6])2(H)	C[6](C[5a]C[5a,6,6]N[5a])(C[6]C[6]H)(O[6]B[6])	H(C[6]C[6]2)	C[6](C[6]C[5a]O[6])2(H){1|B<4>,2|C<3>,2|N<3>}	C[6](C[5a]C[5a,6,6]N[5a])(C[6]C[6]H)(O[6]B[6]){1|C<4>,1|H<1>,1|O<2>,2|F<1>,3|C<3>}	H(C[6]C[6]2)	119.6285	0.060	2	119.6285	0.004	2	120.0619	0.119	119	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:O[6]-2:	C[6]-3:	C[6](C[6]C[5a]O[6])2(H)	C[6](C[5a]C[5a]N[5a])(C[6]C[6]H)(O[6]B[6])	H(C[6]C[6]2)	C[6](C[6]C[5a]O[6])2(H){1|B<4>,2|C<3>,2|N<3>}	C[6](C[5a]C[5a]N[5a])(C[6]C[6]H)(O[6]B[6]){1|C<4>,1|H<1>,1|O<2>,2|F<1>,3|C<3>}	H(C[6]C[6]2)	119.9509	0.272	48	120.0734	0.112	107	120.0619	0.119	119	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:O[6]-2:	C[6]-3:	C[6](C[6]C[5a]O[6])2(H)	C[6](C[5a]C[5a]N[5a])(C[6]C[6]H)(O[6]B[6])	H(C[6]C[6]2)	C[6](C[6]C[5a]O[6])2(H){1|B<4>,2|C<3>,2|N<3>}	C[6](C[5a]C[5a]N[5a])(C[6]C[6]H)(O[6]B[6]){1|C<4>,1|H<1>,1|O<2>,5|C<3>}	H(C[6]C[6]2)	119.8585	0.070	4	120.0734	0.112	107	120.0619	0.119	119	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:O[6]-2:	C[6]-3:	C[6](C[6]C[5a]O[6])2(H)	C[6](C[5a]C[5a]N[5a])(C[6]C[6]H)(O[6]B[6])	H(C[6]C[6]2)	C[6](C[6]C[5a]O[6])2(H){1|B<4>,2|C<3>,2|N<3>}	C[6](C[5a]C[5a]N[5a])(C[6]C[6]H)(O[6]B[6]){1|C<4>,1|H<1>,3|C<3>,3|O<2>}	H(C[6]C[6]2)	119.8900	0.058	2	120.0734	0.112	107	120.0619	0.119	119	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:O[6]-2:	C[6]-3:	C[6](C[6]C[5a]O[6])2(H)	C[6](C[5a]C[5a]N[5a])(C[6]C[6]H)(O[6]B[6])	H(C[6]C[6]2)	C[6](C[6]C[5a]O[6])2(H){1|B<4>,2|C<3>,2|N<3>}	C[6](C[5a]C[5a]N[5a])(C[6]C[6]H)(O[6]B[6]){1|H<1>,1|O<2>,2|F<1>,4|C<3>}	H(C[6]C[6]2)	120.0821	0.429	11	120.0734	0.112	107	120.0619	0.119	119	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:O[6]-2:	C[6]-3:	C[6](C[6]C[5a]O[6])2(H)	C[6](C[5a]C[5a]N[5a])(C[6]C[6]H)(O[6]B[6])	H(C[6]C[6]2)	C[6](C[6]C[5a]O[6])2(H){1|B<4>,2|C<3>,2|N<3>}	C[6](C[5a]C[5a]N[5a])(C[6]C[6]H)(O[6]B[6]){1|H<1>,1|O<2>,3|C<3>,3|F<1>}	H(C[6]C[6]2)	120.5019	0.227	8	120.0734	0.112	107	120.0619	0.119	119	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:O[6]-2:	C[6]-3:	C[6](C[6]C[5a]O[6])2(H)	C[6](C[5a]C[5a]N[5a])(C[6]C[6]H)(O[6]B[6])	H(C[6]C[6]2)	C[6](C[6]C[5a]O[6])2(H){1|B<4>,2|C<3>,2|N<3>}	C[6](C[5a]C[5a]N[5a])(C[6]C[6]H)(O[6]B[6]){1|H<1>,2|F<1>,2|O<2>,3|C<3>}	H(C[6]C[6]2)	120.2685	0.025	2	120.0734	0.112	107	120.0619	0.119	119	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:O[6]-2:	C[6]-3:	C[6](C[6]C[5a]O[6])2(H)	C[6](C[5a]C[5a]N[5a])(C[6]C[6]H)(O[6]B[6])	H(C[6]C[6]2)	C[6](C[6]C[5a]O[6])2(H){1|B<4>,2|C<3>,2|N<3>}	C[6](C[5a]C[5a]N[5a])(C[6]C[6]H)(O[6]B[6]){1|O<2>,2|F<1>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.1393	0.318	26	120.0734	0.112	107	120.0619	0.119	119	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:O[6]-2:	C[6]-3:	C[6](C[6]C[5a]O[6])2(H)	C[6](C[5a]C[5a]N[5a])(C[6]C[6]H)(O[6]B[6])	H(C[6]C[6]2)	C[6](C[6]C[5a]O[6])2(H){1|B<4>,2|C<3>,2|N<3>}	C[6](C[5a]C[5a]N[5a])(C[6]C[6]H)(O[6]B[6]){1|O<2>,2|H<1>,5|C<3>}	H(C[6]C[6]2)	120.3198	0.376	6	120.0734	0.112	107	120.0619	0.119	119	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6,6]N)(C[6]C[6]C)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(NN)	H(C[6]C[6]2)	C[6](C[6]C[6,6]N)(C[6]C[6]C)(H){1|C<3>,1|C<4>,1|O<1>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(NN){1|H<1>,2|C<3>,3|C<4>}	H(C[6]C[6]2)	119.0540	0.000	1	119.0540	0.000	1	119.0540	0.000	1	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6,6]O)(H)	C[6](C[6,6]C[5,6,6]C[6])(C[6]C[6]H)(OH)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6,6]O)(H){1|C<3>,1|O<2>,2|C<4>}	C[6](C[6,6]C[5,6,6]C[6])(C[6]C[6]H)(OH){1|C<3>,1|C<4>,1|N<3>,1|O<1>,2|H<1>}	H(C[6]C[6]2)	118.8350	0.000	1	118.8350	0.000	1	119.8965	0.211	13	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H){1|O<1>,2|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(OC){1|H<1>,1|O<1>,3|C<3>}	H(C[6]C[6]2)	119.5140	0.000	1	119.5140	0.000	1	119.8965	0.211	13	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(OH)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H){1|C<3>,1|C<4>,2|H<1>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(OH){1|C<3>,1|O<1>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	120.1580	0.000	1	120.1580	0.000	1	119.8965	0.211	13	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H)	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(OC){1|B<4>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.4600	0.314	2	120.4600	0.099	2	119.8965	0.211	13	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H)	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(OMn)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(OMn){1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.7360	0.000	1	119.7360	0.000	1	119.8965	0.211	13	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H)	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(ONi)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(ONi){1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.7880	0.337	2	119.7880	0.113	2	119.8965	0.211	13	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H)	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(OZn)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(OZn){1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.6220	0.000	1	119.6220	0.000	1	119.8965	0.211	13	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]O)(H)	C[6](C[6,6]C[6,6]2)(C[6]C[6]H)(OC[6a])	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|O<1>}	C[6](C[6,6]C[6,6]2)(C[6]C[6]H)(OC[6a]){1|C<3>,1|H<1>,1|O<1>,3|C<4>}	H(C[6]C[6]2)	120.0320	0.000	1	120.0320	0.000	1	119.8965	0.211	13	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]O)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(OH)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]O)(H){1|H<1>,2|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(OH){1|C<3>,1|C<4>,1|O<2>,2|O<1>}	H(C[6]C[6]2)	120.0200	0.000	1	120.0200	0.000	1	119.8965	0.211	13	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]O)(H)	C[6](C[6,6]C[6,6]O[6])(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]O)(H){1|C<3>,1|O<1>,1|O<2>}	C[6](C[6,6]C[6,6]O[6])(C[6]C[6]H)(OC){1|C<3>,1|O<1>,2|C<4>}	H(C[6]C[6]2)	119.9100	0.000	1	119.9100	0.000	1	119.8965	0.211	13	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]O[6]C)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(OCo)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]O[6]C)(H){2|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(OCo){1|C<2>,1|C<4>,3|O<2>}	H(C[6]C[6]2)	120.3310	0.000	1	120.3310	0.000	1	119.8965	0.211	13	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CC)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H){1|Ag<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CC){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	122.9275	1.227	2	122.9275	1.505	2	122.9275	1.505	2	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6,6a]N)(C[6]C[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(NN)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]N)(C[6]C[6]C)(H){1|O<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(NN){1|C<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	118.4477	0.206	4	118.4477	0.043	4	118.5566	0.916	15	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6,6a]N)(C[6]C[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(NN)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]N)(C[6]C[6]H)(H){1|O<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(NN){1|N<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	118.9050	0.000	1	119.1895	0.162	2	118.5566	0.916	15	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6,6a]N)(C[6]C[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(NN)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]N)(C[6]C[6]H)(H){1|O<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(NN){2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.4740	0.000	1	119.1895	0.162	2	118.5566	0.916	15	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6,6a]N)(C[6]C[6]N)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(NC[6a])	H(C[6]C[6]2)	C[6](C[6]C[6,6a]N)(C[6]C[6]N)(H){1|O<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(NC[6a]){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	116.3420	0.000	1	116.3420	0.000	1	118.5566	0.916	15	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6,6a]N)(C[6]C[6]O)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(NC[6a])	H(C[6]C[6]2)	C[6](C[6]C[6,6a]N)(C[6]C[6]O)(H){1|O<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(NC[6a]){1|H<1>,1|O<2>,3|C<3>}	H(C[6]C[6]2)	118.8986	0.236	5	118.8986	0.056	5	118.5566	0.916	15	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6,6a]N)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(NN)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]N)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(NN){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.4425	0.032	2	119.4425	0.001	2	118.5566	0.916	15	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6a]S[6])(C[6]C[6,6a]N)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(NC[6a])	H(C[6]C[6]2)	C[6](C[6]C[6a]S[6])(C[6]C[6,6a]N)(H){4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(NC[6a]){1|H<1>,1|S<2>,3|C<3>}	H(C[6]C[6]2)	116.4590	0.000	1	116.4590	0.000	1	118.5566	0.916	15	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]2)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]2)(H){1|O<1>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(OC){1|H<1>,4|C<3>}	H(C[6]C[6]2)	117.9985	0.258	4	117.9985	0.066	4	119.7557	3.675	26	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]2)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(OC[6])	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]2)(H){1|O<1>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(OC[6]){1|H<1>,4|C<3>}	H(C[6]C[6]2)	118.0865	0.238	2	118.0865	0.057	2	119.7557	3.675	26	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]C)(H){1|O<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(OC){1|H<1>,4|C<3>}	H(C[6]C[6]2)	119.0760	0.141	2	119.0760	0.020	2	119.7557	3.675	26	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(OCu)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]C)(H){1|O<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(OCu){1|C<4>,1|O<2>,3|C<3>}	H(C[6]C[6]2)	118.7350	0.000	1	118.7350	0.000	1	119.7557	3.675	26	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]N)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(OH)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]N)(H){1|O<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(OH){1|N<3>,1|O<1>,3|C<3>}	H(C[6]C[6]2)	119.9670	0.000	1	119.9670	0.000	1	119.7557	3.675	26	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]O)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]O)(H){1|O<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(OC){1|N<2>,1|O<1>,3|C<3>}	H(C[6]C[6]2)	119.3900	0.000	1	119.3900	0.000	1	119.7557	3.675	26	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]O)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(OH)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]O)(H){1|H<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(OH){1|O<2>,2|C<3>,2|O<1>}	H(C[6]C[6]2)	119.5370	0.000	1	119.5370	0.000	1	119.7557	3.675	26	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]N[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(OC){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.3660	0.000	1	120.4157	0.011	3	119.7557	3.675	26	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]N[6]C)(H){1|Ir<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(OC){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.3450	0.000	1	120.4157	0.011	3	119.7557	3.675	26	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]N[6]C)(H){1|Re<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(OC){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.5360	0.000	1	120.4157	0.011	3	119.7557	3.675	26	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(OH)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]N[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(OH){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.6520	0.000	1	121.8333	11.521	3	119.7557	3.675	26	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(OH)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]N[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(OH){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	122.9240	3.988	2	121.8333	11.521	3	119.7557	3.675	26	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(OC[6a])	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]N[6]H)(H){1|Pd<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(OC[6a]){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.7940	0.000	1	120.7940	0.000	1	119.7557	3.675	26	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(OH)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(OH){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.7900	0.938	2	120.7900	0.879	2	119.7557	3.675	26	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]N[6a])(C[6]C[6]H)(OC[6a])	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|N<2>}	C[6](C[6,6a]C[6,6a]N[6a])(C[6]C[6]H)(OC[6a]){1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.9800	0.000	1	119.9800	0.000	1	119.7557	3.675	26	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]O[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(OLi)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]O[6]C)(H){2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(OLi){1|C<3>,1|C<4>,3|O<2>}	H(C[6]C[6]2)	121.1960	4.975	2	121.1960	24.753	2	119.7557	3.675	26	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6a]O[6])(C[6]C[6,6a]O)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(OH)	H(C[6]C[6]2)	C[6](C[6]C[6a]O[6])(C[6]C[6,6a]O)(H){4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(OH){1|H<1>,1|O<2>,3|C<3>}	H(C[6]C[6]2)	119.4660	0.000	1	119.4660	0.000	1	119.7557	3.675	26	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6a]O[6])(C[6]C[6,6a]O)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(ONi)	H(C[6]C[6]2)	C[6](C[6]C[6a]O[6])(C[6]C[6,6a]O)(H){4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(ONi){2|O<2>,3|C<3>}	H(C[6]C[6]2)	118.7420	0.000	1	118.7420	0.000	1	119.7557	3.675	26	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6,6a]S)(C[6]C[6]O)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(SC[6a])	H(C[6]C[6]2)	C[6](C[6]C[6,6a]S)(C[6]C[6]O)(H){1|O<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(SC[6a]){1|H<1>,1|O<1>,3|C<3>}	H(C[6]C[6]2)	118.8627	0.224	3	118.8627	0.050	3	119.1580	0.382	4	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6,6a]S)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(SC)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]S)(C[6]N[6]H)(H){1|O<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(SC){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0440	0.000	1	120.0440	0.000	1	119.1580	0.382	4	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:As-3:C[6]-2:	C[6]-3:	C[6](C[6]C[6]As)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(AsC[6a]O)(C[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6]As)(C[6]C[6]H)(H){1|C<2>,1|H<1>}	C[6](C[6]C[6]H)(AsC[6a]O)(C[6]C[6]){1|C<3>,1|H<1>}	H(C[6]C[6]2)	116.7620	0.000	1	116.1340	0.789	2	116.1340	0.789	2	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:As-3:C[6]-2:	C[6]-3:	C[6](C[6]C[6]As)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(AsC[6a]O)(C[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6]As)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(AsC[6a]O)(C[6]C[6]){1|C<3>,2|H<1>}	H(C[6]C[6]2)	115.5060	0.000	1	116.1340	0.789	2	116.1340	0.789	2	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]C)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(CN)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]C)(H){1|C<4>,1|N<3>,2|H<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(CN){1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.6900	0.000	1	119.6900	0.000	1	120.4300	0.751	476	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CN)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]C)(H){1|Mn<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)2(CN){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.2160	0.000	1	121.2160	0.000	1	120.4300	0.751	476	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CN)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(CN){1|Br<1>,1|C<3>,1|O<2>}	H(C[6]C[6]2)	120.9690	0.000	1	120.9690	0.000	1	120.4300	0.751	476	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(CC)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<2>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(CC){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1895	0.261	2	120.1895	0.068	2	120.4300	0.751	476	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CC)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CC){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5820	0.000	1	120.1826	0.403	92	120.4300	0.751	476	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CC)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CC){1|Cu<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0693	0.113	3	120.1826	0.403	92	120.4300	0.751	476	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CC)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CC){1|Ir<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2220	0.000	1	120.1826	0.403	92	120.4300	0.751	476	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CC)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CC){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4690	0.000	1	120.1826	0.403	92	120.4300	0.751	476	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CC)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CC){1|Pt<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2771	0.504	41	120.1826	0.403	92	120.4300	0.751	476	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CC)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CC){1|Re<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1224	0.324	7	120.1826	0.403	92	120.4300	0.751	476	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CC)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CC){1|Ru<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0950	0.132	3	120.1826	0.403	92	120.4300	0.751	476	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CC)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CC){1|Ru<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1650	0.000	1	120.1826	0.403	92	120.4300	0.751	476	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CC)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CC){1|Ag<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.4230	1.060	4	120.1826	0.403	92	120.4300	0.751	476	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CC)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CC){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.2360	0.180	2	120.1826	0.403	92	120.4300	0.751	476	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CC)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CC){1|Cd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0170	0.000	1	120.1826	0.403	92	120.4300	0.751	476	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CC)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CC){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	116.6170	0.000	1	120.1826	0.403	92	120.4300	0.751	476	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CC)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CC){1|Cu<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5360	0.305	2	120.1826	0.403	92	120.4300	0.751	476	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CC)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CC){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1822	0.551	16	120.1826	0.403	92	120.4300	0.751	476	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CC)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CC){1|Pt<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4886	0.422	7	120.1826	0.403	92	120.4300	0.751	476	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CC)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CC){1|Re<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4460	0.000	1	120.1826	0.403	92	120.4300	0.751	476	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CN){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5800	0.000	1	120.8075	0.103	34	120.4300	0.751	476	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CN){1|Zn<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7410	0.023	2	120.8075	0.103	34	120.4300	0.751	476	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CN){1|Zn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.8070	0.189	5	120.8075	0.103	34	120.4300	0.751	476	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CN){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6815	0.260	2	120.8075	0.103	34	120.4300	0.751	476	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0795	0.018	2	120.8075	0.103	34	120.4300	0.751	476	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CN){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.8382	0.160	6	120.8075	0.103	34	120.4300	0.751	476	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CN){1|Cu<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.9245	0.339	2	120.8075	0.103	34	120.4300	0.751	476	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CN){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7530	0.000	1	120.8075	0.103	34	120.4300	0.751	476	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CN){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7886	0.094	5	120.8075	0.103	34	120.4300	0.751	476	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CN){1|Pt<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.1242	0.469	6	120.8075	0.103	34	120.4300	0.751	476	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CN){1|Zn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7590	0.096	2	120.8075	0.103	34	120.4300	0.751	476	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CO){1|Pt<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7260	0.000	1	120.7260	0.000	1	120.4300	0.751	476	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CC)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<2>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(CC){1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.8660	0.000	1	120.3280	0.579	2	120.4300	0.751	476	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CC)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(CC){1|C<3>,3|H<1>}	H(C[6]C[6]2)	119.7900	0.000	1	120.3280	0.579	2	120.4300	0.751	476	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(CN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7295	0.197	2	119.7295	0.039	2	120.4300	0.751	476	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CC)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CC){1|Co<6>,1|C<3>,1|O<2>}	H(C[6]C[6]2)	120.6730	0.000	1	120.6220	0.089	6	120.4300	0.751	476	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CC)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CC){1|Pd<4>,1|C<3>,1|O<2>}	H(C[6]C[6]2)	120.6118	0.332	5	120.6220	0.089	6	120.4300	0.751	476	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(CN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(CN){1|Br<1>,1|C<3>,1|O<2>}	H(C[6]C[6]2)	120.6060	0.000	1	120.6060	0.000	1	120.4300	0.751	476	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(CC)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|Ga<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CC){1|N<3>,2|C<4>}	H(C[6]C[6]2)	119.6965	0.146	2	119.6965	0.021	2	120.4300	0.751	476	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(CN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CN){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.0130	0.000	1	121.0130	0.000	1	120.4300	0.751	476	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]I)(CC)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|I<1>}	C[6](C[6]C[6]H)(C[6]C[6]I)(CC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.0206	0.223	10	120.0206	0.050	10	120.4300	0.751	476	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CC)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.8948	0.179	4	120.1198	0.554	87	120.4300	0.751	476	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CC)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<2>,1|H<1>}	C[6](C[6]C[6]H)2(CC){1|H<1>,1|N<2>}	H(C[6]C[6]2)	117.7990	0.000	1	120.1198	0.554	87	120.4300	0.751	476	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CC)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<2>,2|H<1>}	C[6](C[6]C[6]H)2(CC){1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.6320	0.000	1	120.1198	0.554	87	120.4300	0.751	476	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CC)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(CC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.2537	0.278	11	120.1198	0.554	87	120.4300	0.751	476	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CC)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(CC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.1060	3.750	2	120.1198	0.554	87	120.4300	0.751	476	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CC)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|W<6>}	C[6](C[6]C[6]H)2(CC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.0646	0.340	5	120.1198	0.554	87	120.4300	0.751	476	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CC)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(CC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.8058	1.193	10	120.1198	0.554	87	120.4300	0.751	476	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CC)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cu<3>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.3720	0.116	2	120.1198	0.554	87	120.4300	0.751	476	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CC)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.2647	0.192	7	120.1198	0.554	87	120.4300	0.751	476	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CC)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(CC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.7920	0.925	2	120.1198	0.554	87	120.4300	0.751	476	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CC)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CC){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5480	0.000	1	120.1198	0.554	87	120.4300	0.751	476	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CC)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.1553	0.460	10	120.1198	0.554	87	120.4300	0.751	476	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CC)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Re<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.2470	0.426	2	120.1198	0.554	87	120.4300	0.751	476	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CC)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.9412	0.340	14	120.1198	0.554	87	120.4300	0.751	476	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CC)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Rh<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.4089	0.536	11	120.1198	0.554	87	120.4300	0.751	476	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CC)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.3475	0.641	2	120.1198	0.554	87	120.4300	0.751	476	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CC)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|V<11>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.4425	0.069	2	120.1198	0.554	87	120.4300	0.751	476	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CN){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.6705	0.013	2	120.6737	0.613	180	120.4300	0.751	476	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(CN){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.4700	1.024	60	120.6737	0.613	180	120.4300	0.751	476	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(CN){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.0770	0.013	2	120.6737	0.613	180	120.4300	0.751	476	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(CN){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.6350	1.044	22	120.6737	0.613	180	120.4300	0.751	476	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CN){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.0920	0.000	1	120.6737	0.613	180	120.4300	0.751	476	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CN){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.8847	0.102	4	120.6737	0.613	180	120.4300	0.751	476	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CN){1|N<3>,2|H<1>}	H(C[6]C[6]2)	121.2629	1.060	8	120.6737	0.613	180	120.4300	0.751	476	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cu<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CN){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.6380	0.059	2	120.6737	0.613	180	120.4300	0.751	476	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CN){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.8191	0.188	10	120.6737	0.613	180	120.4300	0.751	476	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ga<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CN){1|N<3>,2|H<1>}	H(C[6]C[6]2)	121.6500	1.986	2	120.6737	0.613	180	120.4300	0.751	476	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(CN){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.5350	0.304	4	120.6737	0.613	180	120.4300	0.751	476	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CN){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5745	0.091	2	120.6737	0.613	180	120.4300	0.751	476	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CN){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6250	0.000	1	120.6737	0.613	180	120.4300	0.751	476	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CN){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.8607	0.192	12	120.6737	0.613	180	120.4300	0.751	476	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CN){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.8393	0.162	6	120.6737	0.613	180	120.4300	0.751	476	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CN){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.7609	0.227	8	120.6737	0.613	180	120.4300	0.751	476	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CN){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.6925	0.097	2	120.6737	0.613	180	120.4300	0.751	476	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Pt<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CN){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.6900	0.170	10	120.6737	0.613	180	120.4300	0.751	476	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CN){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.9775	0.024	4	120.6737	0.613	180	120.4300	0.751	476	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CN){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.8950	0.083	4	120.6737	0.613	180	120.4300	0.751	476	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Rh<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CN){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.7325	0.161	2	120.6737	0.613	180	120.4300	0.751	476	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CN){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1520	0.000	1	120.6737	0.613	180	120.4300	0.751	476	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CN){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.5480	0.249	2	120.6737	0.613	180	120.4300	0.751	476	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ru<9>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CN){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.3688	0.171	4	120.6737	0.613	180	120.4300	0.751	476	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Tc<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CN){1|N<3>,2|H<1>}	H(C[6]C[6]2)	121.1690	0.140	2	120.6737	0.613	180	120.4300	0.751	476	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Zn<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CN){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.8110	0.099	3	120.6737	0.613	180	120.4300	0.751	476	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(CH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(CH){1|C<2>,2|C<4>}	H(C[6]C[6]2)	116.7930	0.000	1	116.7930	0.000	1	120.4300	0.751	476	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CC)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CC){1|C<2>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	120.5494	0.270	8	119.4411	3.843	16	120.4300	0.751	476	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CC)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CC){1|Pd<4>,1|C<2>,1|C<3>}	H(C[6]C[6]2)	118.0941	2.391	7	119.4411	3.843	16	120.4300	0.751	476	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CC)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CC){1|Pd<4>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	120.0030	0.000	1	119.4411	3.843	16	120.4300	0.751	476	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CC)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Pt<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CC){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.1055	0.199	4	120.4736	0.124	10	120.4300	0.751	476	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CC)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Zn<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CC){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.7190	0.135	6	120.4736	0.124	10	120.4300	0.751	476	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CN)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Ir<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CN){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6725	1.054	2	120.4904	0.307	7	120.4300	0.751	476	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CN)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Re<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CN){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5907	0.111	4	120.4904	0.307	7	120.4300	0.751	476	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CN)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Ru<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CN){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7250	0.000	1	120.4904	0.307	7	120.4300	0.751	476	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(CN)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]C)(H){1|N<2>,2|C<3>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(CN){3|C<3>}	H(C[6]C[6]2)	118.0800	0.000	1	118.0800	0.000	1	120.4300	0.751	476	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CC)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H){1|Ir<6>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(CC){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8220	0.000	1	119.8220	0.000	1	120.4300	0.751	476	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CC)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]C)(H){1|Co<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CC){3|N<3>}	H(C[6]C[6]2)	121.5675	0.063	2	121.6023	0.293	13	120.4300	0.751	476	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CC)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]C)(H){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CC){3|N<3>}	H(C[6]C[6]2)	121.6086	0.593	11	121.6023	0.293	13	120.4300	0.751	476	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CN)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]C)(H){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CN){3|N<3>}	H(C[6]C[6]2)	121.4847	0.494	4	121.4847	0.244	4	120.4300	0.751	476	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-2:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6]H)(H)	C[6](C[6]Se[6]C[6])(C[6]C[6]H)(C[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6]H)(H){1|Se<2>,1|C<2>,1|C<3>,1|H<1>}	C[6](C[6]Se[6]C[6])(C[6]C[6]H)(C[6]C[6]){1|C<4>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	121.0630	0.000	1	121.0630	0.000	1	120.9078	0.911	6	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-2:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](C[6]C[6]2)(C[6]C[6]H)(C[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|C<2>,1|C<4>,2|C<3>}	C[6](C[6]C[6]2)(C[6]C[6]H)(C[6]C[6]){1|N<3>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	121.4810	0.000	1	120.8768	1.131	5	120.9078	0.911	6	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-2:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](C[6]C[6]2)(C[6]C[6]H)(C[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|C<2>,1|H<1>,2|C<3>}	C[6](C[6]C[6]2)(C[6]C[6]H)(C[6]C[6]){1|N<3>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	119.7395	0.298	2	120.8768	1.131	5	120.9078	0.911	6	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-2:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](C[6]C[6]2)(C[6]C[6]H)(C[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|C<2>,2|C<3>}	C[6](C[6]C[6]2)(C[6]C[6]H)(C[6]C[6]){1|C<2>,1|C<3>,1|N<2>,3|H<1>}	H(C[6]C[6]2)	121.5000	0.000	1	120.8768	1.131	5	120.9078	0.911	6	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-2:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](C[6]C[6]2)(C[6]C[6]H)(C[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|H<1>,3|C<3>}	C[6](C[6]C[6]2)(C[6]C[6]H)(C[6]C[6]){1|N<3>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	121.9240	0.000	1	120.8768	1.131	5	120.9078	0.911	6	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:I-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]I)(H)	C[6](C[6]C[6]H)2(IC[6a])	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]I)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(IC[6a]){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7435	0.435	2	119.7435	0.189	2	119.7435	0.189	2	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6,6]C)(C[6]C[6]H)(NC[6a])	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]N)(H){1|C<3>,3|C<4>}	C[6](C[6]C[6,6]C)(C[6]C[6]H)(NC[6a]){1|H<1>,2|C<4>}	H(C[6]C[6]2)	118.8870	0.000	1	118.8870	0.000	1	119.6450	3.491	191	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6,6]C)(C[6]C[6]H)(NN)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]N)(H){1|C<3>,3|C<4>}	C[6](C[6]C[6,6]C)(C[6]C[6]H)(NN){1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.3590	0.000	1	119.3590	0.000	1	119.6450	3.491	191	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6,6]C)(C[6]C[6]H)(NO)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]N)(H){1|C<3>,3|C<4>}	C[6](C[6]C[6,6]C)(C[6]C[6]H)(NO){1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.4675	0.230	2	119.4675	0.053	2	119.6450	3.491	191	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(NN)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]N)(H){1|Cr<9>,1|H<1>,2|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(NN){1|Cr<9>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	120.0560	0.000	1	120.0560	0.000	1	119.6450	3.491	191	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]N)(H)	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(NN)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]N)(H){1|O<1>,2|C<3>}	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(NN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.0495	0.088	2	119.0495	0.008	2	119.6450	3.491	191	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]N)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(NC)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]N)(H){1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(NC){1|C<2>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	113.3860	0.000	1	113.3860	0.000	1	119.6450	3.491	191	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]N)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(NC[6])	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]N)(H){1|C<3>,1|C<4>,2|H<1>}	C[6](C[6]C[6]C)(C[6]C[6]H)(NC[6]){1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	118.7180	0.000	1	118.7180	0.000	1	119.6450	3.491	191	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]N)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(NO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]N)(H){1|C<3>,1|C<4>,1|O<1>}	C[6](C[6]C[6]C)(C[6]C[6]H)(NO){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	118.7460	0.000	1	118.7460	0.000	1	119.6450	3.491	191	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(NC[6a])	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]N)(H){1|C<3>,1|N<3>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]N)(NC[6a]){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	118.7010	0.000	1	118.7010	0.000	1	119.6450	3.491	191	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(NC)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(NC){1|C<3>,2|C<4>}	H(C[6]C[6]2)	119.0510	1.655	2	119.0510	2.738	2	119.6450	3.491	191	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(NC[6a])	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(NC[6a]){1|C<3>,2|C<4>}	H(C[6]C[6]2)	118.0920	0.000	1	118.0920	0.000	1	119.6450	3.491	191	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(NC[5a])	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(NC[5a]){1|C<3>,2|C<4>}	H(C[6]C[6]2)	118.5320	0.711	2	118.5320	0.506	2	119.6450	3.491	191	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(NC[6a])	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(NC[6a]){1|C<3>,2|C<4>}	H(C[6]C[6]2)	118.4187	0.222	6	118.4187	0.049	6	119.6450	3.491	191	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(NN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(NN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	118.3957	2.128	3	119.3577	1.162	14	119.6450	3.491	191	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(NN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(NN){1|O<2>,2|C<3>}	H(C[6]C[6]2)	119.8838	0.422	5	119.3577	1.162	14	119.6450	3.491	191	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(NN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]N)(H){1|Dy<16>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(NN){1|O<2>,2|C<4>}	H(C[6]C[6]2)	119.4560	0.097	3	119.3577	1.162	14	119.6450	3.491	191	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(NN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]N)(H){1|Tb<16>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(NN){1|O<2>,2|C<4>}	H(C[6]C[6]2)	119.3447	0.751	3	119.3577	1.162	14	119.6450	3.491	191	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(NO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(NO){1|C<3>,2|C<4>}	H(C[6]C[6]2)	119.1488	0.237	4	119.1488	0.056	4	119.6450	3.491	191	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(NN)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(NN){2|Cl<1>,1|C<3>}	H(C[6]C[6]2)	121.8730	0.000	1	121.8730	0.000	1	119.6450	3.491	191	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(NC[6a])	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|O<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(NC[6a]){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	118.6997	0.294	4	118.6310	0.088	5	119.6450	3.491	191	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(NC[6a])	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|O<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(NC[6a]){1|C<3>,2|H<1>}	H(C[6]C[6]2)	118.3560	0.000	1	118.6310	0.088	5	119.6450	3.491	191	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(NO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|N<3>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]N)(NO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	111.5970	0.000	1	111.5970	0.000	1	119.6450	3.491	191	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(NN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|O<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(NN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.4043	0.181	4	119.4043	0.033	4	119.6450	3.491	191	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(NO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|N<3>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(NO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	118.8120	0.000	1	127.6660	156.787	2	119.6450	3.491	191	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(NO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|O<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(NO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	136.5200	0.000	1	127.6660	156.787	2	119.6450	3.491	191	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]C[6]P)(NC[6])	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|P<3>,2|C<3>}	C[6](C[6]C[6]H)(C[6]C[6]P)(NC[6]){1|C<3>,2|H<1>}	H(C[6]C[6]2)	117.3170	0.170	2	117.3170	0.029	2	119.6450	3.491	191	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]C[6]S)(NC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|O<1>,1|S<2>}	C[6](C[6]C[6]H)(C[6]C[6]S)(NC){1|C<3>,2|H<1>}	H(C[6]C[6]2)	117.7720	0.000	1	117.7720	0.000	1	119.6450	3.491	191	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NC){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.5525	0.455	2	120.5905	0.177	6	119.6450	3.491	191	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NC){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.8225	0.262	2	120.5905	0.177	6	119.6450	3.491	191	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NC){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9350	0.000	1	120.5905	0.177	6	119.6450	3.491	191	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NC){1|Re<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.8580	0.000	1	120.5905	0.177	6	119.6450	3.491	191	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.6820	0.000	1	119.4920	1.818	5	119.6450	3.491	191	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NH){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0710	0.160	2	119.4920	1.818	5	119.6450	3.491	191	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.4960	0.000	1	119.4920	1.818	5	119.6450	3.491	191	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	117.1400	0.000	1	119.4920	1.818	5	119.6450	3.491	191	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(NN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){3|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(NN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	118.0792	1.383	5	118.0792	1.914	5	119.6450	3.491	191	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(NC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(NC){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	120.0150	0.000	1	120.0150	0.000	1	119.6450	3.491	191	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(NC[6a])	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(NC[6a]){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.4440	0.089	2	119.4440	0.008	2	119.6450	3.491	191	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(NFe)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|N<3>,2|H<1>}	C[6](C[6]C[6]H)2(NFe){1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.1540	0.037	2	119.1540	0.001	2	119.6450	3.491	191	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(NN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(NN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	118.4850	1.534	3	118.4850	2.353	3	119.6450	3.491	191	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(NC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(NC){1|Zn<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.1220	0.000	1	120.1220	0.000	1	119.6450	3.491	191	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]Pd)(C[6]C[6]H)(NN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|Pd<4>,1|C<3>}	C[6](C[6]C[6]Pd)(C[6]C[6]H)(NN){1|C<2>,2|H<1>}	H(C[6]C[6]2)	120.3440	0.000	1	120.3440	0.000	1	119.6450	3.491	191	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]N)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(NC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]C[6]O)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(NC){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	118.5150	0.000	1	118.5150	0.000	1	119.6450	3.491	191	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]N)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(NN)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(NN){1|O<2>,2|C<3>}	H(C[6]C[6]2)	119.4258	0.343	5	119.5424	0.072	11	119.6450	3.491	191	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]N)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(NN)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]C[6]O)(H){1|Dy<16>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(NN){1|O<2>,2|C<4>}	H(C[6]C[6]2)	119.7240	0.043	3	119.5424	0.072	11	119.6450	3.491	191	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]N)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(NN)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]C[6]O)(H){1|Tb<16>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(NN){1|O<2>,2|C<4>}	H(C[6]C[6]2)	119.5550	0.199	3	119.5424	0.072	11	119.6450	3.491	191	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(NS)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(NS){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.6470	0.000	1	120.6470	0.000	1	119.6450	3.491	191	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(NC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.4365	0.111	4	119.4365	0.012	4	119.6450	3.491	191	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NH)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(NH){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.7260	0.031	2	119.8655	0.031	4	119.6450	3.491	191	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NH)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Co<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NH){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.0050	0.120	2	119.8655	0.031	4	119.6450	3.491	191	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NN)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(NN){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.8382	0.712	6	120.1624	2.276	62	119.6450	3.491	191	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NN)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(NN){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.5519	3.167	12	120.1624	2.276	62	119.6450	3.491	191	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NN)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(NN){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.9710	0.835	12	120.1624	2.276	62	119.6450	3.491	191	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NN)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NN){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.9850	0.280	2	120.1624	2.276	62	119.6450	3.491	191	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NN)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NN){1|N<3>,2|H<1>}	H(C[6]C[6]2)	121.1220	0.000	1	120.1624	2.276	62	119.6450	3.491	191	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NN)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NN){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.4669	0.421	13	120.1624	2.276	62	119.6450	3.491	191	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NN)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Pt<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NN){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.8190	0.082	2	120.1624	2.276	62	119.6450	3.491	191	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NN)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NN){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.7920	0.062	2	120.1624	2.276	62	119.6450	3.491	191	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NN)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|V<11>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NN){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.5120	0.250	2	120.1624	2.276	62	119.6450	3.491	191	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NN)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NN){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.1497	0.839	4	120.1624	2.276	62	119.6450	3.491	191	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NN)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Zn<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NN){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.7925	0.063	6	120.1624	2.276	62	119.6450	3.491	191	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NS)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(NS){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.9059	0.371	20	119.9059	0.138	20	119.6450	3.491	191	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]N)2(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(NC[6a])	H(C[6]C[6]2)	C[6](C[6]C[6]N)2(H){1|C<3>,1|N<3>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]N)(NC[6a]){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	118.9390	0.000	1	118.9390	0.000	1	119.6450	3.491	191	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]N)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(NC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)2(H){1|C<3>,1|O<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(NC){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2780	0.000	1	120.2733	0.011	3	119.6450	3.491	191	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]N)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(NC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)2(H){1|C<3>,2|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(NC){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2710	0.150	2	120.2733	0.011	3	119.6450	3.491	191	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(NN)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]N)(H){1|Ir<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(NN){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0725	0.302	2	120.0725	0.091	2	119.6450	3.491	191	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[5,5,6]H)(C[6]C[6]O)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[5,5,6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(OC){1|C<4>,1|S<2>,2|H<1>}	H(C[6]C[6]2)	119.0325	0.138	2	119.0325	0.019	2	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[5,6,6]O)(C[6]C[6]O)(H)	C[6](C[6]C[5,6,6]O)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[5,6,6]O)(C[6]C[6]O)(H){1|O<1>,3|C<4>}	C[6](C[6]C[5,6,6]O)(C[6]C[6]H)(OC){1|H<1>,1|O<1>,2|C<4>}	H(C[6]C[6]2)	118.3280	0.000	1	118.7030	0.281	2	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[5,6,6]O)(C[6]C[6]O)(H)	C[6](C[6]C[5,6,6]O)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[5,6,6]O)(C[6]C[6]O)(H){1|O<1>,3|C<4>}	C[6](C[6]C[5,6,6]O)(C[6]C[6]H)(OC){1|O<1>,1|S<3>,2|C<4>}	H(C[6]C[6]2)	119.0780	0.000	1	118.7030	0.281	2	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(OC){1|C<4>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	119.7350	0.000	1	119.7350	0.000	1	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[5,6]O)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[5,6]O)(C[6]C[6]O)(H){1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(OC){1|C<4>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	119.5190	0.000	1	119.5190	0.000	1	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(OH)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|O<1>,2|S<2>}	C[6](C[6]C[6]H)2(OH){1|H<1>,2|C<3>}	H(C[6]C[6]2)	123.4340	0.000	1	123.4340	0.000	1	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]O)(H){1|H<1>,1|N<3>,1|O<1>,2|C<3>}	C[6](C[6]C[6]H)2(OC){1|C<4>,2|C<3>}	H(C[6]C[6]2)	120.3220	0.000	1	120.3220	0.000	1	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6,6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6,6]C)(C[6]C[6]O)(H){1|Cl<1>,1|C<3>,2|O<2>}	C[6](C[6]C[6]Cl)(C[6]C[6]H)(OC){1|C<3>,1|C<4>,1|O<1>}	H(C[6]C[6]2)	118.5465	0.296	2	118.5465	0.088	2	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6,6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[6,6]C)(C[6]C[6]O)(H){1|C<3>,1|H<1>,2|O<2>}	C[6](C[6]C[6]H)2(OC){1|C<3>,1|C<4>,1|O<1>}	H(C[6]C[6]2)	117.1960	0.000	1	117.1960	0.000	1	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6,6]C[6a])(C[6]C[6]O)(H)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6,6]C[6a])(C[6]C[6]O)(H){1|C<4>,1|O<1>,3|C<3>}	C[6](C[6]C[6,6]O)(C[6]C[6]H)(OC){1|C<4>,2|C<3>}	H(C[6]C[6]2)	120.1320	0.000	1	120.1320	0.000	1	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]O)(H)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]O)(H){1|C<3>,1|O<1>,1|O<2>}	C[6](C[6]C[6,6]O)(C[6]C[6]H)(OC){1|C<3>,1|C<4>,1|O<1>}	H(C[6]C[6]2)	119.6163	0.140	3	119.3845	0.228	4	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]O)(H)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]O)(H){1|O<1>,2|C<3>}	C[6](C[6]C[6,6]O)(C[6]C[6]H)(OC){1|O<1>,2|C<3>}	H(C[6]C[6]2)	118.6890	0.000	1	119.3845	0.228	4	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]O)(H){1|C<3>,1|H<1>,2|O<2>}	C[6](C[6]C[6]H)2(OC){1|C<3>,1|C<4>,1|O<1>}	H(C[6]C[6]2)	121.9960	0.000	1	121.9960	0.000	1	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6,6a]N)(C[6]C[6]O)(H)	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]N)(C[6]C[6]O)(H){1|O<1>,2|C<3>}	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(OC){1|N<2>,2|C<3>}	H(C[6]C[6]2)	118.9720	0.112	3	118.9720	0.013	3	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6,6a]N)(C[6]C[6]O)(H)	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(OH)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]N)(C[6]C[6]O)(H){1|O<1>,2|C<3>}	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(OH){1|N<2>,2|C<3>}	H(C[6]C[6]2)	118.6820	0.000	1	118.6820	0.000	1	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]O)(H)	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]O)(H){1|O<1>,2|C<3>}	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(OC){1|O<1>,2|C<3>}	H(C[6]C[6]2)	119.0618	0.067	4	119.0618	0.004	4	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]O)(H)	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(OCd)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]O)(H){1|O<2>,2|C<3>}	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(OCd){1|O<1>,2|C<3>}	H(C[6]C[6]2)	117.9960	0.000	1	117.9960	0.000	1	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]O)(H)	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(OCo)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]O)(H){1|O<2>,2|C<3>}	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(OCo){1|O<1>,2|C<3>}	H(C[6]C[6]2)	116.1420	0.000	1	116.1420	0.000	1	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]O)(H)	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(OH)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]O)(H){1|O<1>,2|C<3>}	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(OH){1|O<1>,2|C<3>}	H(C[6]C[6]2)	119.0700	0.344	4	119.0700	0.119	4	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]O)(H)	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(OIr)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]O)(H){1|O<2>,2|C<3>}	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(OIr){1|O<1>,2|C<3>}	H(C[6]C[6]2)	118.9825	0.006	2	118.9825	0.000	2	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6]O)(H){1|C<4>,1|H<1>,1|O<2>,2|C<3>}	C[6](C[6]C[6]H)(C[6]C[6]O)(OC){1|C<2>,1|C<4>,1|O<2>}	H(C[6]C[6]2)	118.4850	0.000	1	118.4850	0.000	1	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(OC){1|Br<1>,2|C<3>}	H(C[6]C[6]2)	120.3335	0.108	2	120.3335	0.012	2	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|Br<1>,1|C<3>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(OC){1|Br<1>,2|C<3>}	H(C[6]C[6]2)	119.2360	0.000	1	119.7580	0.534	6	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(OC){1|Br<1>,1|C<2>,1|C<3>}	H(C[6]C[6]2)	120.6790	0.000	1	119.7580	0.534	6	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(OC){1|C<4>,2|C<3>}	H(C[6]C[6]2)	118.6870	0.000	1	119.7580	0.534	6	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(OC){1|O<2>,2|C<3>}	H(C[6]C[6]2)	119.9635	0.501	2	119.7580	0.534	6	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|C<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(OC){1|C<2>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.0190	0.000	1	119.7580	0.534	6	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(OC){1|Co<6>,1|C<2>,1|C<3>}	H(C[6]C[6]2)	120.6790	0.000	1	120.5702	0.172	5	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(OC){1|Pd<4>,1|C<2>,1|C<3>}	H(C[6]C[6]2)	120.5430	0.473	4	120.5702	0.172	5	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(OH){1|Cd<6>,2|C<3>}	H(C[6]C[6]2)	120.7100	0.000	1	118.9807	2.373	3	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(OH){1|H<1>,2|C<3>}	H(C[6]C[6]2)	118.1160	0.511	2	118.9807	2.373	3	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(OC){1|C<4>,2|C<3>}	H(C[6]C[6]2)	118.7590	0.000	1	117.7774	2.931	7	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|C<4>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(OC){1|C<3>,3|C<4>}	H(C[6]C[6]2)	117.6138	1.814	6	117.7774	2.931	7	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(OH){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.1930	0.686	2	120.1930	0.470	2	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|C<3>,1|C<4>,2|H<1>}	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(OC){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.8930	0.016	2	119.8930	0.000	2	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<4>,1|H<1>,1|O<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(OC){1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	118.8830	0.000	1	118.8830	0.000	1	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]2)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){2|C<3>}	C[6](C[6]C[6]2)(C[6]C[6]H)(OC){1|C<2>,1|C<3>,1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	116.5240	0.000	1	116.5240	0.000	1	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(OC){2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.3720	0.000	1	120.0020	0.794	2	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(OC){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	120.6320	0.000	1	120.0020	0.794	2	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(OCu)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<2>,1|C<3>,1|H<1>}	C[6](C[6]C[6]C)(C[6]C[6]H)(OCu){1|C<3>,1|H<1>}	H(C[6]C[6]2)	115.1025	7.724	2	113.6290	36.342	3	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(OCu)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){2|C<2>}	C[6](C[6]C[6]C)(C[6]C[6]H)(OCu){1|C<2>,1|H<1>}	H(C[6]C[6]2)	110.6820	0.000	1	113.6290	36.342	3	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,2|O<2>}	C[6](C[6]C[6]C)(C[6]C[6]H)(OH){2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.9990	0.000	1	116.3937	37.227	3	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(OH){1|C<2>,2|H<1>}	H(C[6]C[6]2)	114.5910	7.413	2	116.3937	37.227	3	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(OMn)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(OMn){1|C<2>,2|H<1>}	H(C[6]C[6]2)	115.8740	0.000	1	115.8740	0.000	1	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(ONi)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<2>,1|C<3>,1|H<1>}	C[6](C[6]C[6]C)(C[6]C[6]H)(ONi){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.4925	0.633	2	119.4925	0.401	2	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(OP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(OP){1|C<3>,2|H<1>}	H(C[6]C[6]2)	118.8170	0.000	1	118.8170	0.000	1	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(OZn)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<2>,1|C<3>,1|H<1>}	C[6](C[6]C[6]C)(C[6]C[6]H)(OZn){1|C<3>,1|H<1>}	H(C[6]C[6]2)	114.1610	0.000	1	114.1610	0.000	1	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(OC){1|H<1>,2|C<3>}	H(C[6]C[6]2)	118.5160	0.000	1	120.5540	8.307	2	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|N<4>}	C[6](C[6]C[6]H)(C[6]C[6]N)(OC){1|C<2>,2|H<1>}	H(C[6]C[6]2)	122.5920	0.000	1	120.5540	8.307	2	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(OH){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	120.1970	0.020	2	120.1970	0.000	2	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(OC){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.4899	0.367	14	119.4899	0.135	14	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(OH){1|H<1>,2|C<3>}	H(C[6]C[6]2)	118.8747	0.766	19	118.8676	0.557	20	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|O<2>,2|C<3>}	C[6](C[6]C[6]H)(C[6]C[6]O)(OH){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	118.7340	0.000	1	118.8676	0.557	20	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(OC){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.8063	0.374	6	120.7159	0.174	7	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(OC){1|Ir<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1730	0.000	1	120.7159	0.174	7	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(OH){1|Bi<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9600	0.120	2	119.7506	0.671	28	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(OH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9287	0.136	3	119.7506	0.671	28	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(OH){1|Ir<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3155	0.599	2	119.7506	0.671	28	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(OH){1|Mo<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0380	0.000	1	119.7506	0.671	28	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(OH){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0490	0.000	1	119.7506	0.671	28	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(OH){1|Re<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.8410	0.000	1	119.7506	0.671	28	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(OH){1|Sn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.3710	0.000	1	119.7506	0.671	28	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(OH){1|Zn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0300	1.020	3	119.7506	0.671	28	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(OH){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	120.4800	0.000	1	119.7506	0.671	28	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(OH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1950	0.000	1	119.7506	0.671	28	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|N<3>,2|C<4>}	C[6](C[6]C[6]H)(C[6]N[6]C)(OH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.1127	1.037	9	119.7506	0.671	28	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|N<3>,2|C<4>}	C[6](C[6]C[6]H)(C[6]N[6]C)(OH){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9170	0.000	1	119.7506	0.671	28	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|N<3>,2|C<4>}	C[6](C[6]C[6]H)(C[6]N[6]C)(OH){1|Zn<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8425	0.155	2	119.7506	0.671	28	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(OC){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7783	0.291	6	120.8567	0.109	9	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(OC){1|Ir<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.4900	0.000	1	120.8567	0.109	9	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(OC){1|Pt<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7750	0.010	2	120.8567	0.109	9	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(OC[6a])	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(OC[6a]){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3800	0.000	1	121.0830	0.222	5	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(OC[6a])	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(OC[6a]){1|Cu<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.4865	0.248	2	121.0830	0.222	5	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(OC[6a])	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(OC[6a]){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.0320	0.000	1	121.0830	0.222	5	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(OC[6a])	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(OC[6a]){1|Mn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.0300	0.000	1	121.0830	0.222	5	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(OH){1|Ir<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4160	0.334	2	120.1926	0.498	44	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(OH){1|Zn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6207	0.201	3	120.1926	0.498	44	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(OH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.4145	0.469	11	120.1926	0.498	44	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(OH){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.6440	0.000	1	120.1926	0.498	44	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(OH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7284	0.837	18	120.1926	0.498	44	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(OH){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5880	0.058	2	120.1926	0.498	44	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(OH){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.8260	0.000	1	120.1926	0.498	44	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(OH){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.2630	0.000	1	120.1926	0.498	44	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(OH){1|Ir<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5680	0.000	1	120.1926	0.498	44	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(OH){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6630	0.127	2	120.1926	0.498	44	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(OH){1|Pt<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4650	0.000	1	120.1926	0.498	44	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(OH){1|Zn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.8430	0.000	1	120.1926	0.498	44	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(OC){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5780	0.000	1	120.5780	0.000	1	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(OH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9917	0.500	4	119.9917	0.250	4	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(OSn)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(OSn){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9110	0.000	1	119.9110	0.000	1	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]O)(OIr)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|H<1>,1|N<3>,1|O<3>}	C[6](C[6]C[6]H)(C[6]N[6]O)(OIr){1|Ir<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7593	0.438	3	120.7593	0.192	3	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]O)(OMo)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]O)(OMo){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.4020	0.477	2	120.4485	0.083	4	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]O)(OMo)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]O)(OMo){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4950	0.116	2	120.4485	0.083	4	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]O)(ORh)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|H<1>,1|N<3>,1|O<3>}	C[6](C[6]C[6]H)(C[6]N[6]O)(ORh){1|Rh<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3967	0.444	6	120.3967	0.198	6	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]S)(OCu)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]S)(OCu){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.8415	0.039	2	119.8415	0.002	2	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]S)(OZn)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]S)(OZn){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.2427	0.205	3	119.2427	0.042	3	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<2>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(OC){1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.0250	0.000	1	120.4896	8.949	29	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<2>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(OC){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.7600	0.000	1	120.4896	8.949	29	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<2>,2|H<1>}	C[6](C[6]C[6]H)2(OC){1|C<3>,1|H<1>}	H(C[6]C[6]2)	117.6445	5.189	2	120.4896	8.949	29	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)2(OC){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	134.6320	0.000	1	120.4896	8.949	29	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(OC){1|C<2>,2|H<1>}	H(C[6]C[6]2)	120.3585	0.013	2	120.4896	8.949	29	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(OC){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	120.4181	0.184	13	120.4896	8.949	29	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Ni<3>,1|Ni<4>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(OC){1|Ni<4>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.9620	0.000	1	120.4896	8.949	29	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Ru<10>,1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(OC){1|Ru<10>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.7080	0.065	2	120.4896	8.949	29	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Ru<7>,1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(OC){1|Ru<5>,1|Ru<7>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.7760	0.000	1	120.4896	8.949	29	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Ta<12>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(OC){1|Ta<12>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.5580	0.021	2	120.4896	8.949	29	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Ti<10>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(OC){1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.9050	0.403	2	120.4896	8.949	29	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Y<14>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(OC){1|Y<14>,1|C<4>,1|H<1>,1|H<2>}	H(C[6]C[6]2)	119.2600	0.000	1	120.4896	8.949	29	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)2(OH){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	120.2395	0.065	4	119.5521	2.544	14	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(OH){1|H<1>,2|C<3>}	H(C[6]C[6]2)	117.7000	2.227	3	119.5521	2.544	14	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(OH){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	119.9530	1.280	7	119.5521	2.544	14	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(OP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<2>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(OP){1|C<3>,1|H<1>}	H(C[6]C[6]2)	118.8110	0.000	1	119.2510	0.149	3	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(OP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(OP){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.4710	0.086	2	119.2510	0.149	3	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(OP[6])	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<2>,2|H<1>}	C[6](C[6]C[6]H)2(OP[6]){1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.8480	0.000	1	120.8480	0.000	1	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(OC){1|Pd<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.4444	0.486	10	120.4444	0.237	10	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(OH){1|Ir<8>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.8205	0.084	4	119.8948	0.093	6	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(OH){1|Ru<9>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.0435	0.614	2	119.8948	0.093	6	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(OOs)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(OOs){1|Os<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.0540	0.102	2	120.0540	0.010	2	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(OP[6])	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(OP[6]){1|Re<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.9135	0.281	2	120.9135	0.079	2	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]Si)(C[6]C[6]H)(OS)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Si<4>,1|C<3>,1|C<4>,1|O<2>}	C[6](C[6]C[6]Si)(C[6]C[6]H)(OS){1|C<4>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	120.5380	0.000	1	120.5380	0.000	1	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]Zr)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Zr<13>,1|C<4>,1|H<1>}	C[6](C[6]C[6]Zr)(C[6]C[6]H)(OC){1|C<3>,1|H<1>,1|O<3>}	H(C[6]C[6]2)	120.2530	0.000	1	120.2530	0.000	1	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(OC){1|Pt<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.4700	0.000	1	120.4700	0.000	1	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(OH){1|Cu<5>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.3090	0.000	1	119.5407	0.201	6	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(OH){1|Os<6>,1|H<1>,1|N<2>,2|C<3>}	H(C[6]C[6]2)	120.1350	0.000	1	119.5407	0.201	6	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(OH){1|Os<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.0460	0.000	1	119.5407	0.201	6	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(OH){1|Ru<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.6080	0.000	1	119.5407	0.201	6	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(OH){1|Ru<9>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.9880	0.000	1	119.5407	0.201	6	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(OH){1|Zn<5>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.1580	0.000	1	119.5407	0.201	6	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]N[6]Br)(C[6]C[6]H)(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Br<1>,1|H<1>,1|N<3>}	C[6](C[6]N[6]Br)(C[6]C[6]H)(OH){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	120.3540	0.000	1	120.3540	0.000	1	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]N[6]Cl)(C[6]C[6]H)(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Cl<1>,1|H<1>,1|N<3>}	C[6](C[6]N[6]Cl)(C[6]C[6]H)(OH){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	120.3450	0.000	1	120.3450	0.000	1	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]N)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(OC){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.0230	0.000	1	119.9301	0.504	7	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]N)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(OC){1|N<2>,2|C<3>}	H(C[6]C[6]2)	119.9828	0.666	5	119.9301	0.504	7	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]N)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(OC){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.5740	0.000	1	119.9301	0.504	7	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]N[5])(C[6]C[6]O)(H)	C[6](C[6]C[4a]C[6])(C[6]C[6]H)(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]C[6]O)(H){1|C<4>,3|C<3>}	C[6](C[6]C[4a]C[6])(C[6]C[6]H)(OH){1|C<2>,1|N<3>,1|O<2>,2|C<3>}	H(C[6]C[6]2)	119.0570	0.000	1	119.0570	0.000	1	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]O)(H){1|Co<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(OC){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.7555	1.139	4	120.7655	0.407	131	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]O)(H){1|Co<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(OC){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.9916	0.763	32	120.7655	0.407	131	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]O)(H){1|Co<7>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(OC){1|N<3>,2|C<3>}	H(C[6]C[6]2)	121.1755	0.436	2	120.7655	0.407	131	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]O)(H){1|Cu<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(OC){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5303	0.227	3	120.7655	0.407	131	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]O)(H){1|Cu<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(OC){1|N<3>,2|C<3>}	H(C[6]C[6]2)	121.1195	0.391	4	120.7655	0.407	131	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]O)(H){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(OC){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.9225	0.192	4	120.7655	0.407	131	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]O)(H){1|Ir<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(OC){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4357	0.200	3	120.7655	0.407	131	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]O)(H){1|Ir<8>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(OC){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4290	0.259	2	120.7655	0.407	131	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]O)(H){1|Mn<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(OC){1|N<3>,2|C<3>}	H(C[6]C[6]2)	121.6965	0.933	4	120.7655	0.407	131	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]O)(H){1|Ni<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(OC){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8350	0.641	23	120.7655	0.407	131	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]O)(H){1|Pt<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(OC){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.7597	0.540	6	120.7655	0.407	131	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]O)(H){1|Pt<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(OC){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2777	0.356	4	120.7655	0.407	131	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]O)(H){1|Re<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(OC){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2073	0.329	12	120.7655	0.407	131	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]O)(H){1|Rh<8>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(OC){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5715	0.132	2	120.7655	0.407	131	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]O)(H){1|Ru<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(OC){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6358	0.126	4	120.7655	0.407	131	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]O)(H){1|Ru<9>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(OC){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5094	0.388	10	120.7655	0.407	131	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]O)(H){1|Zn<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(OC){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.9388	0.228	6	120.7655	0.407	131	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]O)(H){1|Zn<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(OC){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4483	0.294	6	120.7655	0.407	131	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]O)(H){1|Co<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(OH){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.3910	0.083	2	120.5321	0.064	22	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]O)(H){1|Co<8>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(OH){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4910	0.088	2	120.5321	0.064	22	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]O)(H){1|Cu<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(OH){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5330	0.300	2	120.5321	0.064	22	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]O)(H){1|Ir<8>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(OH){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3800	0.034	2	120.5321	0.064	22	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]O)(H){1|Mn<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(OH){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5620	0.000	1	120.5321	0.064	22	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]O)(H){1|Ni<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(OH){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.7919	0.163	7	120.5321	0.064	22	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]O)(H){1|Re<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(OH){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.3463	0.329	3	120.5321	0.064	22	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]O)(H){1|Ru<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(OH){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5260	0.000	1	120.5321	0.064	22	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]O)(H){1|Ru<9>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(OH){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2230	0.052	2	120.5321	0.064	22	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]C[6]S)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]C[6]S)(H){1|C<2>,1|H<1>,1|O<2>,1|S<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(OC){1|C<4>,1|S<2>}	H(C[6]C[6]2)	119.6830	0.000	1	119.6830	0.000	1	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]C)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(OZn)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]C)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(OZn){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	118.2775	0.078	2	118.2775	0.006	2	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(OC){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7400	0.000	1	119.5325	0.086	2	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]C)(H){1|C<3>,1|O<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(OC){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.3250	0.000	1	119.5325	0.086	2	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(OFe)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]C)(H){1|C<3>,1|C<4>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(OFe){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	119.3163	0.193	6	119.3163	0.037	6	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]C)(H){1|C<3>,1|C<4>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(OH){1|N<3>,2|C<4>}	H(C[6]C[6]2)	119.0200	0.000	1	119.0200	0.000	1	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]C)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(OC){1|N<3>,2|C<4>}	H(C[6]C[6]2)	120.9160	0.006	2	120.6145	0.339	28	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]C)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(OC){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1345	0.135	2	120.6145	0.339	28	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]C)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(OC){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0465	0.255	2	120.6145	0.339	28	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(OC){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7875	0.084	2	120.6145	0.339	28	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(OC){1|N<3>,2|C<4>}	H(C[6]C[6]2)	120.7353	0.316	6	120.6145	0.339	28	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]C)(H){1|Mo<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(OC){1|N<3>,2|C<4>}	H(C[6]C[6]2)	119.9965	0.019	2	120.6145	0.339	28	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]C)(H){1|Ni<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(OC){1|N<3>,2|C<3>}	H(C[6]C[6]2)	121.0390	0.040	2	120.6145	0.339	28	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]C)(H){1|Ni<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(OC){1|N<3>,2|C<4>}	H(C[6]C[6]2)	120.3225	0.414	2	120.6145	0.339	28	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(OC){1|N<3>,2|C<4>}	H(C[6]C[6]2)	120.8303	0.240	4	120.6145	0.339	28	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(OC){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.1985	0.292	2	120.6145	0.339	28	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]C)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(OC){1|N<3>,2|C<3>}	H(C[6]C[6]2)	121.2955	1.983	2	120.6145	0.339	28	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(OC[6a])	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(OC[6a]){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4667	0.178	3	120.4667	0.032	3	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(OH){1|N<3>,2|C<4>}	H(C[6]C[6]2)	119.7937	0.067	6	120.6284	0.241	50	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(OH){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.2826	0.497	10	120.6284	0.241	50	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]C)(H){1|Cd<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(OH){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.8475	0.104	4	120.6284	0.241	50	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]C)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(OH){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.7610	0.263	2	120.6284	0.241	50	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]C)(H){1|Cr<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(OH){1|N<3>,2|C<3>}	H(C[6]C[6]2)	121.0499	0.128	8	120.6284	0.241	50	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]C)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(OH){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.9975	0.190	2	120.6284	0.241	50	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]C)(H){1|Cu<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(OH){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.5470	0.298	4	120.6284	0.241	50	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(OH){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.9383	0.176	6	120.6284	0.241	50	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(OH){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.9840	0.511	2	120.6284	0.241	50	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(OH){1|N<3>,2|C<4>}	H(C[6]C[6]2)	120.7305	0.169	2	120.6284	0.241	50	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]C)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(OH){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.8200	0.318	4	120.6284	0.241	50	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(OP)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(OP){1|N<3>,2|C<4>}	H(C[6]C[6]2)	120.9640	0.182	2	120.9640	0.033	2	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(OZn)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(OZn){1|N<3>,2|C<4>}	H(C[6]C[6]2)	118.9626	0.288	8	118.9626	0.083	8	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(OC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.4265	0.356	2	120.4265	0.127	2	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(OH){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3530	2.047	3	120.3530	4.191	3	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(OZn)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(OZn){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9160	0.000	1	119.9160	0.000	1	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]S)(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|S<4>}	C[6](C[6]C[6]H)(C[6]C[6]S)(OH){1|N<3>,2|H<1>}	H(C[6]C[6]2)	121.6800	0.000	1	121.6800	0.000	1	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(OC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.4710	0.914	2	120.5495	0.409	201	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|B<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(OC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.4462	0.269	4	120.5495	0.409	201	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|B<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(OC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.8113	1.427	4	120.5495	0.409	201	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|C<3>,1|C<6>,1|H<1>}	C[6](C[6]C[6]H)2(OC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.1997	0.081	4	120.5495	0.409	201	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)2(OC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.0182	0.273	4	120.5495	0.409	201	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(OC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.3235	0.448	2	120.5495	0.409	201	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(OC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.0312	0.650	8	120.5495	0.409	201	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(OC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.9720	0.365	4	120.5495	0.409	201	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(OC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.5200	0.724	22	120.5495	0.409	201	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(OC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.5395	0.390	2	120.5495	0.409	201	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(OC){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8395	0.169	4	120.5495	0.409	201	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(OC){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.1580	0.000	1	120.5495	0.409	201	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(OC){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.1550	0.358	2	120.5495	0.409	201	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(OC){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8220	0.438	2	120.5495	0.409	201	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(OC){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.7850	0.292	4	120.5495	0.409	201	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(OC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.0330	1.195	4	120.5495	0.409	201	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(OC){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6895	0.762	12	120.5495	0.409	201	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(OC){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.4200	0.000	1	120.5495	0.409	201	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(OC){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8240	0.390	2	120.5495	0.409	201	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(OC){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	121.1078	0.314	4	120.5495	0.409	201	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(OC){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.9764	0.751	23	120.5495	0.409	201	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(OC){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.4497	0.144	3	120.5495	0.409	201	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(OC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.3542	0.237	6	120.5495	0.409	201	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(OC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.3805	0.540	8	120.5495	0.409	201	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|Pt<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(OC){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3853	0.522	3	120.5495	0.409	201	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|Pt<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(OC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.5375	0.160	4	120.5495	0.409	201	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(OC){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6332	0.383	12	120.5495	0.409	201	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(OC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.6060	0.428	4	120.5495	0.409	201	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|Rh<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(OC){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5850	0.638	2	120.5495	0.409	201	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|Ru<10>,1|Ru<8>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(OC){1|Ru<10>,1|C<4>,1|H<1>,1|N<4>}	H(C[6]C[6]2)	119.9530	0.000	1	120.5495	0.409	201	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(OC){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5002	0.151	5	120.5495	0.409	201	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(OC){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.5940	0.392	2	120.5495	0.409	201	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(OC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.5442	0.460	19	120.5495	0.409	201	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|Ru<9>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(OC){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3152	0.203	9	120.5495	0.409	201	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|Zn<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(OC){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8194	0.176	5	120.5495	0.409	201	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|Zn<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(OC){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	121.1343	0.222	3	120.5495	0.409	201	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(OC[6a])	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(OC[6a]){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7930	0.102	3	120.7930	0.010	3	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(OCo)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(OCo){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.9610	0.102	2	119.9610	0.010	2	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(OCu)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(OCu){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.5805	0.269	2	119.5805	0.073	2	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(OH){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.2620	0.011	2	120.4326	0.196	43	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(OH){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.5423	0.541	22	120.4326	0.196	43	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|Co<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(OH){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3965	0.076	2	120.4326	0.196	43	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(OH){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5130	0.560	2	120.4326	0.196	43	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(OH){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.8730	0.198	2	120.4326	0.196	43	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(OH){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.0585	0.101	2	120.4326	0.196	43	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(OH){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3730	0.274	2	120.4326	0.196	43	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(OH){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6975	0.015	2	120.4326	0.196	43	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(OH){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.3268	0.089	4	120.4326	0.196	43	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(OH){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2910	0.000	1	120.4326	0.196	43	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|Ru<9>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(OH){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3625	0.374	2	120.4326	0.196	43	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(OMn)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(OMn){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.4005	0.226	2	119.4005	0.051	2	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]N)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(OC){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	119.9497	0.325	4	119.9783	0.159	14	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]N)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(OC){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.2023	0.166	4	119.9783	0.159	14	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]N)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(OC){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	119.1985	0.134	2	119.9783	0.159	14	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]N)(H){1|Zn<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(OC){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.1728	0.162	4	119.9783	0.159	14	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]O[6]C)(H)	C[6](C[6]C[6]H)2(OB)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]O[6]C)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(OB){1|O<2>,2|C<4>}	H(C[6]C[6]2)	119.5170	0.816	4	119.5170	0.666	4	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]O[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(OAl)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]O[6]H)(H){1|C<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(OAl){1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.7859	0.345	9	120.7859	0.119	9	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]O[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(OCu)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]O[6]H)(H){1|C<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(OCu){1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.9070	0.000	1	119.9070	0.000	1	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]O[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(OFe)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]O[6]H)(H){1|C<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(OFe){1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.2840	0.152	3	120.2840	0.023	3	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]O[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]O[6]H)(H){1|C<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(OH){1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.1720	0.000	1	119.1720	0.000	1	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]O[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(ONi)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]O[6]H)(H){1|C<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(ONi){1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.9170	0.000	1	120.9170	0.000	1	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]O[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(OSn)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]O[6]H)(H){1|C<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(OSn){1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.4050	0.681	3	120.4050	0.464	3	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]O)2(H){1|C<3>,1|C<4>,1|O<1>}	C[6](C[6]C[6]C)(C[6]C[6]H)(OC){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	119.3717	0.673	3	120.1745	2.881	4	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]O)2(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(OC){1|C<3>,1|O<1>,1|O<2>}	H(C[6]C[6]2)	122.5830	0.000	1	120.1745	2.881	4	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]O)2(H){1|C<2>,2|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(OH){1|C<3>,1|O<1>}	H(C[6]C[6]2)	122.9050	0.000	1	120.5607	21.808	9	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]O)2(H){1|C<3>,2|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(OH){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	121.3932	4.902	6	120.5607	21.808	9	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]O)2(H){1|C<4>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(OH){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	113.9130	0.000	1	120.5607	21.808	9	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]O)2(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(OH){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	119.8690	0.000	1	120.5607	21.808	9	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)2(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(OCu)	H(C[6]C[6]2)	C[6](C[6]C[6]O)2(H){1|C<3>,2|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(OCu){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	118.3540	0.000	1	118.3540	0.000	1	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)2(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]O)2(H){1|C<3>,2|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(OH){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	119.6330	0.000	1	119.6330	0.000	1	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)2(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(ONi)	H(C[6]C[6]2)	C[6](C[6]C[6]O)2(H){1|C<3>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(ONi){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	119.0820	0.000	1	118.9390	0.047	3	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)2(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(ONi)	H(C[6]C[6]2)	C[6](C[6]C[6]O)2(H){1|C<3>,2|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(ONi){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	118.8675	0.251	2	118.9390	0.047	3	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)2(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(OPd)	H(C[6]C[6]2)	C[6](C[6]C[6]O)2(H){1|C<3>,2|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(OPd){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	118.9440	0.653	3	118.9440	0.427	3	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)2(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(OPt)	H(C[6]C[6]2)	C[6](C[6]C[6]O)2(H){1|C<3>,2|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(OPt){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	117.6685	0.206	2	117.6685	0.042	2	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]O)2(H){1|C<3>,1|C<4>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(OC){1|C<3>,1|C<4>,1|O<1>}	H(C[6]C[6]2)	119.6215	0.009	2	120.5768	3.824	5	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]O)2(H){1|C<3>,1|C<4>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(OC){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	119.2430	0.000	1	120.5768	3.824	5	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]O)2(H){1|O<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]C[6]O)(OC){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	123.9920	0.000	1	120.5768	3.824	5	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]O)2(H){1|Pd<5>,1|C<3>,1|C<5>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(OC){1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.4060	0.000	1	120.5768	3.824	5	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(OFe)	H(C[6]C[6]2)	C[6](C[6]C[6]O)2(H){1|C<3>,1|O<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(OFe){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	119.5555	0.305	6	119.5555	0.093	6	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]O)2(H){1|C<3>,1|O<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(OH){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	120.4183	0.947	3	120.4183	0.896	3	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(ONi)	H(C[6]C[6]2)	C[6](C[6]C[6]O)2(H){1|C<3>,1|O<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(ONi){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	119.4015	0.504	2	119.4015	0.254	2	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(OSi)	H(C[6]C[6]2)	C[6](C[6]C[6]O)2(H){1|C<3>,1|O<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(OSi){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	119.3230	0.000	1	119.3230	0.000	1	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]O)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(OC){1|Co<6>,1|C<3>,1|O<2>}	H(C[6]C[6]2)	120.6965	0.094	6	120.6965	0.009	6	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)2(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]O)2(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)2(OC){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	135.1490	0.000	1	120.6442	15.830	16	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)2(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]O)2(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(OC){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	119.5625	0.133	13	120.6442	15.830	16	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)2(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]O)2(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(OC){1|C<3>,1|O<1>,1|O<2>}	H(C[6]C[6]2)	120.4235	3.396	2	120.6442	15.830	16	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)2(H)	C[6](C[6]C[6]H)2(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]O)2(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)2(OH){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	119.6130	0.137	4	119.8236	0.316	17	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)2(H)	C[6](C[6]C[6]H)2(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]O)2(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(OH){1|C<3>,1|O<1>,1|O<2>}	H(C[6]C[6]2)	120.4782	0.292	6	119.8236	0.316	17	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)2(H)	C[6](C[6]C[6]H)2(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]O)2(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(OH){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	119.3829	0.277	7	119.8236	0.316	17	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]O)(H){1|C<2>,1|H<1>,1|O<2>,2|C<3>}	C[6](C[6]C[6]H)2(OC){2|C<3>}	H(C[6]C[6]2)	120.0240	0.000	1	120.0240	0.000	1	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]O)(H)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]O)(H){1|C<4>,1|O<2>,4|C<3>}	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(OC){1|C<4>,1|O<1>,3|C<3>}	H(C[6]C[6]2)	118.4580	0.000	1	118.4580	0.000	1	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]O)(H){1|Cr<6>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(OC){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.1590	0.154	2	119.8951	0.120	10	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]O)(H){1|Ir<6>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(OC){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8291	0.355	8	119.8951	0.120	10	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(OH)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]O)(H){1|Re<6>,1|H<1>,1|N<2>,2|C<3>}	C[6](C[6]C[6]H)2(OH){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.4415	0.057	2	120.3087	0.055	3	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(OH)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]O)(H){1|Re<6>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(OH){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.0430	0.000	1	120.3087	0.055	3	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6a]O[6])(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(OH)	H(C[6]C[6]2)	C[6](C[6]C[6a]O[6])(C[6]C[6]O)(H){1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(OH){1|O<2>,2|C<3>}	H(C[6]C[6]2)	120.3680	1.496	4	120.3680	2.238	4	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]O)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(OC){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.9340	0.000	1	120.9340	0.000	1	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]O)(H){1|Ir<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(OC){1|H<1>,2|N<3>}	H(C[6]C[6]2)	121.4300	0.000	1	121.4245	0.003	6	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]O)(H){1|Pd<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(OC){1|H<1>,2|N<3>}	H(C[6]C[6]2)	121.4117	0.073	3	121.4245	0.003	6	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]O)(H){1|Ru<6>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(OC){3|N<3>}	H(C[6]C[6]2)	121.4410	0.071	2	121.4245	0.003	6	120.2182	1.853	974	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:P[6]-2:	C[6]-3:	C[6](C[6]C[6]P[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]P[6])(C[6]C[6]H)(P[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6]P[6])(C[6]C[6]C)(H){1|C<4>,1|P<2>,2|C<3>}	C[6](C[6]C[6]P[6])(C[6]C[6]H)(P[6]C[6]){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	115.8695	0.042	2	115.8695	0.002	2	115.8695	0.002	2	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]S)(H)	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(SC)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]S)(H){1|C<3>,1|N<2>,1|O<1>}	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(SC){1|O<1>,2|C<3>}	H(C[6]C[6]2)	123.8210	0.272	2	123.8210	0.074	2	120.2209	2.581	238	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]S)(H)	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(SC[6a])	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]S)(H){1|C<3>,1|N<2>,1|O<1>}	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(SC[6a]){1|O<1>,2|C<3>}	H(C[6]C[6]2)	119.0910	0.000	1	118.7047	0.125	3	120.2209	2.581	238	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]S)(H)	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(SC[6a])	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]S)(H){1|O<1>,2|C<3>}	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(SC[6a]){1|O<1>,2|C<3>}	H(C[6]C[6]2)	118.5115	0.161	2	118.7047	0.125	3	120.2209	2.581	238	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]S)(H)	C[6](C[6]C[5,6]O)(C[6]C[6]H)(SC[6a])	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]S)(H){1|C<4>,1|H<1>,1|O<1>}	C[6](C[6]C[5,6]O)(C[6]C[6]H)(SC[6a]){1|C<3>,1|O<2>,2|C<4>}	H(C[6]C[6]2)	116.2380	0.000	1	116.2380	0.000	1	120.2209	2.581	238	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]S)(H)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(SC[6a])	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]S)(H){1|C<4>,1|H<1>,1|O<1>}	C[6](C[6]C[6,6]O)(C[6]C[6]H)(SC[6a]){1|C<3>,1|S<2>,2|C<4>}	H(C[6]C[6]2)	118.5430	0.000	1	118.5430	0.000	1	120.2209	2.581	238	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]S)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(SC[6a])	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]S)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(SC[6a]){1|C<3>,1|C<4>,1|S<2>}	H(C[6]C[6]2)	118.8670	0.156	4	118.8670	0.024	4	120.2209	2.581	238	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]S)(H)	C[6](C[6]C[6]H)2(SB)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]S)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(SB){1|C<3>,2|C<4>}	H(C[6]C[6]2)	119.2380	0.179	4	119.2380	0.032	4	120.2209	2.581	238	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]S)(H)	C[6](C[6]C[6]H)(C[6]C[6]S)(SOs)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]S)(H){1|C<2>,1|H<1>,1|S<2>}	C[6](C[6]C[6]H)(C[6]C[6]S)(SOs){1|C<3>,1|H<1>}	H(C[6]C[6]2)	117.4895	7.729	4	117.4895	59.743	4	120.2209	2.581	238	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]S)(H)	C[6](C[6]C[6]H)(C[6]C[6]S)(SRu)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]S)(H){1|C<3>,1|S<2>}	C[6](C[6]C[6]H)(C[6]C[6]S)(SRu){1|C<2>,2|H<1>}	H(C[6]C[6]2)	118.4450	0.000	1	118.4450	0.000	1	120.2209	2.581	238	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]S)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(SC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]S)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(SC){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.4120	0.000	1	119.4120	0.000	1	120.2209	2.581	238	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]S)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(SC[6a])	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]S)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(SC[6a]){1|Zn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0915	0.192	2	120.0915	0.037	2	120.2209	2.581	238	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]S)(H)	C[6](C[6]C[6]H)(C[6]N[6]S)(SNi)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]S)(H){1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]S)(SNi){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.3265	0.261	2	119.3265	0.068	2	120.2209	2.581	238	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]S)(H)	C[6](C[6]C[6]H)(C[6]N[6]S)(SPd)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]S)(H){1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]S)(SPd){1|C<3>,2|H<1>}	H(C[6]C[6]2)	114.9155	3.845	2	114.9155	14.780	2	120.2209	2.581	238	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]S)(H)	C[6](C[6]C[6]H)(C[6]N[6]S)(SPt)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]S)(H){1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]S)(SPt){1|C<3>,2|H<1>}	H(C[6]C[6]2)	116.9850	0.000	1	116.9850	0.000	1	120.2209	2.581	238	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]S)(H)	C[6](C[6]C[6]H)2(SC[6,6])	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]S)(H){1|C<2>,2|H<1>}	C[6](C[6]C[6]H)2(SC[6,6]){1|C<3>,1|H<1>}	H(C[6]C[6]2)	125.2960	0.000	1	125.2960	0.000	1	120.2209	2.581	238	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]S)(H)	C[6](C[6]C[6]H)2(SC[6a])	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]S)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(SC[6a]){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.4855	0.201	4	119.4855	0.041	4	120.2209	2.581	238	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]S)(H)	C[6](C[6]C[6]H)2(SPd)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]S)(H){1|C<2>,2|H<1>}	C[6](C[6]C[6]H)2(SPd){1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0240	0.000	1	120.0240	0.000	1	120.2209	2.581	238	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]S)(H)	C[6](C[6]C[6]H)2(SRe)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]S)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(SRe){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.6430	2.164	2	119.6430	4.682	2	120.2209	2.581	238	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]S)(H)	C[6](C[6]C[6]H)2(SC)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]S)(H){1|Re<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(SC){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8230	0.000	1	119.8230	0.000	1	120.2209	2.581	238	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]C[6]S)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(SC)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]C[6]S)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]C[6]N)(SC){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	125.6880	0.000	1	125.6880	0.000	1	120.2209	2.581	238	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]C[6]S)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(SC)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]C[6]S)(H){1|C<3>,1|O<1>,1|S<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(SC){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	119.2600	0.000	1	119.2600	0.000	1	120.2209	2.581	238	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]C[6]S)(H)	C[6](C[6]C[6]H)(C[6]C[6]S)(SCu)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]C[6]S)(H){1|C<3>,1|O<1>,1|S<2>}	C[6](C[6]C[6]H)(C[6]C[6]S)(SCu){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	118.7075	0.087	2	118.7075	0.008	2	120.2209	2.581	238	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]C[6]S)(H)	C[6](C[6]C[6]H)(C[6]C[6]S)(SNi)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]C[6]S)(H){1|C<3>,1|O<1>,1|S<2>}	C[6](C[6]C[6]H)(C[6]C[6]S)(SNi){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	119.1500	0.191	2	119.1500	0.036	2	120.2209	2.581	238	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]S)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(SC)	H(C[6]C[6]2)	C[6](C[6]C[6]S)(C[6]N[6]C)(H){1|Zn<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(SC){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.7789	0.318	8	120.7789	0.101	8	120.2209	2.581	238	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(SFe)	H(C[6]C[6]2)	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(SFe){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8940	0.000	1	119.8940	0.000	1	120.2209	2.581	238	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(SIr)	H(C[6]C[6]2)	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(SIr){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.3730	0.000	1	119.3730	0.000	1	120.2209	2.581	238	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(SNi)	H(C[6]C[6]2)	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(SNi){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0340	0.126	2	120.0340	0.016	2	120.2209	2.581	238	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(SPb)	H(C[6]C[6]2)	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(SPb){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.2390	0.000	1	119.2390	0.000	1	120.2209	2.581	238	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(SRh)	H(C[6]C[6]2)	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(SRh){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7903	0.149	4	119.7903	0.022	4	120.2209	2.581	238	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(SRu)	H(C[6]C[6]2)	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(SRu){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8660	0.151	2	119.8660	0.023	2	120.2209	2.581	238	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(SZn)	H(C[6]C[6]2)	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(SZn){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.6160	0.229	2	119.6160	0.052	2	120.2209	2.581	238	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(SC)	H(C[6]C[6]2)	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|C<2>,1|H<1>}	C[6](C[6]C[6]H)2(SC){1|H<1>,1|N<2>}	H(C[6]C[6]2)	122.6380	0.000	1	120.7510	1.641	34	120.2209	2.581	238	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(SC)	H(C[6]C[6]2)	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(SC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	122.2340	2.575	4	120.7510	1.641	34	120.2209	2.581	238	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(SC)	H(C[6]C[6]2)	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(SC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.3620	0.108	10	120.7510	1.641	34	120.2209	2.581	238	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(SC)	H(C[6]C[6]2)	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|Cu<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(SC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.5425	0.145	2	120.7510	1.641	34	120.2209	2.581	238	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(SC)	H(C[6]C[6]2)	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|Hg<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(SC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.4117	0.398	4	120.7510	1.641	34	120.2209	2.581	238	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(SC)	H(C[6]C[6]2)	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(SC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.1200	1.724	4	120.7510	1.641	34	120.2209	2.581	238	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(SC)	H(C[6]C[6]2)	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(SC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	121.3607	1.398	4	120.7510	1.641	34	120.2209	2.581	238	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(SC)	H(C[6]C[6]2)	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(SC){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7450	0.000	1	120.7510	1.641	34	120.2209	2.581	238	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(SC)	H(C[6]C[6]2)	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(SC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.2353	0.328	4	120.7510	1.641	34	120.2209	2.581	238	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(SC[5])	H(C[6]C[6]2)	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(SC[5]){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.5850	0.058	2	120.5850	0.003	2	120.2209	2.581	238	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(SC[6])	H(C[6]C[6]2)	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(SC[6]){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.7769	0.319	8	120.7769	0.102	8	120.2209	2.581	238	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(SC[6a])	H(C[6]C[6]2)	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(SC[6a]){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.9305	0.245	2	120.4135	0.846	10	120.2209	2.581	238	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(SC[6a])	H(C[6]C[6]2)	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|Cd<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(SC[6a]){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.5315	0.210	2	120.4135	0.846	10	120.2209	2.581	238	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(SC[6a])	H(C[6]C[6]2)	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(SC[6a]){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.5535	0.139	4	120.4135	0.846	10	120.2209	2.581	238	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(SC[6a])	H(C[6]C[6]2)	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|Zn<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(SC[6a]){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.4985	2.620	2	120.4135	0.846	10	120.2209	2.581	238	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(SCu)	H(C[6]C[6]2)	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(SCu){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.4819	0.158	8	119.4819	0.025	8	120.2209	2.581	238	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(SIr)	H(C[6]C[6]2)	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(SIr){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.7415	0.401	2	119.8195	0.859	12	120.2209	2.581	238	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(SIr)	H(C[6]C[6]2)	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(SIr){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.8351	1.015	10	119.8195	0.859	12	120.2209	2.581	238	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(SPd)	H(C[6]C[6]2)	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(SPd){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.6640	0.044	2	119.6640	0.002	2	120.2209	2.581	238	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(SS)	H(C[6]C[6]2)	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(SS){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.5509	0.291	18	120.4611	0.099	40	120.2209	2.581	238	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(SS)	H(C[6]C[6]2)	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(SS){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.4500	0.202	2	120.4611	0.099	40	120.2209	2.581	238	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(SS)	H(C[6]C[6]2)	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(SS){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.5115	0.226	4	120.4611	0.099	40	120.2209	2.581	238	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(SS)	H(C[6]C[6]2)	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(SS){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.6625	0.282	4	120.4611	0.099	40	120.2209	2.581	238	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(SS)	H(C[6]C[6]2)	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|Ru<9>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(SS){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.2443	0.316	12	120.4611	0.099	40	120.2209	2.581	238	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(SW)	H(C[6]C[6]2)	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(SW){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.9445	0.278	2	119.9445	0.077	2	120.2209	2.581	238	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]S)(C[6]O[6]C)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(SRh)	H(C[6]C[6]2)	C[6](C[6]C[6]S)(C[6]O[6]C)(H){1|C<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(SRh){1|C<3>,1|C<4>,1|O<2>}	H(C[6]C[6]2)	119.9600	0.000	1	119.9600	0.000	1	120.2209	2.581	238	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]S)(C[6]O[6]C)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(SRu)	H(C[6]C[6]2)	C[6](C[6]C[6]S)(C[6]O[6]C)(H){1|C<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(SRu){1|C<3>,1|C<4>,1|O<2>}	H(C[6]C[6]2)	119.9300	0.132	2	119.9300	0.017	2	120.2209	2.581	238	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]S)(C[6]O[6]C)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(SZn)	H(C[6]C[6]2)	C[6](C[6]C[6]S)(C[6]O[6]C)(H){1|C<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(SZn){1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.1190	0.000	1	119.1190	0.000	1	120.2209	2.581	238	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]S)(C[6]O[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(SCo)	H(C[6]C[6]2)	C[6](C[6]C[6]S)(C[6]O[6]H)(H){1|C<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(SCo){1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.2025	0.585	2	120.2025	0.342	2	120.2209	2.581	238	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]S)(C[6]O[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(SCu)	H(C[6]C[6]2)	C[6](C[6]C[6]S)(C[6]O[6]H)(H){1|C<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(SCu){1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.3280	0.000	1	120.3280	0.000	1	120.2209	2.581	238	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]S)(C[6]O[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(SFe)	H(C[6]C[6]2)	C[6](C[6]C[6]S)(C[6]O[6]H)(H){1|C<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(SFe){1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.0393	0.155	6	120.0393	0.024	6	120.2209	2.581	238	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]S)(C[6]O[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(SMo)	H(C[6]C[6]2)	C[6](C[6]C[6]S)(C[6]O[6]H)(H){1|C<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(SMo){1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.3132	0.184	4	120.3132	0.034	4	120.2209	2.581	238	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]S)(C[6]O[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(SNi)	H(C[6]C[6]2)	C[6](C[6]C[6]S)(C[6]O[6]H)(H){1|C<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(SNi){1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.3240	0.225	2	120.3240	0.051	2	120.2209	2.581	238	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]S)(C[6]O[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(SRu)	H(C[6]C[6]2)	C[6](C[6]C[6]S)(C[6]O[6]H)(H){1|C<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(SRu){1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.1430	0.000	1	120.1430	0.000	1	120.2209	2.581	238	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]S)(C[6]O[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(SZn)	H(C[6]C[6]2)	C[6](C[6]C[6]S)(C[6]O[6]H)(H){1|C<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(SZn){1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.7053	0.337	3	119.7053	0.114	3	120.2209	2.581	238	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]S)(C[6]S[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(SRu)	H(C[6]C[6]2)	C[6](C[6]C[6]S)(C[6]S[6]H)(H){1|C<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(SRu){1|C<3>,1|H<1>,1|S<2>}	H(C[6]C[6]2)	117.6350	0.000	1	117.5670	0.009	2	120.2209	2.581	238	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]S)(C[6]S[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(SRu)	H(C[6]C[6]2)	C[6](C[6]C[6]S)(C[6]S[6]H)(H){1|C<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(SRu){1|C<4>,1|H<1>,1|S<2>}	H(C[6]C[6]2)	117.4990	0.000	1	117.5670	0.009	2	120.2209	2.581	238	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]S)(C[6]S[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(SZn)	H(C[6]C[6]2)	C[6](C[6]C[6]S)(C[6]S[6]H)(H){1|C<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(SZn){1|C<4>,1|H<1>,1|S<2>}	H(C[6]C[6]2)	117.6495	0.040	2	117.6495	0.002	2	120.2209	2.581	238	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]S)(H)	C[6](C[6]C[6]H)2(SC)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]S)(H){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(SC){3|N<3>}	H(C[6]C[6]2)	121.4581	0.174	29	121.4581	0.030	29	120.2209	2.581	238	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Se-2:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]Se)(H)	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(SeC[6a])	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]Se)(H){1|O<1>,2|C<3>}	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(SeC[6a]){1|O<1>,2|C<3>}	H(C[6]C[6]2)	119.1530	0.000	1	119.1530	0.000	1	119.7738	0.952	11	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Se-2:	C[6]-3:	C[6](C[6]C[6]Se)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(SeC[6a])	H(C[6]C[6]2)	C[6](C[6]C[6]Se)(C[6]C[6]H)(H){1|C<2>,2|H<1>}	C[6](C[6]C[6]H)2(SeC[6a]){1|C<3>,1|H<1>}	H(C[6]C[6]2)	118.4235	1.774	2	118.4235	3.148	2	119.7738	0.952	11	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Se-2:	C[6]-3:	C[6](C[6]C[6]Se)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(SeSe)	H(C[6]C[6]2)	C[6](C[6]C[6]Se)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(SeSe){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.5075	0.530	2	120.5075	0.281	2	119.7738	0.952	11	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Se-2:	C[6]-3:	C[6](C[6]C[6]Se)(C[6]O[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(SeCu)	H(C[6]C[6]2)	C[6](C[6]C[6]Se)(C[6]O[6]H)(H){1|C<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(SeCu){1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.0120	0.000	1	120.0120	0.000	1	119.7738	0.952	11	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Se-2:	C[6]-3:	C[6](C[6]C[6]Se)(C[6]O[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(SeFe)	H(C[6]C[6]2)	C[6](C[6]C[6]Se)(C[6]O[6]H)(H){1|C<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(SeFe){1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.1120	0.000	1	120.1120	0.000	1	119.7738	0.952	11	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Se-2:	C[6]-3:	C[6](C[6]C[6]Se)(C[6]O[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(SeNi)	H(C[6]C[6]2)	C[6](C[6]C[6]Se)(C[6]O[6]H)(H){1|C<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(SeNi){1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.3885	0.179	2	120.3885	0.032	2	119.7738	0.952	11	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Se-2:	C[6]-3:	C[6](C[6]C[6]Se)(C[6]O[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(SeZn)	H(C[6]C[6]2)	C[6](C[6]C[6]Se)(C[6]O[6]H)(H){1|C<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(SeZn){1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.7980	0.156	2	119.7980	0.024	2	119.7738	0.952	11	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[4]-3:C[6]-2:	C[6]-3:	C[6](C[6]C[6]N[4])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(N[4]C[4]2)(C[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6]N[4])(C[6]C[6]H)(H){1|C<4>,1|O<2>,2|C<3>}	C[6](C[6]C[6]H)(N[4]C[4]2)(C[6]C[6]){1|C<3>,1|O<1>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	114.3570	0.000	1	114.3570	0.000	1	114.3570	0.000	1	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(CC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]C)(CC){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.6650	0.481	2	119.6650	0.231	2	120.1746	0.280	19	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(CN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]C)(CN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5637	0.223	6	120.5637	0.050	6	120.1746	0.280	19	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(CW)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]C)(CW){1|C<2>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.4295	0.158	4	119.4295	0.025	4	120.1746	0.280	19	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CC){1|C<2>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5020	0.196	4	120.4687	0.063	6	120.1746	0.280	19	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CC){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4020	0.434	2	120.4687	0.063	6	120.1746	0.280	19	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CW)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CW){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.0750	0.000	1	120.0750	0.000	1	120.1746	0.280	19	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-2:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]2)(C[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|H<1>,3|C<3>}	C[6](C[6]C[6]H)(N[6]C[6]2)(C[6]C[6]){1|Br<1>,1|H<1>,1|N<2>,1|O<1>,3|C<3>}	H(C[6]C[6]2)	119.7690	0.000	1	119.7690	0.000	1	119.7690	0.000	1	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(NH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(NH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	116.8270	0.000	1	116.8270	0.000	1	119.7178	2.014	91	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(NS)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(NS){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	118.9865	0.349	2	118.9865	0.122	2	119.7178	2.014	91	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]S)(NS)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]N)(H){1|C<3>,1|H<1>,1|S<4>}	C[6](C[6]C[6]H)(N[6]C[6]S)(NS){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	116.4120	0.000	1	116.4120	0.000	1	119.7178	2.014	91	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]B)(NSi)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]B)(NSi){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.2945	0.199	2	120.2945	0.039	2	119.7178	2.014	91	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(NC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]C)(NC){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.3808	0.253	10	119.3808	0.064	10	119.7178	2.014	91	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(NC[6])	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]C)(NC[6]){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.4560	0.173	2	119.4560	0.030	2	119.7178	2.014	91	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(NH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]C)(NH){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3140	0.107	2	120.3140	0.012	2	119.7178	2.014	91	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(NN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,2|C<4>}	C[6](C[6]C[6]H)(N[6]C[6]C)(NN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	118.4570	0.000	1	118.4570	0.000	1	119.7178	2.014	91	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(NS)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,3|C<4>}	C[6](C[6]C[6]H)(N[6]C[6]C)(NS){1|C<4>,3|H<1>}	H(C[6]C[6]2)	119.4950	0.311	2	119.4950	0.097	2	119.7178	2.014	91	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(NC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(NC){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5530	0.236	2	120.5530	0.056	2	119.7178	2.014	91	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(NC[5])	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(NC[5]){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.6395	0.069	2	120.6395	0.005	2	119.7178	2.014	91	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(NC[6a])	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(NC[6a]){1|C<3>,2|H<1>}	H(C[6]C[6]2)	116.9960	0.000	1	116.9960	0.000	1	119.7178	2.014	91	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(NH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Br<1>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(NH){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	119.6240	0.208	2	118.7935	3.066	11	119.7178	2.014	91	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(NH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Br<1>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(NH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.5900	0.037	2	118.7935	3.066	11	119.7178	2.014	91	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(NH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(NH){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	118.2555	4.676	2	118.7935	3.066	11	119.7178	2.014	91	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(NH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(NH){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	117.8840	0.396	3	118.7935	3.066	11	119.7178	2.014	91	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(NH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(NH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.0690	1.605	2	118.7935	3.066	11	119.7178	2.014	91	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(NN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(NN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3303	0.353	3	120.3303	0.125	3	119.7178	2.014	91	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(NP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(NP){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1180	0.000	1	120.1180	0.000	1	119.7178	2.014	91	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(NP[6])	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(NP[6]){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7810	0.000	1	119.7810	0.000	1	119.7178	2.014	91	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(NS)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(NS){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7336	0.588	7	119.8007	1.017	36	119.7178	2.014	91	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(NS)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,1|H<1>,1|I<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(NS){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8122	0.121	5	119.8007	1.017	36	119.7178	2.014	91	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(NS)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(NS){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.9360	1.205	3	119.8007	1.017	36	119.7178	2.014	91	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(NS)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(NS){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.6495	3.884	2	119.8007	1.017	36	119.7178	2.014	91	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(NS)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(NS){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2368	0.163	8	119.8007	1.017	36	119.7178	2.014	91	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(NS)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(NS){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.3298	0.989	11	119.8007	1.017	36	119.7178	2.014	91	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(NC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(N[6]C[6]O)(NC){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7600	0.000	1	119.7600	0.000	1	119.7178	2.014	91	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(NC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]N)(H){1|C<3>,1|C<4>,1|O<1>}	C[6](C[6]C[6]H)(N[6]C[6]O)(NC){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9190	0.000	1	119.9190	0.000	1	119.7178	2.014	91	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-2:	C[6]-3:	C[6](C[6]N[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(NH)	H(C[6]C[6]2)	C[6](C[6]N[6]H)(C[6]N[6]N)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(NH){1|H<1>,1|N<3>,1|O<1>}	H(C[6]C[6]2)	119.9310	0.000	1	121.5033	7.125	7	119.7178	2.014	91	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-2:	C[6]-3:	C[6](C[6]N[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(NH)	H(C[6]C[6]2)	C[6](C[6]N[6]H)(C[6]N[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(NH){1|H<1>,1|N<3>,1|O<1>}	H(C[6]C[6]2)	119.7967	1.888	3	121.5033	7.125	7	119.7178	2.014	91	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-2:	C[6]-3:	C[6](C[6]N[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(NH)	H(C[6]C[6]2)	C[6](C[6]N[6]H)(C[6]N[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(NH){1|H<1>,1|N<3>,1|S<1>}	H(C[6]C[6]2)	123.7340	2.178	3	121.5033	7.125	7	119.7178	2.014	91	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-2:	C[6]-3:	C[6](C[6]N[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(NPt)	H(C[6]C[6]2)	C[6](C[6]N[6]H)(C[6]N[6]N)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(NPt){1|H<1>,1|N<3>,1|O<1>}	H(C[6]C[6]2)	121.0320	0.000	1	121.0320	0.000	1	119.7178	2.014	91	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-2:	C[6]-3:	C[6](C[6]N[6]N)2(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(NH)	H(C[6]C[6]2)	C[6](C[6]N[6]N)2(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(NH){3|N<3>}	H(C[6]C[6]2)	120.6680	0.000	1	120.6680	0.000	1	119.7178	2.014	91	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N[6]-2:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]N[6]2)(H)	C[6](C[6]C[6]H)(N[6]C[6]2)(N[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]N[6]2)(H){1|Fe<10>,1|Pd<4>,1|C<3>,4|C<4>}	C[6](C[6]C[6]H)(N[6]C[6]2)(N[6]C[6]){1|N<3>,3|C<4>,5|H<1>}	H(C[6]C[6]2)	120.7230	0.000	1	120.7230	0.000	1	120.4835	0.115	2	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N[6]-2:	C[6]-3:	C[6](C[6]N[6]2)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]2)(N[6]C[6])	H(C[6]C[6]2)	C[6](C[6]N[6]2)(C[6]N[6]N)(H){1|C<3>,1|O<2>,2|C<4>}	C[6](C[6]C[6]H)(N[6]C[6]2)(N[6]C[6]){2|C<4>,3|N<3>,4|H<1>}	H(C[6]C[6]2)	120.2440	0.000	1	120.2440	0.000	1	120.4835	0.115	2	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]O)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(OH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.1617	0.704	3	120.1617	0.496	3	120.3781	2.329	77	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)(N[6]C[6]2)(OCd)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(N[6]C[6]2)(OCd){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.0420	0.000	1	119.0420	0.000	1	120.3781	2.329	77	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)(N[6]C[6]2)(OCu)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(N[6]C[6]2)(OCu){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	118.8390	0.000	1	118.8390	0.000	1	120.3781	2.329	77	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]C)(OC){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4550	0.000	1	120.4550	0.000	1	120.3781	2.329	77	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(OCo)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]C)(OCo){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7590	0.000	1	119.7590	0.000	1	120.3781	2.329	77	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]C)(OH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0790	0.000	1	120.0790	0.000	1	120.3781	2.329	77	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(OMg)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]C)(OMg){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.6130	0.000	1	119.6130	0.000	1	120.3781	2.329	77	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(OC){1|C<3>,2|H<1>}	H(C[6]C[6]2)	118.5090	0.000	1	119.9575	4.196	2	120.3781	2.329	77	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(OC){1|Ir<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.4060	0.000	1	119.9575	4.196	2	120.3781	2.329	77	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(OCo)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(OCo){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.9490	0.000	1	119.9490	0.000	1	120.3781	2.329	77	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(OFe)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(OFe){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8852	0.137	4	119.8852	0.019	4	120.3781	2.329	77	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(OH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	113.4090	0.000	1	119.0376	9.352	8	120.3781	2.329	77	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(OH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.6897	2.378	6	119.0376	9.352	8	120.3781	2.329	77	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(OH){1|Cl<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7540	0.000	1	119.0376	9.352	8	120.3781	2.329	77	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(OZn)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(OZn){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0138	0.266	8	120.0138	0.071	8	120.3781	2.329	77	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)(N[6]C[6]I)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|C<3>,1|H<1>,1|I<3>}	C[6](C[6]C[6]H)(N[6]C[6]I)(OC){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.7780	0.113	2	120.7780	0.013	2	120.3781	2.329	77	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(OSn)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(N[6]C[6]O)(OSn){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.0250	0.311	2	120.0250	0.097	2	120.3781	2.329	77	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)(N[6]C[6]W)(OP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|C<3>,1|H<1>,1|W<6>}	C[6](C[6]C[6]H)(N[6]C[6]W)(OP){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	121.0915	0.295	2	121.0915	0.087	2	120.3781	2.329	77	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)(N[6]C[6]W)(OSi)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|C<3>,1|H<1>,1|W<9>}	C[6](C[6]C[6]H)(N[6]C[6]W)(OSi){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.8570	0.000	1	120.8570	0.000	1	120.3781	2.329	77	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:O-2:	C[6]-3:	C[6](C[6]N[6]O)2(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(OMn)	H(C[6]C[6]2)	C[6](C[6]N[6]O)2(H){1|C<3>,2|C<4>}	C[6](C[6]C[6]H)(N[6]C[6]C)(OMn){1|N<3>,1|O<1>,1|S<1>}	H(C[6]C[6]2)	118.9680	0.163	4	119.0513	0.033	6	120.3781	2.329	77	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:O-2:	C[6]-3:	C[6](C[6]N[6]O)2(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(OMn)	H(C[6]C[6]2)	C[6](C[6]N[6]O)2(H){1|C<3>,2|C<4>}	C[6](C[6]C[6]H)(N[6]C[6]C)(OMn){1|N<3>,1|O<2>,1|S<1>}	H(C[6]C[6]2)	119.2180	0.037	2	119.0513	0.033	6	120.3781	2.329	77	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:O-2:	C[6]-3:	C[6](C[6]N[6]O)2(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]N[6]O)2(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(OC){1|N<2>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	122.0412	0.172	21	122.0519	0.031	22	120.3781	2.329	77	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:O-2:	C[6]-3:	C[6](C[6]N[6]O)2(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]N[6]O)2(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(OC){1|N<2>,1|O<2>,1|S<2>}	H(C[6]C[6]2)	122.2760	0.000	1	122.0519	0.031	22	120.3781	2.329	77	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:O-2:	C[6]-3:	C[6](C[6]N[6]O)2(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(OCa)	H(C[6]C[6]2)	C[6](C[6]N[6]O)2(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(OCa){1|N<3>,1|O<1>,1|S<1>}	H(C[6]C[6]2)	119.8185	0.190	2	119.4977	0.154	4	120.3781	2.329	77	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:O-2:	C[6]-3:	C[6](C[6]N[6]O)2(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(OCa)	H(C[6]C[6]2)	C[6](C[6]N[6]O)2(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(OCa){1|N<3>,1|O<2>,1|S<1>}	H(C[6]C[6]2)	119.1770	0.120	2	119.4977	0.154	4	120.3781	2.329	77	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:O-2:	C[6]-3:	C[6](C[6]N[6]O)2(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(OLi)	H(C[6]C[6]2)	C[6](C[6]N[6]O)2(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(OLi){1|N<3>,1|O<1>,1|S<1>}	H(C[6]C[6]2)	119.6785	0.207	2	119.4895	0.034	6	120.3781	2.329	77	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:O-2:	C[6]-3:	C[6](C[6]N[6]O)2(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(OLi)	H(C[6]C[6]2)	C[6](C[6]N[6]O)2(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(OLi){1|N<3>,1|O<2>,1|S<1>}	H(C[6]C[6]2)	119.3950	0.082	4	119.4895	0.034	6	120.3781	2.329	77	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)(N[6]C[6]B)(SPd)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]B)(SPd){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7363	0.544	3	119.7363	0.295	3	119.8594	4.071	91	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)(N[6]C[6]B)(SPt)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]B)(SPt){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8230	0.000	1	119.8230	0.000	1	119.8594	4.071	91	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)(N[6]C[6]B)(SRh)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]B)(SRh){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.6630	0.123	2	119.6630	0.015	2	119.8594	4.071	91	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)(N[6]C[6]B)(SRu)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]B)(SRu){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7443	0.243	3	119.7443	0.059	3	119.8594	4.071	91	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(SC[6a])	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]C)(SC[6a]){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3480	0.000	1	120.3480	0.000	1	119.8594	4.071	91	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(SCu)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]C)(SCu){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.0945	0.177	4	119.0945	0.031	4	119.8594	4.071	91	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(SFe)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(N[6]C[6]C)(SFe){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.4440	0.000	1	119.4440	0.000	1	119.8594	4.071	91	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(SC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(SC){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1070	0.526	4	120.1070	0.277	4	119.8594	4.071	91	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(SCd)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(SCd){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7223	0.279	3	119.7223	0.078	3	119.8594	4.071	91	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(SCu)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(SCu){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.4727	0.678	6	119.3178	0.564	8	119.8594	4.071	91	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(SCu)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(SCu){1|H<1>,2|C<3>}	H(C[6]C[6]2)	118.8530	1.034	2	119.3178	0.564	8	119.8594	4.071	91	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(SFe)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(SFe){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9360	0.000	1	119.9360	0.000	1	119.8594	4.071	91	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(SIr)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(SIr){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8680	0.000	1	119.8680	0.000	1	119.8594	4.071	91	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(SMo)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(SMo){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.5480	0.000	1	119.5480	0.000	1	119.8594	4.071	91	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(SPt)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(SPt){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0885	0.337	2	120.0885	0.114	2	119.8594	4.071	91	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(SRe)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(SRe){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2720	0.000	1	120.2720	0.000	1	119.8594	4.071	91	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(SRh)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(SRh){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7230	0.000	1	119.7230	0.000	1	119.8594	4.071	91	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(SS)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(SS){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4340	0.000	1	120.4340	0.000	1	119.8594	4.071	91	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(SZn)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(SZn){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7605	0.101	2	119.7605	0.010	2	119.8594	4.071	91	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)(N[6]C[6]N)(SIr)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(N[6]C[6]N)(SIr){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.7380	0.000	1	120.1540	0.682	2	119.8594	4.071	91	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)(N[6]C[6]N)(SIr)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(N[6]C[6]N)(SIr){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.5700	0.000	1	120.1540	0.682	2	119.8594	4.071	91	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(SC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(N[6]C[6]O)(SC){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0258	0.224	17	120.0258	0.050	17	119.8594	4.071	91	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(SCr)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(N[6]C[6]O)(SCr){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.1227	0.310	3	119.1227	0.096	3	119.8594	4.071	91	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(SIr)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(N[6]C[6]O)(SIr){1|C<3>,2|H<1>}	H(C[6]C[6]2)	134.6300	0.000	1	134.6300	0.000	1	119.8594	4.071	91	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(SMg)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(N[6]C[6]O)(SMg){1|C<3>,2|H<1>}	H(C[6]C[6]2)	118.9070	0.000	1	118.9070	0.000	1	119.8594	4.071	91	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(SPd)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(N[6]C[6]O)(SPd){1|C<3>,2|H<1>}	H(C[6]C[6]2)	113.7385	6.160	2	113.7385	37.941	2	119.8594	4.071	91	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(SRu)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(N[6]C[6]O)(SRu){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.3590	0.359	2	119.3590	0.129	2	119.8594	4.071	91	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(SS)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(N[6]C[6]O)(SS){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.5457	0.895	4	119.5457	0.801	4	119.8594	4.071	91	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(SSn)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(N[6]C[6]O)(SSn){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.3150	0.112	2	119.3150	0.012	2	119.8594	4.071	91	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(SZn)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(N[6]C[6]O)(SZn){1|C<3>,2|H<1>}	H(C[6]C[6]2)	118.9958	0.277	4	118.9958	0.077	4	119.8594	4.071	91	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)(N[6]N[6]B)(SCo)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|B<4>,1|C<4>,1|N<2>}	C[6](C[6]C[6]H)(N[6]N[6]B)(SCo){1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6470	0.126	3	120.6470	0.016	3	119.8594	4.071	91	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)(N[6]N[6]B)(SNi)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|B<4>,1|C<4>,1|N<2>}	C[6](C[6]C[6]H)(N[6]N[6]B)(SNi){1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7987	0.206	6	120.7987	0.043	6	119.8594	4.071	91	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)(N[6]N[6]H)(SCu)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|C<4>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(N[6]N[6]H)(SCu){1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0380	0.160	2	120.0380	0.026	2	119.8594	4.071	91	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:S-2:	C[6]-3:	C[6](C[6]N[6]H)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(SCu)	H(C[6]C[6]2)	C[6](C[6]N[6]H)(C[6]N[6]S)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(SCu){1|H<1>,1|N<2>,1|S<2>}	H(C[6]C[6]2)	121.1860	0.171	2	121.1860	0.029	2	119.8594	4.071	91	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:Se-2:	C[6]-3:	C[6](C[6]N[6]Se)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(SeCl)	H(C[6]C[6]2)	C[6](C[6]N[6]Se)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(N[6]C[6]O)(SeCl){1|C<3>,2|H<1>}	H(C[6]C[6]2)	121.0350	0.000	1	121.0350	0.000	1	121.0350	0.000	1	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-2:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]C[6]){1|H<1>,2|C<4>,4|C<3>}	H(C[6]C[6]2)	119.7085	0.411	10	119.7085	0.169	10	120.6606	5.098	14	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-2:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6a]C[6a,6a]C[6a])(C[6]C[6]H)(C[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Co<6>,1|N<3>,4|C<3>}	C[6](C[6a]C[6a,6a]C[6a])(C[6]C[6]H)(C[6]C[6]){1|H<1>,1|N<3>,5|C<3>}	H(C[6]C[6]2)	120.6150	0.000	1	120.6150	0.000	1	120.6606	5.098	14	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-2:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H){5|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]C[6]){1|N<2>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.2040	0.000	1	120.2040	0.000	1	120.6606	5.098	14	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-2:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]C[6]){1|N<2>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	125.6720	2.290	2	125.6720	5.242	2	120.6606	5.098	14	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:N[6]-2:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H){1|O<2>,2|C<4>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]){1|C<4>,1|O<2>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.5430	0.000	1	119.8895	0.240	2	120.3683	1.181	14	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:N[6]-2:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H){5|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]){1|C<2>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.2360	0.000	1	119.8895	0.240	2	120.3683	1.181	14	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:N[6]-2:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]N[6])	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]N[6]){1|S<4>,2|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.9310	0.000	1	119.9310	0.000	1	120.3683	1.181	14	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:N[6]-2:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]N[6])	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){2|C<3>,2|N<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]N[6]){1|Re<6>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.3410	0.000	1	120.3410	0.000	1	120.3683	1.181	14	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:N[6]-2:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)(N[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|H<1>,1|N<2>}	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)(N[6]C[6]){2|H<1>,3|C<3>}	H(C[6]C[6]2)	121.1095	2.336	2	121.1095	5.455	2	120.3683	1.181	14	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:N[6]-2:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]N[6])(H)	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)(N[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]N[6])(H){1|Zn<5>,1|N<2>,1|N<3>,3|C<3>}	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)(N[6]C[6]){1|H<1>,1|N<3>,4|C<3>}	H(C[6]C[6]2)	120.9190	0.000	1	120.9190	0.000	1	120.3683	1.181	14	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:N[6]-2:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6a]O[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6a]O[6])(H){1|C<4>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]){1|O<2>,3|H<1>,4|C<3>}	H(C[6]C[6]2)	121.4460	0.000	1	121.4460	0.000	1	120.3683	1.181	14	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:N[6]-2:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6a]S[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6a]S[6])(H){5|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]){1|S<1>,1|S<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	118.0850	0.000	1	118.0850	0.000	1	120.3683	1.181	14	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:N[6]-2:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]N[6]C)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]N[6]C)(H){1|C<4>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]){1|C<4>,1|N<3>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	121.1320	0.000	1	121.1320	0.000	1	120.3683	1.181	14	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:N[6]-2:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]O[6]C)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]O[6]C)(H){1|C<4>,2|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]){1|O<2>,2|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.9440	0.000	1	120.9440	0.000	1	120.3683	1.181	14	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:N[6]-2:	C[6]-3:	C[6](C[6]C[6a]N[6])2(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])2(H){1|H<1>,5|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]){2|H<1>,2|N<3>,3|C<3>}	H(C[6]C[6]2)	120.3950	0.000	1	120.1200	0.063	3	120.3683	1.181	14	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:N[6]-2:	C[6]-3:	C[6](C[6]C[6a]N[6])2(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])2(H){1|Ir<6>,5|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]){1|N<3>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.9825	0.115	2	120.1200	0.063	3	120.3683	1.181	14	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:O[6]-2:	C[6]-3:	C[6](C[6]C[5a]O[6])(C[6]C[6a]O[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(O[6]B[6])	H(C[6]C[6]2)	C[6](C[6]C[5a]O[6])(C[6]C[6a]O[6])(H){1|B<4>,1|O<2>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(O[6]B[6]){1|O<2>,2|F<1>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.5170	0.205	3	120.1725	0.193	6	119.4979	1.722	124	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:O[6]-2:	C[6]-3:	C[6](C[6]C[5a]O[6])(C[6]C[6a]O[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(O[6]B[6])	H(C[6]C[6]2)	C[6](C[6]C[5a]O[6])(C[6]C[6a]O[6])(H){1|B<4>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(O[6]B[6]){1|O<2>,2|F<1>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.8280	0.288	3	120.1725	0.193	6	119.4979	1.722	124	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:O[6]-2:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6a]O[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(O[6]B[6])	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6a]O[6])(H){1|B<4>,2|H<1>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(O[6]B[6]){1|C<4>,2|H<1>,5|C<3>}	H(C[6]C[6]2)	119.7855	0.153	2	119.7855	0.024	2	119.4979	1.722	124	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:O[6]-2:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6a]O[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(O[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6a]O[6])(H){1|C<4>,5|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(O[6]C[6]){2|H<1>,5|C<3>}	H(C[6]C[6]2)	119.5295	0.146	2	119.4092	0.125	15	119.4979	1.722	124	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:O[6]-2:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6a]O[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(O[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6a]O[6])(H){1|H<1>,5|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(O[6]C[6]){2|H<1>,5|C<3>}	H(C[6]C[6]2)	119.3907	0.375	13	119.4092	0.125	15	119.4979	1.722	124	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:O[6]-2:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6a]O[6])(H)	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)(O[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6a]O[6])(H){1|H<1>,1|N<2>,4|C<3>}	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)(O[6]C[6]){1|H<1>,5|C<3>}	H(C[6]C[6]2)	119.6515	0.001	2	119.6515	0.000	2	119.4979	1.722	124	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:O[6]-2:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6a]O[6])(H)	C[6](C[6a]C[6a,6a]C[6a])(C[6]C[6]H)(O[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6a]O[6])(H){1|C<4>,4|C<3>}	C[6](C[6a]C[6a,6a]C[6a])(C[6]C[6]H)(O[6]C[6]){1|N<2>,2|H<1>,5|C<3>}	H(C[6]C[6]2)	121.4300	0.000	1	121.4300	0.000	1	119.4979	1.722	124	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:O[6]-2:	C[6]-3:	C[6](C[6]C[6a]O[6])(C[6]C[5]C[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(O[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6a]O[6])(C[6]C[5]C[6])(H){1|C<4>,1|H<1>,1|N<3>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(O[6]C[6]){2|H<1>,5|C<3>}	H(C[6]C[6]2)	118.1435	0.330	4	118.3333	0.160	6	119.4979	1.722	124	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:O[6]-2:	C[6]-3:	C[6](C[6]C[6a]O[6])(C[6]C[5]C[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(O[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6a]O[6])(C[6]C[5]C[6])(H){1|H<1>,2|N<3>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(O[6]C[6]){2|H<1>,5|C<3>}	H(C[6]C[6]2)	118.7130	0.205	2	118.3333	0.160	6	119.4979	1.722	124	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:O[6]-2:	C[6]-3:	C[6](C[6]C[6a]O[6])(C[6]C[6]2)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(O[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6a]O[6])(C[6]C[6]2)(H){1|H<1>,2|N<3>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(O[6]C[6]){2|H<1>,5|C<3>}	H(C[6]C[6]2)	120.2360	0.168	2	118.8704	0.765	10	119.4979	1.722	124	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:O[6]-2:	C[6]-3:	C[6](C[6]C[6a]O[6])(C[6]C[6]2)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(O[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6a]O[6])(C[6]C[6]2)(H){1|H<1>,5|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(O[6]C[6]){2|H<1>,5|C<3>}	H(C[6]C[6]2)	118.5290	0.559	8	118.8704	0.765	10	119.4979	1.722	124	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:O[6]-2:	C[6]-3:	C[6](C[6]C[6a]O[6])(C[6]C[6]C)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(O[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6a]O[6])(C[6]C[6]C)(H){1|C<4>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(O[6]C[6]){1|O<2>,2|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	107.3060	0.000	1	116.6610	27.529	5	119.4979	1.722	124	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:O[6]-2:	C[6]-3:	C[6](C[6]C[6a]O[6])(C[6]C[6]C)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(O[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6a]O[6])(C[6]C[6]C)(H){1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(O[6]C[6]){2|H<1>,5|C<3>}	H(C[6]C[6]2)	118.9998	0.490	4	116.6610	27.529	5	119.4979	1.722	124	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:O[6]-2:	C[6]-3:	C[6](C[6]C[6a]O[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(O[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6a]O[6])(C[6]C[6]H)(H){4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(O[6]C[6]){1|N<2>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.1640	0.000	1	120.1640	0.000	1	119.4979	1.722	124	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:O[6]-2:	C[6]-3:	C[6](C[6]C[6a]O[6])(C[6]C[6]O)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(O[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6a]O[6])(C[6]C[6]O)(H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(O[6]C[6]){1|C<4>,1|O<1>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	119.1700	0.000	1	119.3238	1.636	5	119.4979	1.722	124	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:O[6]-2:	C[6]-3:	C[6](C[6]C[6a]O[6])(C[6]C[6]O)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(O[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6a]O[6])(C[6]C[6]O)(H){1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(O[6]C[6]){1|O<2>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.3623	1.473	4	119.3238	1.636	5	119.4979	1.722	124	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:O[6]-2:	C[6]-3:	C[6](C[6]C[6a]O[6])(C[6]N[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(O[6]B[6])	H(C[6]C[6]2)	C[6](C[6]C[6a]O[6])(C[6]N[6]H)(H){1|B<4>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(O[6]B[6]){1|N<3>,2|C<3>,2|F<1>,3|H<1>}	H(C[6]C[6]2)	122.0890	0.000	1	122.0890	0.000	1	119.4979	1.722	124	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:O[6]-2:	C[6]-3:	C[6](C[6]C[6a]O[6])(C[6]N[6]S)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(O[6]B[6])	H(C[6]C[6]2)	C[6](C[6]C[6a]O[6])(C[6]N[6]S)(H){1|B<4>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(O[6]B[6]){1|N<3>,1|S<2>,2|C<3>,2|F<1>,2|H<1>}	H(C[6]C[6]2)	119.7350	0.000	1	119.7350	0.000	1	119.4979	1.722	124	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:O[6]-2:	C[6]-3:	C[6](C[6]C[6a]O[6])(C[6]O[6]C)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(O[6]B[6])	H(C[6]C[6]2)	C[6](C[6]C[6a]O[6])(C[6]O[6]C)(H){1|B<4>,2|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(O[6]B[6]){1|C<4>,1|O<2>,2|C<3>,2|F<1>,2|H<1>}	H(C[6]C[6]2)	119.5743	0.477	3	119.5605	0.153	4	119.4979	1.722	124	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:O[6]-2:	C[6]-3:	C[6](C[6]C[6a]O[6])(C[6]O[6]C)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(O[6]B[6])	H(C[6]C[6]2)	C[6](C[6]C[6a]O[6])(C[6]O[6]C)(H){1|B<4>,2|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(O[6]B[6]){1|O<2>,2|F<1>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.5190	0.000	1	119.5605	0.153	4	119.4979	1.722	124	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:O[6]-2:	C[6]-3:	C[6](C[6]C[6a]O[6])(C[6]O[6]O)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(O[6]B[6])	H(C[6]C[6]2)	C[6](C[6]C[6a]O[6])(C[6]O[6]O)(H){1|B<4>,2|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(O[6]B[6]){2|C<3>,2|F<1>,2|H<1>,2|O<2>}	H(C[6]C[6]2)	119.9880	0.000	1	119.9880	0.000	1	119.4979	1.722	124	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:O[6]-2:	C[6]-3:	C[6](C[6]C[6a]O[6])(C[6]O[6]S)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(O[6]B[6])	H(C[6]C[6]2)	C[6](C[6]C[6a]O[6])(C[6]O[6]S)(H){1|B<4>,2|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(O[6]B[6]){1|O<2>,1|S<2>,2|C<3>,2|F<1>,2|H<1>}	H(C[6]C[6]2)	120.4850	0.000	1	120.4850	0.000	1	119.4979	1.722	124	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:O[6]-2:	C[6]-3:	C[6](C[6]C[6a]O[6])2(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(O[6]B[6])	H(C[6]C[6]2)	C[6](C[6]C[6a]O[6])2(H){1|B<4>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(O[6]B[6]){1|C<4>,1|H<1>,1|O<2>,2|F<1>,3|C<3>}	H(C[6]C[6]2)	119.2527	0.281	3	119.7767	0.189	63	119.4979	1.722	124	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:O[6]-2:	C[6]-3:	C[6](C[6]C[6a]O[6])2(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(O[6]B[6])	H(C[6]C[6]2)	C[6](C[6]C[6a]O[6])2(H){1|B<4>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(O[6]B[6]){1|O<2>,2|F<1>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.6908	0.397	47	119.7767	0.189	63	119.4979	1.722	124	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:O[6]-2:	C[6]-3:	C[6](C[6]C[6a]O[6])2(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(O[6]B[6])	H(C[6]C[6]2)	C[6](C[6]C[6a]O[6])2(H){1|B<4>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(O[6]B[6]){1|O<2>,2|H<1>,5|C<3>}	H(C[6]C[6]2)	120.1670	0.197	12	119.7767	0.189	63	119.4979	1.722	124	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:O[6]-2:	C[6]-3:	C[6](C[6]C[6a]O[6])2(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(O[6]B[6])	H(C[6]C[6]2)	C[6](C[6]C[6a]O[6])2(H){1|B<4>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(O[6]B[6]){1|O<2>,3|C<3>,4|F<1>}	H(C[6]C[6]2)	120.7050	0.000	1	119.7767	0.189	63	119.4979	1.722	124	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:P[6]-2:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6a]P[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(P[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6a]P[6])(H){1|H<1>,5|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(P[6]C[6]){1|O<2>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	117.8130	0.000	1	117.3860	0.140	3	117.3860	0.140	3	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:P[6]-2:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6a]P[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(P[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6a]P[6])(H){1|H<1>,5|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(P[6]C[6]){2|H<1>,5|C<3>}	H(C[6]C[6]2)	117.1725	0.077	2	117.3860	0.140	3	117.3860	0.140	3	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:S[6]-2:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6a]S[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(S[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6a]S[6])(H){1|C<4>,1|H<1>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(S[6]C[6]){1|C<4>,2|H<1>,5|C<3>}	H(C[6]C[6]2)	118.1810	0.000	1	118.1810	0.000	1	117.3672	0.791	4	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:S[6]-2:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6a]S[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(S[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6a]S[6])(H){5|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(S[6]C[6]){1|N<2>,1|S<1>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	118.0930	0.000	1	118.0930	0.000	1	117.3672	0.791	4	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:S[6]-2:	C[6]-3:	C[6](C[6]C[6a]S[6])(C[6]C[6]2)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(S[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6a]S[6])(C[6]C[6]2)(H){1|H<1>,5|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(S[6]C[6]){2|H<1>,5|C<3>}	H(C[6]C[6]2)	116.5975	0.011	2	116.5975	0.000	2	117.3672	0.791	4	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]N[5,6]O)(C[6]N[6]O)(H)	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(OMn)	H(C[6]C[6]2)	C[6](C[6]N[5,6]O)(C[6]N[6]O)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(OMn){1|C<3>,1|N<2>,1|N<3>,1|O<1>}	H(C[6]C[6]2)	137.8210	0.000	1	137.8210	0.000	1	137.8210	0.000	1	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[5]-3:C[6]-3:C[6]-2:	C[6]-3:	C[6](C[6]C[6]N[5])(C[6]C[6]O)(H)	C[6](N[5]C[5,6]C[5])(C[6]C[6]H)(C[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]C[6]O)(H){1|C<4>,3|C<3>}	C[6](N[5]C[5,6]C[5])(C[6]C[6]H)(C[6]C[6]){1|C<2>,1|C<4>,2|C<3>,2|H<1>,2|O<2>}	H(C[6]C[6]2)	118.9010	0.000	1	118.9010	0.000	1	118.9010	0.000	1	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[5a,6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]N[5a,6]S)(C[6]C[6]C)(H)	C[6](N[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(SC[6a])	H(C[6]C[6]2)	C[6](C[6]N[5a,6]S)(C[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](N[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(SC[6a]){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	118.1335	0.377	2	118.1335	0.142	2	118.1335	0.142	2	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[5a]-3:C[6]-3:C[6]-2:	C[6]-3:	C[6](C[6]N[5a]C[6])(C[6]C[6]H)(H)	C[6](N[5a]C[5a]N[5a])(C[6]C[6]H)(C[6]C[6])	H(C[6]C[6]2)	C[6](C[6]N[5a]C[6])(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|H<1>,1|N<2>}	C[6](N[5a]C[5a]N[5a])(C[6]C[6]H)(C[6]C[6]){1|H<1>,1|O<2>,3|C<3>}	H(C[6]C[6]2)	123.5050	0.000	1	123.5050	0.000	1	123.5050	0.000	1	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[5a]-3:C[6]-3:N[6]-2:	C[6]-3:	C[6](C[6]N[5a]N[6])(C[6]N[5]N[6])(H)	C[6](N[5a]C[5a]N[5a])(C[6]C[6]H)(N[6]C[6])	H(C[6]C[6]2)	C[6](C[6]N[5a]N[6])(C[6]N[5]N[6])(H){1|Fe<6>,1|N<2>,1|N<3>,3|C<3>}	C[6](N[5a]C[5a]N[5a])(C[6]C[6]H)(N[6]C[6]){1|C<4>,1|H<1>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	122.7455	0.265	2	122.6951	0.045	7	122.6951	0.045	7	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[5a]-3:C[6]-3:N[6]-2:	C[6]-3:	C[6](C[6]N[5a]N[6])(C[6]N[5]N[6])(H)	C[6](N[5a]C[5a]N[5a])(C[6]C[6]H)(N[6]C[6])	H(C[6]C[6]2)	C[6](C[6]N[5a]N[6])(C[6]N[5]N[6])(H){1|Fe<6>,1|N<2>,1|N<3>,3|C<3>}	C[6](N[5a]C[5a]N[5a])(C[6]C[6]H)(N[6]C[6]){2|C<3>,2|H<1>,2|N<3>}	H(C[6]C[6]2)	122.5990	0.159	4	122.6951	0.045	7	122.6951	0.045	7	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[5a]-3:C[6]-3:N[6]-2:	C[6]-3:	C[6](C[6]N[5a]N[6])(C[6]N[5]N[6])(H)	C[6](N[5a]C[5a]N[5a])(C[6]C[6]H)(N[6]C[6])	H(C[6]C[6]2)	C[6](C[6]N[5a]N[6])(C[6]N[5]N[6])(H){1|Pd<4>,1|N<2>,1|N<3>,3|C<3>}	C[6](N[5a]C[5a]N[5a])(C[6]C[6]H)(N[6]C[6]){2|C<3>,2|H<1>,2|N<3>}	H(C[6]C[6]2)	122.9790	0.000	1	122.6951	0.045	7	122.6951	0.045	7	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]N[6,6]O)(C[6]C[6]H)(H)	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(OH)	H(C[6]C[6]2)	C[6](C[6]N[6,6]O)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(OH){1|C<3>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	119.8810	0.775	2	119.8810	0.601	2	119.8810	0.601	2	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:Br-2:	C[6]-3:	C[6](C[6]N[6]Br)(C[6]C[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(BrCu)	H(C[6]C[6]2)	C[6](C[6]N[6]Br)(C[6]C[6]H)(H){1|Cu<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(BrCu){1|C<3>,2|H<1>}	H(C[6]C[6]2)	121.7080	0.000	1	121.7080	0.000	1	121.7080	0.000	1	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]C)(C[6]C[6]H)(CC)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|C<4>,2|C<3>}	C[6](N[6]C[6,6a]C)(C[6]C[6]H)(CC){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.4370	0.000	1	119.4370	0.000	1	120.1965	0.260	48	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(CN)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Cu<5>,2|C<3>}	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(CN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.8410	0.000	1	120.8410	0.000	1	120.1965	0.260	48	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]H)(C[6]C[6]H)(CN)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|H<1>,2|C<3>}	C[6](N[6]C[6,6a]H)(C[6]C[6]H)(CN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.2100	0.793	2	119.2100	0.629	2	120.1965	0.260	48	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Ni)(C[6]C[6]H)(CN)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Ni<5>,2|C<3>}	C[6](N[6]C[6,6a]Ni)(C[6]C[6]H)(CN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.8540	0.000	1	120.8540	0.000	1	120.1965	0.260	48	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Pt)(C[6]C[6]H)(CW)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Pt<4>,2|C<3>}	C[6](N[6]C[6,6a]Pt)(C[6]C[6]H)(CW){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.7800	0.000	1	120.7800	0.000	1	120.1965	0.260	48	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]B[3,3,5,4x6]C[6])(C[6]C[6]H)(CC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|B<5>,1|C<3>,1|H<1>}	C[6](N[6]B[3,3,5,4x6]C[6])(C[6]C[6]H)(CC){1|C<3>,3|B<6>,3|H<1>}	H(C[6]C[6]2)	119.6720	0.000	1	119.6720	0.000	1	120.1965	0.260	48	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]B[3,3,5,4x6]C[6])(C[6]C[6]H)(CN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|B<5>,1|C<3>,1|H<1>}	C[6](N[6]B[3,3,5,4x6]C[6])(C[6]C[6]H)(CN){1|C<3>,3|B<6>,3|H<1>}	H(C[6]C[6]2)	120.3735	0.190	2	120.3735	0.036	2	120.1965	0.260	48	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Au)(C[6]C[6]H)(CC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Au<3>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Au)(C[6]C[6]H)(CC){1|C<2>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0700	0.376	3	120.0700	0.141	3	120.1965	0.260	48	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CC){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4500	0.075	2	120.4836	0.004	5	120.1965	0.260	48	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CC){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5060	0.061	3	120.4836	0.004	5	120.1965	0.260	48	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	121.0970	0.000	1	121.0970	0.000	1	120.1965	0.260	48	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CN){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.7175	0.192	2	120.7175	0.037	2	120.1965	0.260	48	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CW)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CW){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.5420	0.000	1	119.5420	0.000	1	120.1965	0.260	48	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CC){1|C<2>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2401	0.297	10	120.1871	0.099	15	120.1965	0.260	48	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CC){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0810	0.355	5	120.1871	0.099	15	120.1965	0.260	48	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CC){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3710	0.629	6	120.3710	0.395	6	120.1965	0.260	48	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CW)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CW){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.5290	0.000	1	119.6610	0.032	3	120.1965	0.260	48	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CW)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pt<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CW){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.5910	0.000	1	119.6610	0.032	3	120.1965	0.260	48	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CW)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pt<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CW){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.8630	0.000	1	119.6610	0.032	3	120.1965	0.260	48	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(CC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(CC){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.5370	0.000	1	119.5370	0.000	1	120.1965	0.260	48	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<9>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CC){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.2530	0.000	1	120.2530	0.000	1	120.1965	0.260	48	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zr)(C[6]C[6]H)(CC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zr<13>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zr)(C[6]C[6]H)(CC){1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1730	0.000	1	120.1730	0.000	1	120.1965	0.260	48	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]N[6]N)(H)	C[6](N[6]C[5,6]Co)(C[6]C[6]H)(NC[5a])	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]N[6]N)(H){1|Co<4>,1|C<3>,1|C<4>}	C[6](N[6]C[5,6]Co)(C[6]C[6]H)(NC[5a]){1|C<3>,2|C<4>}	H(C[6]C[6]2)	118.9505	0.381	2	118.9505	0.145	2	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]N[6]N)(H)	C[6](N[6]C[5,6]Ir)(C[6]C[6]H)(NC[5a])	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]N[6]N)(H){1|Ir<8>,1|C<3>,1|C<4>}	C[6](N[6]C[5,6]Ir)(C[6]C[6]H)(NC[5a]){1|C<3>,2|C<4>}	H(C[6]C[6]2)	119.0810	0.000	1	119.0810	0.000	1	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6,6]Cu)(C[6]C[6]H)(NC[6])	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]N)(H){1|Cu<3>,2|C<3>}	C[6](N[6]C[6,6]Cu)(C[6]C[6]H)(NC[6]){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5710	0.000	1	120.5710	0.000	1	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6,6]Li)(C[6]C[6]H)(NC[5a])	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]N)(H){1|Li<4>,1|C<3>,1|C<4>}	C[6](N[6]C[6,6]Li)(C[6]C[6]H)(NC[5a]){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	118.5370	0.851	2	118.5370	0.725	2	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]N)(H)	C[6](N[6]C[6,6a]Co)(C[6]C[6]H)(NN)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]N)(H){1|Co<5>,2|C<3>}	C[6](N[6]C[6,6a]Co)(C[6]C[6]H)(NN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5310	0.000	1	120.5310	0.000	1	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]N)(H)	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(NC[6])	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]N)(H){1|Cu<3>,2|C<3>}	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(NC[6]){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.4640	0.000	1	120.4640	0.000	1	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]N)(H)	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(NN)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]N)(H){1|Cu<5>,2|C<3>}	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(NN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5390	0.000	1	120.5390	0.000	1	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]N)(H)	C[6](N[6]C[6,6a]Pt)(C[6]C[6]H)(NC[6])	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]N)(H){1|Pt<4>,2|C<3>}	C[6](N[6]C[6,6a]Pt)(C[6]C[6]H)(NC[6]){1|H<1>,2|C<3>}	H(C[6]C[6]2)	118.9120	0.407	4	118.9120	0.166	4	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]N)(H)	C[6](N[6]C[6,6a]Ru)(C[6]C[6]H)(NP)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]N)(H){1|Ru<6>,2|C<3>}	C[6](N[6]C[6,6a]Ru)(C[6]C[6]H)(NP){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.1930	0.000	1	120.1930	0.000	1	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]N)(H)	C[6](N[6]C[6]Cd)(C[6]C[6]H)(NC[5a])	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]N)(H){1|Cd<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cd)(C[6]C[6]H)(NC[5a]){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.1360	0.030	3	119.1360	0.001	3	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]N)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(NC)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]N)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(NC){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.6590	0.000	1	119.6590	0.000	1	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]N)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(NC[5a])	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]N)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(NC[5a]){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.1230	0.000	1	119.1230	0.000	1	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]N)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NC[5a])	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]N)(H){1|Fe<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NC[5a]){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.1775	0.033	2	119.1775	0.001	2	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(NC[6])	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]N)(H){1|Ir<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(NC[6]){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.9445	0.221	2	119.9445	0.049	2	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]N)(H)	C[6](N[6]C[6]Os)(C[6]C[6]H)(NC[5a])	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]N)(H){1|Os<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Os)(C[6]C[6]H)(NC[5a]){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	118.5540	0.267	2	118.5540	0.071	2	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]N)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(NP)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]N)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(NP){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.2130	0.000	1	119.2130	0.000	1	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NC[5a])	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]N)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NC[5a]){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	118.9110	0.055	2	118.9110	0.003	2	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]N)(H){1|Ru<9>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.4770	0.000	2	119.4770	0.000	2	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]N[6]N)(H)	C[6](N[6]C[6]Os)(C[6]C[6]H)(NN)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]N[6]N)(H){1|Os<9>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Os)(C[6]C[6]H)(NN){1|Cl<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.3250	0.000	1	121.3250	0.000	1	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Al)(C[6]C[6]H)(NC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Al<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Al)(C[6]C[6]H)(NC){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.7060	0.000	1	119.7060	0.000	1	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Al)(C[6]C[6]H)(NC[5a])	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Al<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Al)(C[6]C[6]H)(NC[5a]){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0572	0.072	4	120.0572	0.005	4	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Al)(C[6]C[6]H)(NSi)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Al<5>,1|C<4>,1|H<1>}	C[6](N[6]C[6]Al)(C[6]C[6]H)(NSi){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7750	0.000	1	120.7810	0.004	3	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Al)(C[6]C[6]H)(NSi)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Al<7>,1|C<4>,1|H<1>}	C[6](N[6]C[6]Al)(C[6]C[6]H)(NSi){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7840	0.093	2	120.7810	0.004	3	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(NC[6])	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Co<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(NC[6]){1|C<3>,2|H<1>}	H(C[6]C[6]2)	115.6490	0.000	1	118.7320	7.162	3	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(NC[6])	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Co<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(NC[6]){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2735	0.257	2	118.7320	7.162	3	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(NN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Co<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(NN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.7110	0.000	1	121.0046	0.076	5	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(NN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(NN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	121.0780	0.255	4	121.0046	0.076	5	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Cr)(C[6]C[6]H)(NN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cr<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cr)(C[6]C[6]H)(NN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3821	0.331	8	120.3821	0.109	8	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Cr)(C[6]C[6]H)(NP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cr<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cr)(C[6]C[6]H)(NP){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.8400	0.049	2	120.8730	0.004	3	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Cr)(C[6]C[6]H)(NP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cr<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cr)(C[6]C[6]H)(NP){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.9390	0.000	1	120.8730	0.004	3	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(NC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(NC){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.5648	1.787	5	120.5648	3.195	5	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(NC[6])	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(NC[6]){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3385	0.063	2	119.2245	2.591	4	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(NC[6])	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(NC[6]){1|C<3>,2|H<1>}	H(C[6]C[6]2)	118.1105	1.675	2	119.2245	2.591	4	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(NN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(NN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	121.2030	0.000	1	121.2030	0.000	1	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Fe<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NC){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.0710	0.000	1	120.5275	0.417	2	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NC){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.9840	0.000	1	120.5275	0.417	2	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NC[5a])	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Fe<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NC[5a]){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.9070	0.083	2	120.0048	0.232	6	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NC[5a])	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Fe<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NC[5a]){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.0538	0.613	4	120.0048	0.232	6	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NH){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0120	0.000	1	120.0120	0.000	1	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cl<1>,1|Fe<6>,1|C<3>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2845	0.032	2	120.4858	0.126	6	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NN){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.9400	0.047	2	120.4858	0.126	6	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2330	0.066	2	120.4858	0.126	6	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Fe<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NP){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4820	0.000	1	120.7407	0.072	3	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NP){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8700	0.211	2	120.7407	0.072	3	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(NC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ir<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(NC){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8850	0.000	1	119.9025	0.001	2	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(NC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ir<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(NC){1|Br<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9200	0.000	1	119.9025	0.001	2	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(NC[5a])	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ir<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(NC[5a]){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.8280	0.221	5	119.6877	0.044	11	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(NC[5a])	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ir<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(NC[5a]){1|C<3>,1|F<1>,1|H<1>}	H(C[6]C[6]2)	119.6093	0.086	4	119.6877	0.044	11	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(NC[5a])	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ir<8>,2|C<3>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(NC[5a]){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.4940	0.147	2	119.6877	0.044	11	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(NN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ir<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(NN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.8270	0.067	5	120.8270	0.004	5	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Li)(C[6]C[6]H)(NC[5a])	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Li<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Li)(C[6]C[6]H)(NC[5a]){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.3340	0.226	2	120.2140	0.069	3	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Li)(C[6]C[6]H)(NC[5a])	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Li<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Li)(C[6]C[6]H)(NC[5a]){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9740	0.000	1	120.2140	0.069	3	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(NC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(NC){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	114.1610	0.000	1	114.1610	0.000	1	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(NH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Mn<6>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(NH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9650	0.126	2	119.9650	0.016	2	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(NN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(NN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6000	0.223	5	120.6000	0.050	5	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Mo)(C[6]C[6]H)(NC[6a])	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Mo<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mo)(C[6]C[6]H)(NC[6a]){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4770	0.031	2	120.4770	0.001	2	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Mo)(C[6]C[6]H)(NN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Mo<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mo)(C[6]C[6]H)(NN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2986	0.376	10	120.3764	0.149	12	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Mo)(C[6]C[6]H)(NN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Mo<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mo)(C[6]C[6]H)(NN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.7655	0.047	2	120.3764	0.149	12	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NC){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	118.7300	0.000	1	119.5505	1.346	2	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NC){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3710	0.000	1	119.5505	1.346	2	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NC[5a])	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NC[5a]){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	119.8050	0.048	2	119.8050	0.002	2	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NC[6])	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NC[6]){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.6615	4.110	2	119.6615	16.895	2	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NN){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	121.3115	0.023	2	120.6419	2.192	20	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.9462	0.279	5	120.6419	2.192	20	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NN){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	121.4640	0.000	1	120.6419	2.192	20	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NN){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.7500	0.000	1	120.6419	2.192	20	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.8746	0.188	9	120.6419	2.192	20	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.9570	0.000	1	120.6419	2.192	20	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<6>,1|C<3>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NN){1|C<2>,2|H<1>}	H(C[6]C[6]2)	114.4430	0.000	1	120.6419	2.192	20	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NP){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0065	0.333	2	119.7300	0.099	5	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NP){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.5457	0.119	3	119.7300	0.099	5	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Os)(C[6]C[6]H)(NN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Br<1>,1|Os<9>,1|C<3>}	C[6](N[6]C[6]Os)(C[6]C[6]H)(NN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4277	0.126	3	120.4427	0.161	19	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Os)(C[6]C[6]H)(NN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cl<1>,1|Os<9>,1|C<3>}	C[6](N[6]C[6]Os)(C[6]C[6]H)(NN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.7915	0.241	2	120.4427	0.161	19	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Os)(C[6]C[6]H)(NN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Os<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Os)(C[6]C[6]H)(NN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4250	0.361	10	120.4427	0.161	19	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Os)(C[6]C[6]H)(NN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Os<9>,1|C<3>,1|F<1>}	C[6](N[6]C[6]Os)(C[6]C[6]H)(NN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6140	0.000	1	120.4427	0.161	19	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Os)(C[6]C[6]H)(NN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Os<9>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Os)(C[6]C[6]H)(NN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6770	0.057	2	120.4427	0.161	19	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Os)(C[6]C[6]H)(NN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Os<9>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Os)(C[6]C[6]H)(NN){1|Cl<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.3280	0.000	1	120.4427	0.161	19	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(NC[5a])	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(NC[5a]){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.2890	0.000	1	120.2890	0.000	1	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(NN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(NN){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.8880	0.000	1	120.5786	0.072	7	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(NN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(NN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4616	0.219	5	120.5786	0.072	7	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(NN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(NN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.8540	0.000	1	120.5786	0.072	7	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(NP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(NP){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6670	0.000	1	120.6670	0.000	1	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(NC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Pt<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(NC){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4090	0.000	1	120.4090	0.000	1	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(NC[5a])	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(NC[5a]){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.0844	0.558	9	119.0844	0.312	9	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(NC[5a])	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(NC[5a]){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.4970	0.000	1	119.4970	0.000	1	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(NN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Re<6>,1|C<2>,1|H<1>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(NN){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.4860	0.000	1	120.4281	2.619	17	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(NN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(NN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5044	1.774	14	120.4281	2.619	17	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(NN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Re<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(NN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3470	0.000	1	120.4281	2.619	17	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(NN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Re<8>,2|C<3>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(NN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3840	0.000	1	120.4281	2.619	17	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(NC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Rh<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(NC){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2953	0.195	3	120.2953	0.038	3	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(NN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Rh<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(NN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4840	0.275	3	120.6668	0.184	4	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(NN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Rh<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(NN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	121.2150	0.000	1	120.6668	0.184	4	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(NP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Rh<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(NP){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7680	0.000	1	119.7680	0.000	1	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<9>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NC){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2660	0.000	1	120.2660	0.000	1	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NC[5a])	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NC[5a]){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.7120	0.101	6	119.6248	0.149	37	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NC[5a])	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NC[5a]){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.5708	0.367	4	119.6248	0.149	37	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NC[5a])	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NC[5a]){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.4205	0.426	2	119.6248	0.149	37	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NC[5a])	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NC[5a]){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.3184	0.176	10	119.6248	0.149	37	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NC[5a])	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NC[5a]){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.6250	0.389	6	119.6248	0.149	37	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NC[5a])	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<7>,1|C<4>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NC[5a]){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.8460	0.116	2	119.6248	0.149	37	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NC[5a])	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<7>,1|C<4>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NC[5a]){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.6930	0.000	1	119.6248	0.149	37	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NC[5a])	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NC[5a]){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.4915	0.295	2	119.6248	0.149	37	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NC[5a])	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<8>,1|C<4>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NC[5a]){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.3650	0.158	2	119.6248	0.149	37	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NC[5a])	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<9>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NC[5a]){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.7580	0.000	1	119.6248	0.149	37	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NC[5a])	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<9>,1|C<4>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NC[5a]){1|C<3>,1|C<5>,1|H<1>}	H(C[6]C[6]2)	119.9330	0.000	1	119.6248	0.149	37	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NC[6])	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NC[6]){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8535	0.066	2	119.8535	0.004	2	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NC[6a])	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NC[6a]){1|C<3>,2|H<1>}	H(C[6]C[6]2)	112.1850	0.000	1	112.1850	0.000	1	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.7780	0.305	2	120.9057	0.055	4	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<9>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	121.0335	0.088	2	120.9057	0.055	4	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NP){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.4405	0.295	2	119.9945	0.442	4	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NP){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5485	0.103	2	119.9945	0.442	4	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Sn)(C[6]C[6]H)(NC[5a])	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Sn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Sn)(C[6]C[6]H)(NC[5a]){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	119.8030	0.105	2	119.8030	0.011	2	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Yb)(C[6]C[6]H)(NC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Yb<14>,1|C<4>,1|H<1>}	C[6](N[6]C[6]Yb)(C[6]C[6]H)(NC){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9370	0.000	1	119.9370	0.000	1	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(NC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(NC){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	121.1700	0.000	1	118.7684	3.703	5	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(NC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Zn<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(NC){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	118.1680	1.592	4	118.7684	3.703	5	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(NC[6])	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(NC[6]){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.2160	0.134	4	119.6830	0.537	6	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(NC[6])	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Zn<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(NC[6]){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.5360	0.000	1	119.6830	0.537	6	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(NC[6])	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Zn<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(NC[6]){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6980	0.000	1	119.6830	0.537	6	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(NN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(NN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6403	0.122	3	120.6322	0.010	4	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(NN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Zn<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(NN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6080	0.000	1	120.6322	0.010	4	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(NP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Zn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(NP){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1220	0.298	2	120.1220	0.089	2	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]N)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NC[5a])	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]N)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NC[5a]){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.8657	0.418	4	119.8657	0.175	4	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]N)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(NC[5a])	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]N)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(NC[5a]){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.1352	0.140	4	120.1352	0.020	4	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NC[5a])	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]N)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NC[5a]){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.2610	0.055	2	119.2610	0.003	2	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]N)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(NC[5a])	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]N)(H){1|Zn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(NC[5a]){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.2115	0.189	4	120.2115	0.036	4	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]N[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(NC)	H(C[6]C[6]2)	C[6](C[6]N[6]H)(C[6]N[6]N)(H){1|Pt<4>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(NC){1|H<1>,1|N<3>,1|O<1>}	H(C[6]C[6]2)	120.3910	0.000	1	120.3910	0.000	1	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]N[6]N)2(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NN)	H(C[6]C[6]2)	C[6](C[6]N[6]N)2(H){2|Fe<6>,1|C<3>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NN){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	121.0275	0.233	2	121.0275	0.054	2	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]N[6]N)2(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(NN)	H(C[6]C[6]2)	C[6](C[6]N[6]N)2(H){2|Zn<6>,1|C<3>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(NN){1|C<3>,2|N<3>}	H(C[6]C[6]2)	120.8500	0.000	1	120.8500	0.000	1	120.0158	1.237	311	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]N[6]O)(H)	C[6](N[6]C[5,6]Cu)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]N[6]O)(H){1|Cu<4>,1|C<3>,1|C<4>}	C[6](N[6]C[5,6]Cu)(C[6]C[6]H)(OC){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.2580	0.000	1	121.2580	0.000	1	120.6601	0.504	249	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]O)(H)	C[6](N[6]C[6,6]Cu)(C[6]C[6]H)(OP)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]O)(H){1|Cu<4>,2|C<3>}	C[6](N[6]C[6,6]Cu)(C[6]C[6]H)(OP){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.9525	0.470	2	120.9525	0.221	2	120.6601	0.504	249	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]O)(H)	C[6](N[6]C[6,6]Pt)(C[6]C[6]H)(OP)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]O)(H){1|Pt<4>,2|C<3>}	C[6](N[6]C[6,6]Pt)(C[6]C[6]H)(OP){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8430	0.000	1	120.8430	0.000	1	120.6601	0.504	249	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]O)(H)	C[6](N[6]C[6,6a]Cd)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]O)(H){1|Cd<4>,2|C<3>}	C[6](N[6]C[6,6a]Cd)(C[6]C[6]H)(OC){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.7165	0.322	2	120.7165	0.104	2	120.6601	0.504	249	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]O)(H)	C[6](N[6]C[6,6a]Co)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]O)(H){1|Co<4>,2|C<3>}	C[6](N[6]C[6,6a]Co)(C[6]C[6]H)(OC){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.4490	0.683	2	120.4490	0.467	2	120.6601	0.504	249	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]O)(H)	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]O)(H){1|Cu<5>,2|C<3>}	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(OC){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.7055	0.488	4	120.7055	0.238	4	120.6601	0.504	249	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]O)(H)	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(OCu)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]O)(H){1|Cu<3>,2|C<3>}	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(OCu){1|H<1>,2|C<3>}	H(C[6]C[6]2)	117.8945	2.399	2	117.8945	5.756	2	120.6601	0.504	249	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]O)(H)	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(OH)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]O)(H){1|Cu<4>,2|C<3>}	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(OH){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.2287	0.238	3	119.2287	0.057	3	120.6601	0.504	249	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]O)(H)	C[6](N[6]C[6,6a]Mn)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]O)(H){1|Mn<6>,2|C<3>}	C[6](N[6]C[6,6a]Mn)(C[6]C[6]H)(OC){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.8340	0.000	1	120.8340	0.000	1	120.6601	0.504	249	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]O)(H)	C[6](N[6]C[6,6a]Ni)(C[6]C[6]H)(OH)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]O)(H){1|Ni<6>,2|C<3>}	C[6](N[6]C[6,6a]Ni)(C[6]C[6]H)(OH){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3215	0.808	2	120.3215	0.653	2	120.6601	0.504	249	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]O)(H)	C[6](N[6]C[6,6a]Ru)(C[6]C[6]H)(OH)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]O)(H){1|Ru<9>,2|C<3>}	C[6](N[6]C[6,6a]Ru)(C[6]C[6]H)(OH){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.6060	0.000	1	119.6060	0.000	1	120.6601	0.504	249	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]O)(H)	C[6](N[6]C[6,6a]Zn)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]O)(H){1|Zn<4>,2|C<3>}	C[6](N[6]C[6,6a]Zn)(C[6]C[6]H)(OC){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5418	0.118	5	120.5418	0.014	5	120.6601	0.504	249	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]O)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(OP[6])	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]O)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(OP[6]){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.4415	0.071	2	120.4415	0.005	2	120.6601	0.504	249	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]O)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(OSi)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]O)(H){1|Ir<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(OSi){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.8640	0.184	4	119.7420	0.052	9	120.6601	0.504	249	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]O)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(OSi)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]O)(H){1|Ir<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(OSi){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.6444	0.228	5	119.7420	0.052	9	120.6601	0.504	249	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]O)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(OC[6a])	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]O)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(OC[6a]){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.0375	0.728	2	120.0375	0.529	2	120.6601	0.504	249	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]O)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]O)(H){1|Rh<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(OH){1|C<3>,2|C<4>}	H(C[6]C[6]2)	119.7193	0.359	3	119.7193	0.129	3	120.6601	0.504	249	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](N[6]C[6]Al)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Al<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Al)(C[6]C[6]H)(OC){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	121.2720	0.000	1	121.2720	0.000	1	120.6601	0.504	249	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](N[6]C[6]Cd)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Cd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cd)(C[6]C[6]H)(OC){1|H<1>,2|C<3>}	H(C[6]C[6]2)	121.2090	0.000	1	120.9312	0.027	6	120.6601	0.504	249	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](N[6]C[6]Cd)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Cd<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cd)(C[6]C[6]H)(OC){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.8897	0.113	3	120.9312	0.027	6	120.6601	0.504	249	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](N[6]C[6]Cd)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Cd<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cd)(C[6]C[6]H)(OC){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.8545	0.117	2	120.9312	0.027	6	120.6601	0.504	249	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(OCo)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(OCo){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.3510	0.000	1	119.3510	0.000	1	120.6601	0.504	249	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(OP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Co<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(OP){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	121.0948	0.247	4	121.0948	0.061	4	120.6601	0.504	249	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(OSi)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(OSi){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2710	0.000	1	120.1057	0.081	3	120.6601	0.504	249	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(OSi)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Co<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(OSi){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0230	0.348	2	120.1057	0.081	3	120.6601	0.504	249	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(OC){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.5096	1.239	7	120.7490	0.681	16	120.6601	0.504	249	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(OC){1|C<3>,2|H<1>}	H(C[6]C[6]2)	121.0115	0.303	2	120.7490	0.681	16	120.6601	0.504	249	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(OC){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.8280	0.000	1	120.7490	0.681	16	120.6601	0.504	249	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(OC){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.9075	0.161	4	120.7490	0.681	16	120.6601	0.504	249	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Cu<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(OC){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.9680	0.307	2	120.7490	0.681	16	120.6601	0.504	249	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(OC[6])	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(OC[6]){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.8835	0.342	2	120.8835	0.117	2	120.6601	0.504	249	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(OC[6a])	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(OC[6a]){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.9570	0.000	1	120.9570	0.000	1	120.6601	0.504	249	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(OH){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.9837	0.327	3	120.8031	0.092	8	120.6601	0.504	249	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(OH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.6948	0.263	5	120.8031	0.092	8	120.6601	0.504	249	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(OP[6])	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(OP[6]){1|C<3>,2|H<1>}	H(C[6]C[6]2)	121.1915	0.139	2	121.1915	0.019	2	120.6601	0.504	249	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(OC){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.8147	0.270	6	120.8269	0.062	7	120.6601	0.504	249	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(OC){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.9000	0.000	1	120.8269	0.062	7	120.6601	0.504	249	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(OP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Fe<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(OP){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.9600	0.679	2	121.3671	0.193	8	120.6601	0.504	249	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(OP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(OP){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	121.5028	0.300	6	121.3671	0.193	8	120.6601	0.504	249	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](N[6]C[6]Hg)(C[6]C[6]H)(OP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Hg<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Hg)(C[6]C[6]H)(OP){1|C<3>,2|H<1>}	H(C[6]C[6]2)	121.3570	0.078	2	121.3570	0.006	2	120.6601	0.504	249	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Ir<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(OC){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3050	0.000	1	120.5210	0.041	3	120.6601	0.504	249	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Ir<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(OC){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.6290	0.113	2	120.5210	0.041	3	120.6601	0.504	249	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Ir<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(OH){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6670	0.614	2	120.4871	0.144	9	120.6601	0.504	249	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Ir<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(OH){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.4357	0.339	7	120.4871	0.144	9	120.6601	0.504	249	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(OIr)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Ir<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(OIr){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8630	0.460	2	119.8630	0.211	2	120.6601	0.504	249	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(OP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Ir<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(OP){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	121.1101	0.401	8	121.1101	0.161	8	120.6601	0.504	249	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(OSi)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Ir<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(OSi){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.7535	0.322	2	120.7535	0.104	2	120.6601	0.504	249	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(OC){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.8325	0.081	2	120.8023	0.009	7	120.6601	0.504	249	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(OC){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.7902	0.107	5	120.8023	0.009	7	120.6601	0.504	249	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(OH){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.6456	0.105	7	120.6456	0.011	7	120.6601	0.504	249	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](N[6]C[6]Mo)(C[6]C[6]H)(OP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Mo<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mo)(C[6]C[6]H)(OP){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	121.3240	0.282	4	121.3240	0.080	4	120.6601	0.504	249	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](N[6]C[6]Mo)(C[6]C[6]H)(OSi)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Mo<9>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mo)(C[6]C[6]H)(OSi){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5590	0.000	1	120.5590	0.000	1	120.6601	0.504	249	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(OH){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.4730	0.323	4	120.4730	0.105	4	120.6601	0.504	249	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(OP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Ni<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(OP){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	121.2800	0.041	2	121.2893	0.029	6	120.6601	0.504	249	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(OP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Ni<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(OP){1|H<1>,2|C<3>}	H(C[6]C[6]2)	121.2940	0.217	4	121.2893	0.029	6	120.6601	0.504	249	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](N[6]C[6]Os)(C[6]C[6]H)(OB)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Os<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Os)(C[6]C[6]H)(OB){1|C<3>,2|H<1>}	H(C[6]C[6]2)	121.2770	0.000	1	121.2770	0.000	1	120.6601	0.504	249	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(OC){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3340	0.177	4	120.3340	0.031	4	120.6601	0.504	249	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(OC[6a])	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(OC[6a]){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0145	0.576	2	120.0145	0.332	2	120.6601	0.504	249	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(OH){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.4700	0.362	2	120.4700	0.131	2	120.6601	0.504	249	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(OP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(OP){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	121.1912	0.165	4	121.1912	0.027	4	120.6601	0.504	249	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(OPd)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(OPd){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.6825	0.158	2	119.6825	0.025	2	120.6601	0.504	249	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(OC){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.9450	0.000	1	120.7560	0.065	3	120.6601	0.504	249	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(OC){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.6615	0.278	2	120.7560	0.065	3	120.6601	0.504	249	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(OC[6a])	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(OC[6a]){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3205	0.373	2	120.3205	0.139	2	120.6601	0.504	249	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(OP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(OP){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	121.0750	0.263	4	121.0750	0.069	4	120.6601	0.504	249	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(OP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(OP){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	121.1065	0.191	4	121.1065	0.037	4	120.6601	0.504	249	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(ORe)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(ORe){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.4570	0.000	1	119.4570	0.000	1	120.6601	0.504	249	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Rh<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(OH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3810	0.000	1	120.3810	0.000	1	120.6601	0.504	249	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(OP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Rh<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(OP){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	121.0935	0.379	14	121.0935	0.143	14	120.6601	0.504	249	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(ORh)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Rh<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(ORh){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.9523	0.586	4	119.2308	2.860	5	120.6601	0.504	249	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(ORh)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Rh<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(ORh){1|C<3>,1|H<1>,1|S<3>}	H(C[6]C[6]2)	116.3450	0.000	1	119.2308	2.860	5	120.6601	0.504	249	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(OC){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.7997	0.284	3	120.7997	0.081	3	120.6601	0.504	249	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(OC[6a])	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Ru<9>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(OC[6a]){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.8720	0.161	2	120.8720	0.026	2	120.6601	0.504	249	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Ru<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(OH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.7555	0.090	2	120.4241	0.124	13	120.6601	0.504	249	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(OH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.0487	0.358	4	120.4241	0.124	13	120.6601	0.504	249	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(OH){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.5985	0.063	2	120.4241	0.124	13	120.6601	0.504	249	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(OH){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3825	0.091	2	120.4241	0.124	13	120.6601	0.504	249	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Ru<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(OH){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.9090	0.000	1	120.4241	0.124	13	120.6601	0.504	249	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Ru<9>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(OH){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.4680	0.038	2	120.4241	0.124	13	120.6601	0.504	249	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(OP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(OP){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	121.1134	0.241	8	121.1134	0.058	8	120.6601	0.504	249	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](N[6]C[6]Sn)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Sn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Sn)(C[6]C[6]H)(OC){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.1195	1.356	2	120.1195	1.837	2	120.6601	0.504	249	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Zn<3>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(OC){1|H<1>,2|C<3>}	H(C[6]C[6]2)	121.1230	0.000	1	120.8887	0.124	15	120.6601	0.504	249	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(OC){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.8720	0.359	14	120.8887	0.124	15	120.6601	0.504	249	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]N[6]C)(C[6]N[6]O)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]N[6]C)(C[6]N[6]O)(H){1|Mn<4>,1|Mn<9>,1|C<4>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(OC){1|Mn<9>,1|C<4>,1|N<3>,1|N<4>}	H(C[6]C[6]2)	121.8280	0.000	1	121.8280	0.000	1	120.6601	0.504	249	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(SC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Co<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(SC){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2050	0.000	1	120.2050	0.000	1	120.1698	3.226	90	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(SC[6])	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(SC[6]){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.7085	0.159	2	120.7085	0.025	2	120.1698	3.226	90	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(SCo)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(SCo){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9277	0.275	3	119.9277	0.076	3	120.1698	3.226	90	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](N[6]C[6]Cr)(C[6]C[6]H)(SPt)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Cr<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cr)(C[6]C[6]H)(SPt){1|C<3>,2|H<1>}	H(C[6]C[6]2)	118.7970	0.000	1	118.7970	0.000	1	120.1698	3.226	90	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](N[6]C[6]Mo)(C[6]C[6]H)(SMo)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Mo<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mo)(C[6]C[6]H)(SMo){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.9213	0.109	4	120.9113	0.026	7	120.1698	3.226	90	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](N[6]C[6]Mo)(C[6]C[6]H)(SMo)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Mo<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mo)(C[6]C[6]H)(SMo){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6220	0.000	1	120.9113	0.026	7	120.1698	3.226	90	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](N[6]C[6]Mo)(C[6]C[6]H)(SMo)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Mo<9>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mo)(C[6]C[6]H)(SMo){1|C<3>,2|H<1>}	H(C[6]C[6]2)	121.0360	0.076	2	120.9113	0.026	7	120.1698	3.226	90	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(SNi)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Cl<1>,1|Ni<6>,1|C<3>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(SNi){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9275	0.164	6	120.2050	0.120	12	120.1698	3.226	90	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(SNi)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Ni<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(SNi){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6920	0.000	1	120.2050	0.120	12	120.1698	3.226	90	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(SNi)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(SNi){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.4297	0.300	3	120.2050	0.120	12	120.1698	3.226	90	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(SNi)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(SNi){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4570	0.170	2	120.2050	0.120	12	120.1698	3.226	90	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(SC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(SC){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4830	0.000	1	120.4830	0.000	1	120.1698	3.226	90	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(SC[5])	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(SC[5]){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3720	0.000	1	120.3720	0.000	1	120.1698	3.226	90	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(SPd)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(SPd){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.1360	0.427	2	119.8690	0.113	7	120.1698	3.226	90	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(SPd)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(SPd){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7622	0.272	5	119.8690	0.113	7	120.1698	3.226	90	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(SPt)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(SPt){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8545	0.016	2	119.8545	0.000	2	120.1698	3.226	90	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(SC[6])	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Rh<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(SC[6]){1|C<3>,1|H<1>,1|S<2>}	H(C[6]C[6]2)	119.5246	2.374	14	119.9574	10.873	26	120.1698	3.226	90	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(SC[6])	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Rh<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(SC[6]){1|C<3>,1|H<1>,1|S<2>}	H(C[6]C[6]2)	120.7412	3.789	6	119.9574	10.873	26	120.1698	3.226	90	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(SC[6])	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Rh<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(SC[6]){1|C<3>,1|H<1>,1|S<2>}	H(C[6]C[6]2)	120.1837	4.902	6	119.9574	10.873	26	120.1698	3.226	90	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(SC[6])	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(SC[6]){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4950	0.123	2	120.4950	0.015	2	120.1698	3.226	90	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(SP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(SP){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1443	0.323	3	120.1443	0.104	3	120.1698	3.226	90	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](N[6]C[6]Si)(C[6]C[6]H)(SW)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Si<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Si)(C[6]C[6]H)(SW){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9680	0.000	1	119.9680	0.000	1	120.1698	3.226	90	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](N[6]C[6]Sn)(C[6]C[6]H)(SPd)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Sn<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Sn)(C[6]C[6]H)(SPd){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1177	0.261	7	120.1114	0.052	11	120.1698	3.226	90	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](N[6]C[6]Sn)(C[6]C[6]H)(SPd)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Sn<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Sn)(C[6]C[6]H)(SPd){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1003	0.190	4	120.1114	0.052	11	120.1698	3.226	90	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](N[6]C[6]Sn)(C[6]C[6]H)(SPt)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Sn<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Sn)(C[6]C[6]H)(SPt){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2795	0.132	2	120.2795	0.017	2	120.1698	3.226	90	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](N[6]C[6]Sn)(C[6]C[6]H)(SSn)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Sn<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Sn)(C[6]C[6]H)(SSn){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6800	0.222	2	120.8874	0.072	5	120.1698	3.226	90	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](N[6]C[6]Sn)(C[6]C[6]H)(SSn)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Sn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Sn)(C[6]C[6]H)(SSn){1|C<3>,2|H<1>}	H(C[6]C[6]2)	121.0257	0.218	3	120.8874	0.072	5	120.1698	3.226	90	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(SC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(SC){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8920	0.000	1	119.8920	0.000	1	120.1698	3.226	90	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(SZn)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Zn<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(SZn){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4690	0.000	1	120.4690	0.000	1	120.1698	3.226	90	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6a]O[6])(C[6]N[6]S)(H)	C[6](N[6]C[6a]B[6])(C[6]C[6]H)(SC)	H(C[6]C[6]2)	C[6](C[6]C[6a]O[6])(C[6]N[6]S)(H){1|B<4>,3|C<3>}	C[6](N[6]C[6a]B[6])(C[6]C[6]H)(SC){1|O<2>,2|F<1>,3|C<3>}	H(C[6]C[6]2)	119.7320	0.000	1	119.7320	0.000	1	120.1698	3.226	90	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:Se-2:	C[6]-3:	C[6](C[6]N[6]Se)(C[6]C[6]H)(H)	C[6](N[6]C[6]Mo)(C[6]C[6]H)(SeMo)	H(C[6]C[6]2)	C[6](C[6]N[6]Se)(C[6]C[6]H)(H){1|Mo<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mo)(C[6]C[6]H)(SeMo){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.7645	0.336	2	120.7645	0.113	2	120.5711	0.136	7	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:Se-2:	C[6]-3:	C[6](C[6]N[6]Se)(C[6]C[6]H)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(SePd)	H(C[6]C[6]2)	C[6](C[6]N[6]Se)(C[6]C[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(SePd){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0650	0.000	1	120.0650	0.000	1	120.5711	0.136	7	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:Se-2:	C[6]-3:	C[6](C[6]N[6]Se)(C[6]C[6]H)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(SePt)	H(C[6]C[6]2)	C[6](C[6]N[6]Se)(C[6]C[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(SePt){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6370	0.000	1	120.6370	0.000	1	120.5711	0.136	7	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:Se-2:	C[6]-3:	C[6](C[6]N[6]Se)(C[6]C[6]H)(H)	C[6](N[6]C[6]Sn)(C[6]C[6]H)(SeC[6])	H(C[6]C[6]2)	C[6](C[6]N[6]Se)(C[6]C[6]H)(H){1|Sn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Sn)(C[6]C[6]H)(SeC[6]){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3445	0.101	2	120.3445	0.010	2	120.5711	0.136	7	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:Se-2:	C[6]-3:	C[6](C[6]N[6]Se)(C[6]C[6]H)(H)	C[6](N[6]C[6]Sn)(C[6]C[6]H)(SeSn)	H(C[6]C[6]2)	C[6](C[6]N[6]Se)(C[6]C[6]H)(H){1|Sn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Sn)(C[6]C[6]H)(SeSn){1|C<3>,2|H<1>}	H(C[6]C[6]2)	121.0780	0.000	1	121.0780	0.000	1	120.5711	0.136	7	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	P-3:C[6]-3:C[6]-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](PC[6a]C[6])(C[6]C[6]H)(C[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<2>}	C[6](PC[6a]C[6])(C[6]C[6]H)(C[6]C[6]){1|C<2>,1|H<1>}	H(C[6]C[6]2)	120.2740	0.000	1	120.2740	0.000	1	120.2740	0.000	1	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	P[6]-3:C[6]-3:C[6]-2:	C[6]-3:	C[6](C[6]C[6]P[6])(C[6]C[6]H)(H)	C[6](P[6]C[6,6a]2)(C[6]C[6]H)(C[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6]P[6])(C[6]C[6]H)(H){1|H<1>,3|C<3>}	C[6](P[6]C[6,6a]2)(C[6]C[6]H)(C[6]C[6]){2|H<1>,5|C<3>}	H(C[6]C[6]2)	120.6460	0.000	1	120.6460	0.000	1	120.6460	0.000	1	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	P[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]P[6]O)(H)	C[6](P[6]C[6]Cu)(C[6]C[6]H)(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]P[6]O)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](P[6]C[6]Cu)(C[6]C[6]H)(OH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	118.3995	0.179	2	118.1985	0.072	4	118.1985	0.072	4	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	P[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]P[6]O)(H)	C[6](P[6]C[6]Cu)(C[6]C[6]H)(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]P[6]O)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](P[6]C[6]Cu)(C[6]C[6]H)(OH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	117.8900	0.000	1	118.1985	0.072	4	118.1985	0.072	4	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:C[6]-3:H-1:	P[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]P[6]O)(H)	C[6](P[6]C[6]Cu)(C[6]C[6]H)(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]P[6]O)(H){1|Cu<4>,2|C<3>}	C[6](P[6]C[6]Cu)(C[6]C[6]H)(OH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	118.1050	0.000	1	118.1985	0.072	4	118.1985	0.072	4	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:N[6]-3:H-1:	C[5]-3:C[6]-3:N[6]-2:	C[6]-3:	C[6](C[6]C[5]N[6])(N[6]C[6]Mn)(H)	C[6](C[5]N[5]2)(C[6]N[6]H)(N[6]C[6])	H(C[6]C[6]N[6])	C[6](C[6]C[5]N[6])(N[6]C[6]Mn)(H){1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[5]N[5]2)(C[6]N[6]H)(N[6]C[6]){1|Mn<6>,1|H<1>,2|C<3>,2|N<3>}	H(C[6]C[6]N[6])	118.9950	0.000	1	118.9950	0.000	1	118.9950	0.000	1	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:N[6]-3:H-1:	C[5a]-3:C[6]-3:N[6]-2:	C[6]-3:	C[6](C[6]C[5a]N[6])(N[6]C[6]Co)(H)	C[6](C[5a]N[5a]O[5a])(C[6]N[6]H)(N[6]C[6])	H(C[6]C[6]N[6])	C[6](C[6]C[5a]N[6])(N[6]C[6]Co)(H){1|C<3>,1|H<1>,1|N<2>,1|O<2>}	C[6](C[5a]N[5a]O[5a])(C[6]N[6]H)(N[6]C[6]){1|Co<6>,1|H<1>,1|N<2>,2|C<3>}	H(C[6]C[6]N[6])	119.3050	0.000	1	119.3050	0.000	1	119.3050	0.000	1	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CC)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CC){1|C<2>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	119.6317	0.424	8	120.0122	1.482	10	120.4125	2.347	22	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CC)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CC){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	121.5340	2.507	2	120.0122	1.482	10	120.4125	2.347	22	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CN)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CN){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	120.0565	0.138	6	120.0565	0.019	6	120.4125	2.347	22	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]C)(H)	C[6](C[6]N[6]H)(C[6]N[6]O)(CC)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]C)(H){1|C<4>,1|H<1>,1|N<3>,1|O<1>}	C[6](C[6]N[6]H)(C[6]N[6]O)(CC){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	121.7030	2.979	3	121.7030	8.875	3	120.4125	2.347	22	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CC)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CC){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	119.9050	0.000	1	119.9050	0.000	1	120.4125	2.347	22	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CN)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CN){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	121.8005	2.575	2	121.8005	6.628	2	120.4125	2.347	22	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]N)(N[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NC)	H(C[6]C[6]N[6])	C[6](C[6]C[6]N)(N[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NC){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	119.5740	0.030	2	119.5740	0.001	2	121.1563	6.128	6	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]N)(N[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NH)	H(C[6]C[6]N[6])	C[6](C[6]C[6]N)(N[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	119.8710	0.000	1	119.8710	0.000	1	121.1563	6.128	6	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]N)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NH)	H(C[6]C[6]N[6])	C[6](C[6]C[6]N)(N[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NH){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	125.4090	0.000	1	122.4750	17.217	2	121.1563	6.128	6	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]N)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NH)	H(C[6]C[6]N[6])	C[6](C[6]C[6]N)(N[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NH){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	119.5410	0.000	1	122.4750	17.217	2	121.1563	6.128	6	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]N)(N[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(NH)	H(C[6]C[6]N[6])	C[6](C[6]C[6]N)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(NH){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	122.9690	0.000	1	122.9690	0.000	1	121.1563	6.128	6	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(N[6]C[6]C)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(OCu)	H(C[6]C[6]N[6])	C[6](C[6]C[6]O)(N[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(OCu){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	118.9190	0.023	2	118.9190	0.001	2	120.3199	1.145	40	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(N[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(OH)	H(C[6]C[6]N[6])	C[6](C[6]C[6]O)(N[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(OH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	120.0846	0.411	11	120.0846	0.169	11	120.3199	1.145	40	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(OC[6a])	H(C[6]C[6]N[6])	C[6](C[6]C[6]O)(N[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(OC[6a]){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	120.5985	0.151	2	120.5985	0.023	2	120.3199	1.145	40	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(OH)	H(C[6]C[6]N[6])	C[6](C[6]C[6]O)(N[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(OH){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	120.1522	0.440	18	120.4586	1.062	20	120.3199	1.145	40	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(OH)	H(C[6]C[6]N[6])	C[6](C[6]C[6]O)(N[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(OH){1|H<1>,2|C<3>}	H(C[6]C[6]N[6])	123.2160	0.075	2	120.4586	1.062	20	120.3199	1.145	40	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(N[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(OC[6a])	H(C[6]C[6]N[6])	C[6](C[6]C[6]O)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]N)(C[6]N[6]H)(OC[6a]){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	124.3780	0.000	1	124.3780	0.000	1	120.3199	1.145	40	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(N[6]C[6]H)(H)	C[6](C[6]C[6]O)(C[6]N[6]H)(OC)	H(C[6]C[6]N[6])	C[6](C[6]C[6]O)(N[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<2>}	C[6](C[6]C[6]O)(C[6]N[6]H)(OC){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	119.7210	0.000	1	119.7210	0.000	1	120.3199	1.145	40	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(N[6]C[6]H)(H)	C[6](C[6]N[6]H)(C[6]N[6]O)(OC)	H(C[6]C[6]N[6])	C[6](C[6]C[6]O)(N[6]C[6]H)(H){1|N<3>,1|O<1>,1|S<1>}	C[6](C[6]N[6]H)(C[6]N[6]O)(OC){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	119.6730	0.000	1	119.6730	0.000	1	120.3199	1.145	40	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(N[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(OH)	H(C[6]C[6]N[6])	C[6](C[6]C[6]O)(N[6]C[6]O)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(OH){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]N[6])	120.2170	0.000	1	120.2170	0.000	1	120.3199	1.145	40	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(N[6]C[6]O)(H)	C[6](C[6]C[6]O)(C[6]N[6]H)(OC)	H(C[6]C[6]N[6])	C[6](C[6]C[6]O)(N[6]C[6]O)(H){1|C<3>,1|C<4>,1|O<2>}	C[6](C[6]C[6]O)(C[6]N[6]H)(OC){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]N[6])	119.6670	0.000	1	119.6670	0.000	1	120.3199	1.145	40	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:N[6]-3:H-1:	C[6a]-3:C[6]-3:N[6]-2:	C[6]-3:	C[6](C[6]C[6a]N[6])(N[6]C[6]Ir)(H)	C[6](C[6a]C[6a]N[6a])(C[6]N[6]H)(N[6]C[6])	H(C[6]C[6]N[6])	C[6](C[6]C[6a]N[6])(N[6]C[6]Ir)(H){1|N<2>,3|C<3>}	C[6](C[6a]C[6a]N[6a])(C[6]N[6]H)(N[6]C[6]){1|Ir<6>,2|H<1>,3|C<3>}	H(C[6]C[6]N[6])	119.6010	0.000	1	119.6010	0.000	1	119.8102	0.082	6	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:N[6]-3:H-1:	C[6a]-3:C[6]-3:N[6]-2:	C[6]-3:	C[6](C[6]C[6a]N[6])(N[6]C[6]O)(H)	C[6](C[6a]C[6a]2)(C[6]N[6]H)(N[6]N[6])	H(C[6]C[6]N[6])	C[6](C[6]C[6a]N[6])(N[6]C[6]O)(H){1|N<3>,2|C<3>,2|C<4>}	C[6](C[6a]C[6a]2)(C[6]N[6]H)(N[6]N[6]){1|C<4>,1|O<1>,2|C<3>,3|H<1>}	H(C[6]C[6]N[6])	119.7548	0.238	4	119.7548	0.056	4	119.8102	0.082	6	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:N[6]-3:H-1:	C[6a]-3:C[6]-3:N[6]-2:	C[6]-3:	C[6](C[6]C[6a]N[6])(N[6]C[6]S)(H)	C[6](C[6a]C[6a]2)(C[6]N[6]H)(N[6]C[6])	H(C[6]C[6]N[6])	C[6](C[6]C[6a]N[6])(N[6]C[6]S)(H){1|H<1>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]N[6]H)(N[6]C[6]){1|C<4>,1|S<4>,2|H<1>,3|C<3>}	H(C[6]C[6]N[6])	120.2410	0.000	1	120.2410	0.000	1	119.8102	0.082	6	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:N[6]-3:H-1:	C[6a]-3:C[6]-3:O[6]-2:	C[6]-3:	C[6](C[6]C[6a]O[6])(N[6]C[6]S)(H)	C[6](C[6a]C[6a]2)(C[6]N[6]H)(O[6]C[6])	H(C[6]C[6]N[6])	C[6](C[6]C[6a]O[6])(N[6]C[6]S)(H){1|C<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]N[6]H)(O[6]C[6]){1|C<4>,1|S<4>,2|C<3>,4|H<1>}	H(C[6]C[6]N[6])	118.5350	0.000	1	118.8750	0.059	7	118.8750	0.059	7	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:N[6]-3:H-1:	C[6a]-3:C[6]-3:O[6]-2:	C[6]-3:	C[6](C[6]C[6a]O[6])(N[6]C[6]S)(H)	C[6](C[6a]C[6a]2)(C[6]N[6]H)(O[6]C[6])	H(C[6]C[6]N[6])	C[6](C[6]C[6a]O[6])(N[6]C[6]S)(H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6a]C[6a]2)(C[6]N[6]H)(O[6]C[6]){1|C<4>,1|F<1>,1|S<4>,2|H<1>,3|C<3>}	H(C[6]C[6]N[6])	119.0380	0.231	2	118.8750	0.059	7	118.8750	0.059	7	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:N[6]-3:H-1:	C[6a]-3:C[6]-3:O[6]-2:	C[6]-3:	C[6](C[6]C[6a]O[6])(N[6]C[6]S)(H)	C[6](C[6a]C[6a]2)(C[6]N[6]H)(O[6]C[6])	H(C[6]C[6]N[6])	C[6](C[6]C[6a]O[6])(N[6]C[6]S)(H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6a]C[6a]2)(C[6]N[6]H)(O[6]C[6]){1|C<4>,1|N<3>,1|S<4>,2|H<1>,3|C<3>}	H(C[6]C[6]N[6])	119.0205	0.151	2	118.8750	0.059	7	118.8750	0.059	7	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:N[6]-3:H-1:	C[6a]-3:C[6]-3:O[6]-2:	C[6]-3:	C[6](C[6]C[6a]O[6])(N[6]C[6]S)(H)	C[6](C[6a]C[6a]2)(C[6]N[6]H)(O[6]C[6])	H(C[6]C[6]N[6])	C[6](C[6]C[6a]O[6])(N[6]C[6]S)(H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6a]C[6a]2)(C[6]N[6]H)(O[6]C[6]){1|S<4>,2|C<3>,2|C<4>,3|H<1>}	H(C[6]C[6]N[6])	118.7365	0.162	2	118.8750	0.059	7	118.8750	0.059	7	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	C[6]-3:N[6]-3:H-1:	N[5a]-3:C[6]-3:N[6]-2:	C[6]-3:	C[6](C[6]N[5a]N[6])(N[6]C[6]Cu)(H)	C[6](N[5a]C[5a,6a]2)(C[6]N[6]H)(N[6]C[6])	H(C[6]C[6]N[6])	C[6](C[6]N[5a]N[6])(N[6]C[6]Cu)(H){1|H<1>,3|C<3>}	C[6](N[5a]C[5a,6a]2)(C[6]N[6]H)(N[6]C[6]){1|Cu<5>,1|H<1>,5|C<3>}	H(C[6]C[6]N[6])	119.4630	0.000	1	119.4630	0.000	1	119.4630	0.000	1	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]C)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(CN)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]C)(H){2|C<3>,2|C<4>,3|H<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(CN){1|H<1>,2|C<4>}	H(C[6]N[5,6]C[6])	119.2390	0.000	1	119.2390	0.000	1	119.2390	0.000	1	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	N[6,6]-3:C[6]-3:H-1:	C[5a,6]-3:C[6]-3:O-2:	C[6]-3:	C[6](N[6,6]C[6,6]C[6])(C[6]C[5a,6]O)(H)	C[6](C[5a,6]C[5a,6a]C[5a,6])(C[6]N[6,6]H)(OC)	H(C[6]N[6,6]C[6])	C[6](N[6,6]C[6,6]C[6])(C[6]C[5a,6]O)(H){1|H<1>,2|C<4>,3|C<3>}	C[6](C[5a,6]C[5a,6a]C[5a,6])(C[6]N[6,6]H)(OC){1|C<4>,1|N<3>,3|C<3>}	H(C[6]N[6,6]C[6])	119.6090	0.000	1	119.6090	0.000	1	119.6090	0.000	1	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](N[6]C[6,6a]C)(C[6]C[6]C)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(CC)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]C)(C[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(CC){1|C<4>,2|C<3>}	H(C[6]C[6]N[6])	119.0547	0.067	3	119.0547	0.004	3	118.8271	0.788	136	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](N[6]C[6,6a]Ir)(C[6]C[6]C)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(CC)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Ir)(C[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(CC){1|Ir<6>,2|C<3>}	H(C[6]C[6]N[6])	119.2260	0.396	2	119.2260	0.157	2	118.8271	0.788	136	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](N[6]C[6,6a]Ru)(C[6]C[6]C)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(CC)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Ru)(C[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(CC){1|Ru<6>,2|C<3>}	H(C[6]C[6]N[6])	118.5910	0.042	2	118.5910	0.002	2	118.8271	0.788	136	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](N[6]C[6]Ag)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CC)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ag)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CC){1|Ag<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.5155	1.115	4	119.5155	1.243	4	118.8271	0.788	136	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](N[6]C[6]Cd)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CC)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cd)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CC){1|Cd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5630	0.000	1	118.5630	0.000	1	118.8271	0.788	136	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CC)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]C)(H){1|C<2>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CC){1|Co<6>,1|C<3>}	H(C[6]C[6]N[6])	123.7970	0.000	1	119.3717	17.684	3	118.8271	0.788	136	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CC)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CC){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	115.4280	0.000	1	119.3717	17.684	3	118.8271	0.788	136	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CC)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CC){1|Co<6>,1|C<3>,1|O<2>}	H(C[6]C[6]N[6])	118.8900	0.000	1	119.3717	17.684	3	118.8271	0.788	136	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CC)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CC){1|Cu<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.1450	0.383	2	118.1698	0.072	5	118.8271	0.788	136	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CC)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CC){1|Cu<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.1863	0.265	3	118.1698	0.072	5	118.8271	0.788	136	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CN)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CN){1|Cu<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6930	0.055	2	118.8057	0.040	3	118.8271	0.788	136	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CN)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CN){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.0310	0.000	1	118.8057	0.040	3	118.8271	0.788	136	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](N[6]C[6]Fe)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CN)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Fe)(C[6]C[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CN){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7525	0.045	2	118.7525	0.002	2	118.8271	0.788	136	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CC)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CC){1|Ir<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.1220	0.000	1	119.1220	0.000	1	118.8271	0.788	136	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CN)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CN){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6605	0.106	4	118.7128	0.022	5	118.8271	0.788	136	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CN)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CN){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.9220	0.000	1	118.7128	0.022	5	118.8271	0.788	136	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CC)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CC){1|Pd<4>,1|C<2>,1|C<3>}	H(C[6]C[6]N[6])	119.1205	1.479	8	118.9176	1.039	31	118.8271	0.788	136	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CC)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CC){1|Pd<4>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	119.0160	0.000	1	118.9176	1.039	31	118.8271	0.788	136	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CC)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CC){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7722	0.936	16	118.9176	1.039	31	118.8271	0.788	136	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CC)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CC){1|Pd<4>,1|C<3>,1|O<2>}	H(C[6]C[6]N[6])	119.2702	0.133	5	118.9176	1.039	31	118.8271	0.788	136	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CC)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CC){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.7600	0.000	1	118.9176	1.039	31	118.8271	0.788	136	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CC)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CC){1|Pt<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2393	0.704	7	118.7345	0.553	46	118.8271	0.788	136	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CC)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CC){1|Pt<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8234	0.724	39	118.7345	0.553	46	118.8271	0.788	136	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CN)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CN){1|Pt<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.1183	0.394	6	119.1183	0.155	6	118.8271	0.788	136	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CO)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CO){1|Pt<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8220	0.000	1	118.8220	0.000	1	118.8271	0.788	136	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](N[6]C[6]Re)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CC)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Re)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CC){1|Re<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5310	0.000	1	118.4537	0.031	8	118.8271	0.788	136	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](N[6]C[6]Re)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CC)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Re)(C[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CC){1|Re<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4427	0.186	7	118.4537	0.031	8	118.8271	0.788	136	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CC)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CC){1|Ru<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5300	0.233	3	118.5383	0.036	4	118.8271	0.788	136	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CC)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CC){1|Ru<8>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5630	0.000	1	118.5383	0.036	4	118.8271	0.788	136	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CN)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CN){1|Zn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.1360	0.141	2	119.1051	0.060	9	118.8271	0.788	136	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CN)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CN){1|Zn<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.3380	0.328	2	119.1051	0.060	9	118.8271	0.788	136	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CN)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CN){1|Zn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.9996	0.216	5	119.1051	0.060	9	118.8271	0.788	136	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:H-2:	C[6]-3:	C[6](N[6]C[6,6a]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(HO)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Ru)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(HO){1|Ru<6>,2|C<3>}	H(C[6]C[6]N[6])	119.2810	0.000	1	119.2810	0.000	1	119.2810	0.000	1	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NC)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NC){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2250	0.197	2	118.2250	0.039	2	119.2885	1.771	6	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NC)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NC){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	121.5400	0.000	1	121.5400	0.000	1	119.2885	1.771	6	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NH)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]N)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NH){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7530	0.119	2	118.7530	0.014	2	119.2885	1.771	6	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](N[6]C[6]Re)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NC)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Re)(C[6]C[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NC){1|Re<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	120.2350	0.000	1	120.2350	0.000	1	119.2885	1.771	6	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](N[6]C[6]Cd)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(OH)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cd)(C[6]C[6]O)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(OH){1|Cd<6>,2|C<3>}	H(C[6]C[6]N[6])	118.7590	0.000	1	118.7590	0.000	1	118.9223	0.223	39	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(OC)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]O)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(OC){1|Co<6>,1|C<2>,1|C<3>}	H(C[6]C[6]N[6])	118.9200	0.000	1	119.4410	0.074	7	118.9223	0.223	39	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(OC)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]O)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(OC){1|Co<6>,1|C<3>,1|O<2>}	H(C[6]C[6]N[6])	119.5278	0.159	6	119.4410	0.074	7	118.9223	0.223	39	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(OH)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]O)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(OH){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4440	0.112	2	118.4440	0.012	2	118.9223	0.223	39	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(OC[6a])	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]O)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(OC[6a]){1|Cu<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.9550	0.119	2	118.9567	0.007	3	118.9223	0.223	39	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(OC[6a])	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]O)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(OC[6a]){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.9600	0.000	1	118.9567	0.007	3	118.9223	0.223	39	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(OH)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]O)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(OH){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3370	0.000	1	118.3370	0.000	1	118.9223	0.223	39	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](N[6]C[6]Fe)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(OC)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Fe)(C[6]C[6]O)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(OC){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7372	0.273	6	118.7372	0.074	6	118.9223	0.223	39	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(OC)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]O)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(OC){1|Ir<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	120.1700	0.000	1	120.1700	0.000	1	118.9223	0.223	39	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(OH)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]O)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(OH){1|Ir<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6350	0.000	1	118.8860	0.049	3	118.9223	0.223	39	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(OH)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]O)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(OH){1|Ir<8>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.0115	0.052	2	118.8860	0.049	3	118.9223	0.223	39	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](N[6]C[6]Mn)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(OC[6a])	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mn)(C[6]C[6]O)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(OC[6a]){1|Mn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8155	0.030	2	118.8155	0.001	2	118.9223	0.223	39	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(OH)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]C[6]O)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(OH){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2585	0.115	2	118.2585	0.013	2	118.9223	0.223	39	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(OC)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]O)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(OC){1|Pd<4>,1|C<2>,1|C<3>}	H(C[6]C[6]N[6])	119.3907	0.152	4	119.3907	0.023	4	118.9223	0.223	39	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(OC)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]O)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(OC){1|Pt<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5585	0.217	2	118.5585	0.047	2	118.9223	0.223	39	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(OH)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]O)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(OH){1|Pt<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2540	0.000	1	118.2540	0.000	1	118.9223	0.223	39	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(OH)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]O)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(OH){1|Zn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4430	0.000	1	118.6743	0.056	4	118.9223	0.223	39	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(OH)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]O)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(OH){1|Zn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7513	0.218	3	118.6743	0.056	4	118.9223	0.223	39	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](N[6]C[6,6a]H)(C[6]C[6]S)(H)	C[6](C[6]C[6,6a]S)(C[6]N[6]H)(SC)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]H)(C[6]C[6]S)(H){1|S<2>,2|C<3>}	C[6](C[6]C[6,6a]S)(C[6]N[6]H)(SC){1|H<1>,2|C<3>}	H(C[6]C[6]N[6])	119.3620	0.310	2	119.3620	0.096	2	118.7726	0.390	5	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]C[6]S)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(SC)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]C[6]S)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(SC){1|Ni<5>,1|C<3>,1|S<2>}	H(C[6]C[6]N[6])	118.2325	0.418	2	118.2325	0.175	2	118.7726	0.390	5	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-2:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]S)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(SC[6a])	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]S)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(SC[6a]){1|Zn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6740	0.000	1	118.6740	0.000	1	118.7726	0.390	5	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:2:	3:	N[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]N[6]O)(H)	C[6](N[6]C[6]Cu)(C[6]N[6]H)(OC)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]N[6]O)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]N[6]H)(OC){1|Cu<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.3720	0.000	1	119.3720	0.000	1	119.3720	0.000	1	120.0707	2.018	3644	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[3x6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[3x6]C[3x6]C[6,6])(C[6]C[6]N[6])(H)	C[6](C[6]C[6]N[6])(C[6]C[3x6]H)(N[6]C[6]Os)	H(C[6]C[3x6]C[6])	C[6](C[3x6]C[3x6]C[6,6])(C[6]C[6]N[6])(H){1|Os<6>,1|N<3>,2|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[6]N[6])(C[6]C[3x6]H)(N[6]C[6]Os){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[3x6]C[6])	120.1002	0.384	5	120.1002	0.148	5	119.6900	0.369	9	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[3x6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[3x6]C[3x6]C[6,6])(C[6]C[6]N[6])(H)	C[6](C[6]C[6]N[6])(C[6]C[3x6]H)(N[6]C[6]Pt)	H(C[6]C[3x6]C[6])	C[6](C[3x6]C[3x6]C[6,6])(C[6]C[6]N[6])(H){1|Pt<4>,1|N<3>,2|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[6]N[6])(C[6]C[3x6]H)(N[6]C[6]Pt){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[3x6]C[6])	119.1773	0.395	4	119.1773	0.156	4	119.6900	0.369	9	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[3x6]-3:C[6]-3:H-1:	C[6]-3:C[6a]-3:N[6]-3:	C[6]-3:	C[6](C[3x6]C[3x6]C[6,6])(C[6]C[6a]N[6])(H)	C[6](C[6]C[3x6]H)(C[6a]C[6a]2)(N[6]C[6]Pt)	H(C[6]C[3x6]C[6])	C[6](C[3x6]C[3x6]C[6,6])(C[6]C[6a]N[6])(H){1|Pt<4>,2|C<4>,2|H<1>,3|C<3>}	C[6](C[6]C[3x6]H)(C[6a]C[6a]2)(N[6]C[6]Pt){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[3x6]C[6])	119.4583	0.497	6	119.4583	0.247	6	119.6027	0.184	10	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[3x6]-3:C[6]-3:H-1:	C[6]-3:C[6a]-3:N[6]-3:	C[6]-3:	C[6](C[3x6]C[3x6]C[6,6])(C[6]C[6a]N[6])(H)	C[6](C[6]C[3x6]H)(C[6a]C[6a]2)(N[6]C[6]Ru)	H(C[6]C[3x6]C[6])	C[6](C[3x6]C[3x6]C[6,6])(C[6]C[6a]N[6])(H){1|Ru<6>,2|C<4>,2|H<1>,3|C<3>}	C[6](C[6]C[3x6]H)(C[6a]C[6a]2)(N[6]C[6]Ru){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[3x6]C[6])	119.8193	0.187	4	119.8193	0.035	4	119.6027	0.184	10	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[3x6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[3x6]C[3x6]C[6,6])(C[6]C[6a]N[6])(H)	C[6](C[6a]C[6a]N[6a])(C[6]C[3x6]H)(N[6]C[6]H)	H(C[6]C[3x6]C[6])	C[6](C[3x6]C[3x6]C[6,6])(C[6]C[6a]N[6])(H){1|N<2>,2|C<3>,2|C<4>,3|H<1>}	C[6](C[6a]C[6a]N[6a])(C[6]C[3x6]H)(N[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[3x6]C[6])	120.0642	0.139	6	120.0642	0.019	6	120.0642	0.019	6	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[4,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[4,6]N[4,6]C[4])(C[6]C[6]N)(H)	C[6](C[6]C[4,6]H)(C[6]C[6]H)(NCC)	H(C[6]C[4,6]C[6])	C[6](C[4,6]N[4,6]C[4])(C[6]C[6]N)(H){1|B<4>,1|C<3>,3|H<1>}	C[6](C[6]C[4,6]H)(C[6]C[6]H)(NCC){1|N<3>,2|C<4>}	H(C[6]C[4,6]C[6])	121.1790	0.000	1	121.1790	0.000	1	119.9770	2.890	2	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[4,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[4,6]N[4,6]Si[4])(C[6]C[6]N)(H)	C[6](C[6]C[4,6]H)(C[6]C[6]H)(NCC)	H(C[6]C[4,6]C[6])	C[6](C[4,6]N[4,6]Si[4])(C[6]C[6]N)(H){2|Si<4>,1|C<3>,1|H<1>}	C[6](C[6]C[4,6]H)(C[6]C[6]H)(NCC){1|Si<3>,1|H<1>,1|N<3>}	H(C[6]C[4,6]C[6])	118.7750	0.000	1	118.7750	0.000	1	119.9770	2.890	2	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[5,6]C[5,6]P[5])(C[6]C[6]C)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(CHH)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]P[5])(C[6]C[6]C)(H){1|Nb<6>,1|C<3>,1|H<1>,1|N<3>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(CHH){1|C<3>,1|H<1>,1|P<4>}	H(C[6]C[5,6]C[6])	117.9660	0.000	1	119.6170	5.452	2	119.6170	5.452	2	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[5,6]C[5,6]P[5])(C[6]C[6]C)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(CHH)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]P[5])(C[6]C[6]C)(H){1|Nb<7>,1|C<2>,1|H<1>,1|N<3>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(CHH){1|C<3>,1|P<4>}	H(C[6]C[5,6]C[6])	121.2680	0.000	1	119.6170	5.452	2	119.6170	5.452	2	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6a]-3:	C[6]-3:	C[6](C[5,6]N[5,5,6]C[5,6])(C[6]C[6a]C[6])(H)	C[6](C[6]C[5,6]H)2(C[6a]C[6a]2)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,5,6]C[5,6])(C[6]C[6a]C[6])(H){1|Ga<5>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6]C[5,6]H)2(C[6a]C[6a]2){1|N<3>,2|H<1>,4|C<3>}	H(C[6]C[5,6]C[6])	119.8375	0.381	2	119.8375	0.145	2	119.8375	0.145	2	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6a]-3:N[6]-3:	C[6]-3:	C[6](C[5,6]C[5,6a]C[5,6])(C[6]C[6a]N[6])(H)	C[6](C[6]C[5,6]H)(C[6a]C[6a]2)(N[6]C[6]C)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6a]C[5,6])(C[6]C[6a]N[6])(H){2|C<4>,5|C<3>}	C[6](C[6]C[5,6]H)(C[6a]C[6a]2)(N[6]C[6]C){3|H<1>,5|C<3>}	H(C[6]C[5,6]C[6])	119.9850	0.000	1	119.9850	0.000	1	119.9850	0.000	1	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[5,6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C[6a]-3:	C[6]-3:	C[6](C[5,6]N[5,6]S[5])(C[6]C[6a]N[6])(H)	C[6](N[6]C[6a]B[6])(C[6]C[5,6]H)(C[6a]C[6a]2)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]S[5])(C[6]C[6a]N[6])(H){1|B<4>,5|C<3>}	C[6](N[6]C[6a]B[6])(C[6]C[5,6]H)(C[6a]C[6a]2){1|N<3>,1|S<2>,2|F<1>,2|H<1>,4|C<3>}	H(C[6]C[5,6]C[6])	119.5638	0.226	6	119.5638	0.051	6	119.5638	0.051	6	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]N[6])(H)	C[6](C[6]C[5a,6]H)(C[6]C[6]N[6])(N[6]C[6]Zn)	H(C[6]C[5a,6]C[6])	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]N[6])(H){1|Zn<6>,1|H<1>,1|N<3>,1|O<2>,3|C<3>}	C[6](C[6]C[5a,6]H)(C[6]C[6]N[6])(N[6]C[6]Zn){2|H<1>,4|C<3>}	H(C[6]C[5a,6]C[6])	121.3178	0.070	4	121.3178	0.005	4	121.3178	0.005	4	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[5a,6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[5a,6]C[5a,6a]C[5a,6])(C[6]N[5,6]C)(H)	C[6](N[5,6]C[5,6a]C[5,6])(C[6]C[5a,6]H)(CHO)	H(C[6]C[5a,6]C[6])	C[6](C[5a,6]C[5a,6a]C[5a,6])(C[6]N[5,6]C)(H){1|C<4>,1|N<3>,3|C<3>}	C[6](N[5,6]C[5,6a]C[5,6])(C[6]C[5a,6]H)(CHO){6|C<3>}	H(C[6]C[5a,6]C[6])	120.0540	0.000	1	120.0540	0.000	1	120.0540	0.000	1	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:C[6a]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[5,6]C[6a])(H)	C[6](C[5,6]N[5,6]N[5])(C[6]C[6,6]H)(C[6a]C[6a]2)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[5,6]C[6a])(H){1|H<1>,3|C<3>,3|N<3>}	C[6](C[5,6]N[5,6]N[5])(C[6]C[6,6]H)(C[6a]C[6a]2){1|Ir<8>,1|H<1>,6|C<3>}	H(C[6]C[6,6]C[6])	118.8940	0.000	1	118.5740	0.178	4	118.5740	0.178	4	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:C[6a]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[5,6]C[6a])(H)	C[6](C[5,6]N[5,6]N[5])(C[6]C[6,6]H)(C[6a]C[6a]2)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[5,6]C[6a])(H){1|H<1>,3|C<3>,3|N<3>}	C[6](C[5,6]N[5,6]N[5])(C[6]C[6,6]H)(C[6a]C[6a]2){1|Pd<4>,2|H<1>,6|C<3>}	H(C[6]C[6,6]C[6])	118.4673	0.445	3	118.5740	0.178	4	118.5740	0.178	4	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[5a,6]-3:C[6]-3:C[6a]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[5a,6]C[6a])(H)	C[6](C[5a,6]N[5a,6]N[5a])(C[6]C[6,6]H)(C[6a]C[6a]2)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[5a,6]C[6a])(H){1|H<1>,3|C<3>,3|N<3>}	C[6](C[5a,6]N[5a,6]N[5a])(C[6]C[6,6]H)(C[6a]C[6a]2){1|C<4>,2|H<1>,6|C<3>}	H(C[6]C[6,6]C[6])	118.3875	0.200	2	118.3875	0.040	2	118.3875	0.040	2	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6,6]C[5,6,6]C[6])(C[6]C[6]C)(H)	C[6](C[6]C[5,6]C)(C[6]C[6,6]H)(CCO)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6,6]C[6])(C[6]C[6]C)(H){1|C<3>,6|C<4>}	C[6](C[6]C[5,6]C)(C[6]C[6,6]H)(CCO){1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6,6]C[6])	114.7680	0.000	1	114.7680	0.000	1	118.6278	2.147	9	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6,6]C[6,6]N[6,6])(C[6]C[6]C)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(CCH)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]N[6,6])(C[6]C[6]C)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(CCH){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6,6]C[6])	119.5620	0.000	1	119.5620	0.000	1	118.6278	2.147	9	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6,6]C[6,6a]N[6,6])(C[6]C[6]C)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(CCH)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]N[6,6])(C[6]C[6]C)(H){1|C<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(CCH){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6,6]C[6])	119.0457	0.175	7	119.0457	0.031	7	118.6278	2.147	9	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6a]-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6a]C[6])(H)	C[6](C[6]N[5]N[6])(C[6]C[6,6]H)(C[6a]C[6a]2)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6a]C[6])(H){1|H<1>,3|C<3>,3|N<3>}	C[6](C[6]N[5]N[6])(C[6]C[6,6]H)(C[6a]C[6a]2){1|Ru<5>,2|H<1>,6|C<3>}	H(C[6]C[6,6]C[6])	119.3970	0.000	1	119.3970	0.000	1	118.5527	1.172	3	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6a]-3:	C[6]-3:	C[6](C[6,6]N[6,6,6a]C[6,6a])(C[6]C[6a]C[6])(H)	C[6](C[6]C[6,6a]H)(C[6]C[6,6]H)(C[6a]C[6a]2)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6,6a]C[6,6a])(C[6]C[6a]C[6])(H){1|H<1>,6|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6,6]H)(C[6a]C[6a]2){1|N<3>,2|H<1>,4|C<3>}	H(C[6]C[6,6]C[6])	118.9290	0.000	1	118.9290	0.000	1	118.5527	1.172	3	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6a]-3:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]C[6a]C[6])(H)	C[6](C[6]C[6,6]H)(C[6]C[6,6]O)(C[6a]C[6a]2)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]C[6a]C[6])(H){1|C<4>,1|H<1>,1|O<1>,4|C<3>}	C[6](C[6]C[6,6]H)(C[6]C[6,6]O)(C[6a]C[6a]2){1|N<3>,2|H<1>,5|C<3>}	H(C[6]C[6,6]C[6])	117.3320	0.000	1	117.3320	0.000	1	118.5527	1.172	3	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]N)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]N)(NOO)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<1>,1|O<2>,2|N<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]N)(NOO){1|C<3>,2|C<4>}	H(C[6]C[6,6]C[6])	119.3850	0.000	2	119.3850	0.000	2	119.5676	0.037	5	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6,6]C[6,6]O[6])(C[6]C[6]N)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(NCC)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]O[6])(C[6]C[6]N)(H){1|C<2>,1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(NCC){1|C<3>,1|O<2>}	H(C[6]C[6,6]C[6])	119.6870	0.000	1	119.6870	0.000	1	119.5676	0.037	5	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6,6]N[3x6]N[6])(C[6]C[6]N)(H)	C[6](C[6]C[6,6]H)2(NCC)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[3x6]N[6])(C[6]C[6]N)(H){1|C<3>,1|H<1>,4|C<4>}	C[6](C[6]C[6,6]H)2(NCC){1|N<3>,2|N<4>}	H(C[6]C[6,6]C[6])	119.6905	0.196	2	119.6905	0.038	2	119.5676	0.037	5	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6a]-3:N[6]-3:	C[6]-3:	C[6](C[6,6]C[6,6]N[6])(C[6]C[6a]N[6])(H)	C[6](C[6]C[6,6]H)(C[6a]C[6a]2)(N[6]C[6]Ru)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]N[6])(C[6]C[6a]N[6])(H){1|Ru<6>,1|C<4>,1|H<1>,4|C<3>}	C[6](C[6]C[6,6]H)(C[6a]C[6a]2)(N[6]C[6]Ru){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6,6]C[6])	120.4540	0.000	1	120.4540	0.000	1	119.3893	0.510	4	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6a]-3:N[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]C[6a]N[6])(H)	C[6](C[6]C[6,6]H)(C[6a]C[6a]2)(N[6]B[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]C[6a]N[6])(H){1|B<4>,2|H<1>,4|C<3>}	C[6](C[6]C[6,6]H)(C[6a]C[6a]2)(N[6]B[6]H){1|N<3>,2|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6,6]C[6])	118.9370	0.000	1	119.0343	0.010	3	119.3893	0.510	4	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6a]-3:N[6]-3:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]C[6a]N[6])(H)	C[6](C[6]C[6,6]H)(C[6a]C[6a]2)(N[6]B[6]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]C[6a]N[6])(H){1|B<4>,2|H<1>,4|C<3>}	C[6](C[6]C[6,6]H)(C[6a]C[6a]2)(N[6]B[6]H){1|N<3>,2|H<1>,5|C<3>}	H(C[6]C[6,6]C[6])	119.0830	0.071	2	119.0343	0.010	3	119.3893	0.510	4	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]N[6]C)(H)	C[6](C[6]C[6,6]H)(N[6]C[6]H)(CCH)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]N[6]C)(H){1|Cl<1>,1|H<1>,3|C<3>}	C[6](C[6]C[6,6]H)(N[6]C[6]H)(CCH){1|H<1>,2|C<3>}	H(C[6]C[6,6]C[6])	118.8970	0.000	1	118.8970	0.000	1	118.8970	0.000	1	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C[6a]-3:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]C[6a]N[6])(H)	C[6](N[6]C[6a]B[6])(C[6]C[6,6]H)(C[6a]C[6a]2)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]C[6a]N[6])(H){1|B<4>,1|H<1>,5|C<3>}	C[6](N[6]C[6a]B[6])(C[6]C[6,6]H)(C[6a]C[6a]2){1|N<3>,2|F<1>,2|H<1>,5|C<3>}	H(C[6]C[6,6]C[6])	118.6120	0.000	1	118.6120	0.000	1	118.6120	0.000	1	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6,6a]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:C[6a]-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]C[6a])(H)	C[6](C[5,6]C[5,6]C[5])(C[6]C[6,6a]H)(C[6a]C[6a]2)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]C[6a])(H){1|C<4>,1|H<1>,5|C<3>}	C[6](C[5,6]C[5,6]C[5])(C[6]C[6,6a]H)(C[6a]C[6a]2){3|H<1>,7|C<3>}	H(C[6]C[6,6a]C[6])	118.8070	0.000	1	118.8070	0.000	1	118.6580	0.044	2	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6,6a]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:C[6a]-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]C[6a])(H)	C[6](C[5,6]N[5,6]N[5])(C[6]C[6,6a]H)(C[6a]C[6a]2)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]C[6a])(H){1|H<1>,1|N<2>,2|N<3>,3|C<3>}	C[6](C[5,6]N[5,6]N[5])(C[6]C[6,6a]H)(C[6a]C[6a]2){1|Pd<4>,1|H<1>,6|C<3>}	H(C[6]C[6,6a]C[6])	118.5090	0.000	1	118.5090	0.000	1	118.6580	0.044	2	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6,6a]-3:C[6]-3:H-1:	C[5]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5]N[6])(H)	C[6](C[5]C[5]N[5])(C[6]C[6,6a]H)(N[6]C[6]Pd)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5]N[6])(H){1|Pd<4>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[5]C[5]N[5])(C[6]C[6,6a]H)(N[6]C[6]Pd){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6,6a]C[6])	119.6180	0.000	1	119.6180	0.000	1	119.6180	0.000	1	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6,6a]-3:C[6]-3:H-1:	C[5a,6]-3:C[6]-3:C[6a]-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5a,6]C[6a])(H)	C[6](C[5a,6]N[5a,6]N[5a])(C[6]C[6,6a]H)(C[6a]C[6a]2)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5a,6]C[6a])(H){1|H<1>,1|N<2>,2|N<3>,3|C<3>}	C[6](C[5a,6]N[5a,6]N[5a])(C[6]C[6,6a]H)(C[6a]C[6a]2){1|C<4>,2|H<1>,6|C<3>}	H(C[6]C[6,6a]C[6])	118.9320	0.000	1	118.9320	0.000	1	118.9320	0.000	1	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6,6a]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5a]C[6])(H)	C[6](C[5a]C[5a]S[5a])(C[6]C[6,6a]H)(C[6]N[6]H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5a]C[6])(H){1|N<3>,1|S<2>,2|H<1>,3|C<3>}	C[6](C[5a]C[5a]S[5a])(C[6]C[6,6a]H)(C[6]N[6]H){1|Cd<6>,1|H<1>,4|C<3>}	H(C[6]C[6,6a]C[6])	119.4490	0.253	4	119.4490	0.064	4	119.3466	0.100	5	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6,6a]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[5a]C[6])(H)	C[6](C[5a]N[5a]S[5a])(C[6]C[6,6a]H)(C[6]O[6]N)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[5a]C[6])(H){1|O<2>,1|S<2>,2|N<2>,3|C<3>}	C[6](C[5a]N[5a]S[5a])(C[6]C[6,6a]H)(C[6]O[6]N){4|C<3>}	H(C[6]C[6,6a]C[6])	118.9370	0.000	1	118.9370	0.000	1	119.3466	0.100	5	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6,6a]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5a]N[6])(H)	C[6](C[5a]C[5,5a,6]N[5a])(C[6]C[6,6a]H)(N[6]C[6]Pt)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5a]N[6])(H){1|Pt<4>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[5a]C[5,5a,6]N[5a])(C[6]C[6,6a]H)(N[6]C[6]Pt){1|C<4>,1|H<1>,1|N<2>,3|C<3>}	H(C[6]C[6,6a]C[6])	119.6372	0.743	4	119.6372	0.552	4	119.6372	0.552	4	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]C)(H)	C[6](C[6,6]N[6,6]N[6])(C[6]C[6,6a]H)(CC[6a]O)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]C)(H){1|C<3>,1|H<1>,1|N<3>,2|N<2>}	C[6](C[6,6]N[6,6]N[6])(C[6]C[6,6a]H)(CC[6a]O){2|C<3>,2|C<4>}	H(C[6]C[6,6a]C[6])	118.9940	0.000	1	118.9940	0.000	1	118.9940	0.000	1	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]N[6])(H)	C[6](C[6,6]C[6,6]N[6,6])(C[6]C[6,6a]H)(N[6]C[6]Pt)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]N[6])(H){1|Pt<4>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6,6]C[6,6]N[6,6])(C[6]C[6,6a]H)(N[6]C[6]Pt){2|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6,6a]C[6])	121.1920	0.000	1	121.1920	0.000	1	121.1920	0.000	1	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5]C[6])(H)	C[6](C[6]C[6,6a]H)(C[5]C[5]2)(C[6]N[6]H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5]C[6])(H){1|N<3>,2|H<1>,4|C<3>}	C[6](C[6]C[6,6a]H)(C[5]C[5]2)(C[6]N[6]H){1|C<4>,1|O<1>,1|O<2>,4|C<3>}	H(C[6]C[6,6a]C[6])	119.4770	0.000	1	119.4770	0.000	1	119.1345	0.235	2	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5]C[6])(H)	C[6](C[6]C[6,6a]H)(C[5]N[5]2)(C[6]O[6]O)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5]C[6])(H){1|H<1>,2|C<3>,2|N<3>,2|O<2>}	C[6](C[6]C[6,6a]H)(C[5]N[5]2)(C[6]O[6]O){2|Pt<4>,4|C<3>}	H(C[6]C[6,6a]C[6])	118.7920	0.000	1	118.7920	0.000	1	119.1345	0.235	2	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[5a]-3:C[6]-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5a]C[6])(H)	C[6](C[6]C[6,6a]H)(C[5a]N[5a]2)(C[6]O[6]N)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5a]C[6])(H){1|H<1>,1|N<2>,1|O<2>,2|C<3>,2|N<3>}	C[6](C[6]C[6,6a]H)(C[5a]N[5a]2)(C[6]O[6]N){1|C<4>,4|C<3>}	H(C[6]C[6,6a]C[6])	118.3820	0.000	1	118.9615	0.672	2	118.9615	0.672	2	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[5a]-3:C[6]-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5a]C[6])(H)	C[6](C[6]C[6,6a]H)(C[5a]N[5a]2)(C[6]O[6]N)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5a]C[6])(H){1|H<1>,1|N<3>,1|O<2>,2|C<3>,2|N<2>}	C[6](C[6]C[6,6a]H)(C[5a]N[5a]2)(C[6]O[6]N){1|C<4>,4|C<3>}	H(C[6]C[6,6a]C[6])	119.5410	0.000	1	118.9615	0.672	2	118.9615	0.672	2	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:B-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]B)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(BOO)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]B)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(BOO){1|C<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.2480	0.000	1	119.2480	0.000	1	119.2480	0.000	1	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6,6a]C[6,6,6a]C[6a])(C[6]C[6]C)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6,6]O)(CNO)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6,6a]C[6a])(C[6]C[6]C)(H){1|C<4>,1|H<1>,1|O<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6,6]O)(CNO){1|O<2>,3|C<3>}	H(C[6]C[6,6a]C[6])	118.8210	0.000	1	118.8210	0.000	1	119.1787	1.033	23	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(CNO)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H){1|H<1>,1|O<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(CNO){1|H<1>,2|C<3>}	H(C[6]C[6,6a]C[6])	123.1790	0.000	1	120.5550	13.771	2	119.1787	1.033	23	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(CNO)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H){1|H<1>,1|O<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(CNO){1|N<2>,2|C<3>}	H(C[6]C[6,6a]C[6])	117.9310	0.000	1	120.5550	13.771	2	119.1787	1.033	23	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(COO)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(COO){1|Co<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.5705	0.961	2	119.2331	0.429	7	119.1787	1.033	23	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(COO)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(COO){1|H<1>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.4010	0.000	1	119.2331	0.429	7	119.1787	1.033	23	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(COO)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(COO){1|Zn<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.0225	0.637	4	119.2331	0.429	7	119.1787	1.033	23	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]O)(CHN)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H){1|H<1>,1|N<3>,1|O<2>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]O)(CHN){1|H<1>,2|C<3>}	H(C[6]C[6,6a]C[6])	118.8830	0.000	1	118.8830	0.000	1	119.1787	1.033	23	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]S)(CHN)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H){1|H<1>,1|N<3>,1|S<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]S)(CHN){1|H<1>,2|C<3>}	H(C[6]C[6,6a]C[6])	118.8420	0.000	1	118.8420	0.000	1	119.1787	1.033	23	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H)	C[6](C[6]C[6,6a]H)(C[6]O[6]N)(CC[6a]O)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H){1|H<1>,1|N<2>,1|O<2>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]O[6]N)(CC[6a]O){2|C<3>}	H(C[6]C[6,6a]C[6])	119.6635	0.049	2	119.6635	0.002	2	119.1787	1.033	23	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H)	C[6](C[6]C[6,6a]H)(C[6]O[6]N)(CNO)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H){1|C<4>,1|N<2>,1|O<2>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]O[6]N)(CNO){2|C<3>}	H(C[6]C[6,6a]C[6])	119.2590	0.000	1	118.7562	0.112	5	119.1787	1.033	23	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H)	C[6](C[6]C[6,6a]H)(C[6]O[6]N)(CNO)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H){1|H<1>,1|N<2>,1|O<2>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]O[6]N)(CNO){2|C<3>}	H(C[6]C[6,6a]C[6])	118.6305	0.211	4	118.7562	0.112	5	119.1787	1.033	23	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H)	C[6](C[6]C[6,6a]H)(C[6]O[6]N)(CNS)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H){1|H<1>,1|N<2>,1|O<2>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]O[6]N)(CNS){2|C<3>}	H(C[6]C[6,6a]C[6])	118.8720	0.000	1	118.8720	0.000	1	119.1787	1.033	23	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H)	C[6](C[6]C[6,6a]H)(C[6]O[6]O)(CCN)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H){1|H<1>,2|C<3>,2|O<2>}	C[6](C[6]C[6,6a]H)(C[6]O[6]O)(CCN){2|C<3>}	H(C[6]C[6,6a]C[6])	118.6190	0.000	1	118.6190	0.000	1	119.1787	1.033	23	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H)	C[6](C[6]C[6,6a]H)(C[6]O[6]O)(COO)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H){1|H<1>,2|C<3>,2|O<2>}	C[6](C[6]C[6,6a]H)(C[6]O[6]O)(COO){2|C<3>}	H(C[6]C[6,6a]C[6])	119.1120	0.051	2	119.1120	0.003	2	119.1787	1.033	23	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]2)(H)	C[6](C[6]C[5a,6]2)(C[6]C[6,6a]H)(C[6]N[5]N[6])	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]2)(H){1|H<1>,2|N<3>,4|C<3>}	C[6](C[6]C[5a,6]2)(C[6]C[6,6a]H)(C[6]N[5]N[6]){1|Ru<9>,3|N<3>,5|C<3>}	H(C[6]C[6,6a]C[6])	119.5045	0.005	2	119.5045	0.000	2	119.5045	0.000	2	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6a]-3:	C[6]-3:	C[6](C[6,6a]N[6,6,6a]C[6a,6a])(C[6]C[6a]C[6])(H)	C[6](C[6]C[6,6a]H)(C[6]C[6,6]H)(C[6a]C[6a]2)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]N[6,6,6a]C[6a,6a])(C[6]C[6a]C[6])(H){1|H<1>,6|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6,6]H)(C[6a]C[6a]2){1|N<3>,2|H<1>,4|C<3>}	H(C[6]C[6,6a]C[6])	118.8840	0.000	1	118.8840	0.000	1	118.5845	0.179	2	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6a]-3:	C[6]-3:	C[6](C[6,6a]N[6,6a]N[6a])(C[6]C[6a]C[6])(H)	C[6](C[6]C[6a]C[6])(C[6]C[6,6a]H)(C[6a]C[6a]2)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]N[6,6a]N[6a])(C[6]C[6a]C[6])(H){6|C<3>}	C[6](C[6]C[6a]C[6])(C[6]C[6,6a]H)(C[6a]C[6a]2){1|N<2>,1|N<3>,2|H<1>,5|C<3>}	H(C[6]C[6,6a]C[6])	118.2850	0.000	1	118.2850	0.000	1	118.5845	0.179	2	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]N)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(NCH)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]N)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(NCH){1|C<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.0407	0.073	3	120.0407	0.005	3	120.0407	0.005	3	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]N[6])(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(N[6]C[6]Co)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]N[6])(H){1|Co<6>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(N[6]C[6]Co){2|H<1>,4|C<3>}	H(C[6]C[6,6a]C[6])	119.7795	0.749	4	119.7795	0.560	4	120.6466	5.691	8	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]N[6])(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(N[6]C[6]Pt)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]N[6])(H){1|Pt<4>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(N[6]C[6]Pt){2|H<1>,4|C<3>}	H(C[6]C[6,6a]C[6])	121.5138	3.273	4	121.5138	10.714	4	120.6466	5.691	8	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]C[6])(H)	C[6](C[6]C[6,6a]H)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]C[6])(H){1|C<2>,2|H<1>,4|C<3>}	C[6](C[6]C[6,6a]H)(C[6a]C[6a]2)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6,6a]C[6])	122.7280	0.000	1	122.7280	0.000	1	119.8124	1.514	13	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]C[6])(H)	C[6](C[6]C[6,6a]H)(C[6a]C[6a]2)(C[6]C[6]O)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]C[6])(H){1|C<4>,1|H<1>,1|O<1>,4|C<3>}	C[6](C[6]C[6,6a]H)(C[6a]C[6a]2)(C[6]C[6]O){2|C<4>,2|H<1>,4|C<3>}	H(C[6]C[6,6a]C[6])	117.5480	0.000	1	118.3677	0.587	3	119.8124	1.514	13	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]C[6])(H)	C[6](C[6]C[6,6a]H)(C[6a]C[6a]2)(C[6]C[6]O)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]C[6])(H){1|H<1>,1|O<1>,5|C<3>}	C[6](C[6]C[6,6a]H)(C[6a]C[6a]2)(C[6]C[6]O){2|H<1>,5|C<3>}	H(C[6]C[6,6a]C[6])	118.7775	0.407	2	118.3677	0.587	3	119.8124	1.514	13	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]C[6])(H)	C[6](C[6]C[6,6a]H)(C[6a]C[6a]2)(C[6]N[6]H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]C[6])(H){1|N<3>,2|H<1>,4|C<3>}	C[6](C[6]C[6,6a]H)(C[6a]C[6a]2)(C[6]N[6]H){1|Ir<6>,2|H<1>,4|C<3>}	H(C[6]C[6,6a]C[6])	120.5455	0.158	2	120.1790	0.191	4	119.8124	1.514	13	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]C[6])(H)	C[6](C[6]C[6,6a]H)(C[6a]C[6a]2)(C[6]N[6]H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]C[6])(H){1|N<3>,2|H<1>,4|C<3>}	C[6](C[6]C[6,6a]H)(C[6a]C[6a]2)(C[6]N[6]H){1|Ru<6>,2|H<1>,4|C<3>}	H(C[6]C[6,6a]C[6])	119.8125	0.098	2	120.1790	0.191	4	119.8124	1.514	13	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]C[6])(H)	C[6](C[6]C[6,6a]H)(C[6a]C[6a]2)(C[6]O[6]C)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]C[6])(H){1|H<1>,1|O<2>,5|C<3>}	C[6](C[6]C[6,6a]H)(C[6a]C[6a]2)(C[6]O[6]C){2|H<1>,4|C<3>}	H(C[6]C[6,6a]C[6])	119.5320	0.000	1	119.5320	0.000	1	119.8124	1.514	13	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6a]C[6])(H)	C[6](C[6]C[6,6a]H)(C[6a]C[6a]2)(C[6]N[6]H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6a]C[6])(H){1|H<1>,1|N<2>,1|N<3>,4|C<3>}	C[6](C[6]C[6,6a]H)(C[6a]C[6a]2)(C[6]N[6]H){1|Ru<6>,2|H<1>,4|C<3>}	H(C[6]C[6,6a]C[6])	120.3015	0.233	2	120.3015	0.054	2	119.8124	1.514	13	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6,6a]N[6,6a]C[6a])(C[6]C[6a]C[6])(H)	C[6](C[6]C[6,6a]H)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]N[6,6a]C[6a])(C[6]C[6a]C[6])(H){1|Os<7>,2|H<1>,5|C<3>}	C[6](C[6]C[6,6a]H)(C[6a]C[6a]2)(C[6]C[6]H){1|Os<7>,1|N<4>,2|H<1>,3|C<3>}	H(C[6]C[6,6a]C[6])	119.7780	0.000	1	119.7780	0.000	1	119.8124	1.514	13	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6,6a]N[6,6a]C[6a])(C[6]C[6a]C[6])(H)	C[6](C[6]C[6,6a]H)(C[6a]C[6a]2)(C[6]C[6]Ru)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]N[6,6a]C[6a])(C[6]C[6a]C[6])(H){1|Ru<6>,1|H<1>,5|C<3>}	C[6](C[6]C[6,6a]H)(C[6a]C[6a]2)(C[6]C[6]Ru){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6,6a]C[6])	119.1010	0.000	1	119.1010	0.000	1	119.8124	1.514	13	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6a]-3:N[6]-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]N[6])(H)	C[6](C[6]C[6,6a]H)(C[6a]C[6a]2)(N[6]C[6]C)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]N[6])(H){1|C<4>,1|H<1>,5|C<3>}	C[6](C[6]C[6,6a]H)(C[6a]C[6a]2)(N[6]C[6]C){3|H<1>,5|C<3>}	H(C[6]C[6,6a]C[6])	119.2340	0.000	1	119.1257	0.020	3	118.7953	0.790	11	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6a]-3:N[6]-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]N[6])(H)	C[6](C[6]C[6,6a]H)(C[6a]C[6a]2)(N[6]C[6]C)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]N[6])(H){1|C<4>,1|H<1>,5|C<3>}	C[6](C[6]C[6,6a]H)(C[6a]C[6a]2)(N[6]C[6]C){4|C<3>,4|H<1>}	H(C[6]C[6,6a]C[6])	119.0715	0.149	2	119.1257	0.020	3	118.7953	0.790	11	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6a]-3:N[6]-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]N[6])(H)	C[6](C[6]C[6,6a]H)(C[6a]C[6a]2)(N[6]C[6]N)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]N[6])(H){1|C<4>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6]C[6,6a]H)(C[6a]C[6a]2)(N[6]C[6]N){1|C<4>,3|H<1>,4|C<3>}	H(C[6]C[6,6a]C[6])	118.8550	0.000	1	118.8145	0.003	2	118.7953	0.790	11	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6a]-3:N[6]-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]N[6])(H)	C[6](C[6]C[6,6a]H)(C[6a]C[6a]2)(N[6]C[6]N)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]N[6])(H){1|H<1>,1|N<3>,5|C<3>}	C[6](C[6]C[6,6a]H)(C[6a]C[6a]2)(N[6]C[6]N){2|H<1>,5|C<3>}	H(C[6]C[6,6a]C[6])	118.7740	0.000	1	118.8145	0.003	2	118.7953	0.790	11	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6a]-3:N[6]-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]N[6])(H)	C[6](C[6]C[6,6a]H)(C[6a]C[6a]2)(N[6]C[6]O)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]N[6])(H){1|H<1>,1|O<1>,5|C<3>}	C[6](C[6]C[6,6a]H)(C[6a]C[6a]2)(N[6]C[6]O){1|N<3>,2|H<1>,4|C<3>}	H(C[6]C[6,6a]C[6])	119.0250	0.171	3	119.0250	0.029	3	118.7953	0.790	11	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6a]-3:N[6]-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]N[6])(H)	C[6](C[6]C[6,6a]H)(C[6a]C[6a]2)(N[6]P[6]C)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]N[6])(H){1|C<4>,1|H<1>,1|P<4>,4|C<3>}	C[6](C[6]C[6,6a]H)(C[6a]C[6a]2)(N[6]P[6]C){1|O<1>,1|O<2>,2|H<1>,4|C<3>}	H(C[6]C[6,6a]C[6])	116.1690	0.000	1	116.1690	0.000	1	118.7953	0.790	11	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6a]-3:N[6]-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]N[6a])(C[6]C[6a]N[6])(H)	C[6](C[6]C[6,6a]H)(C[6a]C[6a]2)(N[6]C[6]Ru)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]N[6a])(C[6]C[6a]N[6])(H){1|Ru<6>,5|C<3>}	C[6](C[6]C[6,6a]H)(C[6a]C[6a]2)(N[6]C[6]Ru){1|N<2>,2|H<1>,3|C<3>}	H(C[6]C[6,6a]C[6])	119.2490	0.020	2	119.2490	0.000	2	118.7953	0.790	11	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]C)(H)	C[6](C[6]C[6,6a]H)(N[6]C[6]Au)(CNO)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]C)(H){1|Au<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(N[6]C[6]Au)(CNO){1|H<1>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.9820	0.000	1	119.9820	0.000	1	119.7450	0.076	5	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]C)(H)	C[6](C[6]C[6,6a]H)(N[6]C[6]C)(CCH)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]C)(H){1|C<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(N[6]C[6]C)(CCH){1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.2730	0.000	1	119.2730	0.000	1	119.7450	0.076	5	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]C)(H)	C[6](C[6]C[6,6a]H)(N[6]C[6]Co)(COO)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]C)(H){1|Co<6>,1|H<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(N[6]C[6]Co)(COO){1|H<1>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.8570	0.000	1	119.8570	0.000	1	119.7450	0.076	5	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]C)(H)	C[6](C[6]C[6,6a]H)(N[6]C[6]Fe)(COO)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]C)(H){1|Fe<6>,1|H<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(N[6]C[6]Fe)(COO){1|H<1>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.8450	0.000	1	119.8450	0.000	1	119.7450	0.076	5	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]C)(H)	C[6](C[6]C[6,6a]H)(N[6]C[6]Ni)(COO)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]C)(H){1|Ni<6>,1|H<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(N[6]C[6]Ni)(COO){1|H<1>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.7680	0.000	1	119.7680	0.000	1	119.7450	0.076	5	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]N)(H)	C[6](C[6]C[6,6a]H)(N[6]C[6]S)(NC[6a]C)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]N)(H){1|C<4>,1|H<1>,1|S<4>,2|C<3>}	C[6](C[6]C[6,6a]H)(N[6]C[6]S)(NC[6a]C){1|H<1>,3|C<3>}	H(C[6]C[6,6a]C[6])	118.5920	0.000	1	118.5920	0.000	1	118.5920	0.000	1	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6,6a]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[5,6]C)(H)	C[6](N[5,6]C[5,6]O[5])(C[6]C[6,6a]H)(CNO)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[5,6]C)(H){1|H<1>,1|O<2>,3|C<3>}	C[6](N[5,6]C[5,6]O[5])(C[6]C[6,6a]H)(CNO){1|In<6>,1|O<2>,2|C<3>}	H(C[6]C[6,6a]C[6])	118.9470	0.000	1	118.9470	0.000	1	118.9470	0.000	1	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6,6a]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:C[6a]-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[5,6]C[6a])(H)	C[6](N[5,6]C[5,6]N[5])(C[6]C[6,6a]H)(C[6a]C[6a]2)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[5,6]C[6a])(H){1|C<4>,1|H<1>,1|N<2>,4|C<3>}	C[6](N[5,6]C[5,6]N[5])(C[6]C[6,6a]H)(C[6a]C[6a]2){1|C<4>,3|H<1>,5|C<3>}	H(C[6]C[6,6a]C[6])	118.7470	0.000	1	118.7470	0.000	1	118.7470	0.000	1	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6,6a]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:C[6a]-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6,6]C[6a])(H)	C[6](N[6,6]C[6,6]O[6])(C[6]C[6,6a]H)(C[6a]C[6a]2)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6,6]C[6a])(H){1|C<4>,1|H<1>,1|O<2>,4|C<3>}	C[6](N[6,6]C[6,6]O[6])(C[6]C[6,6a]H)(C[6a]C[6a]2){1|C<4>,1|N<3>,3|H<1>,4|C<3>}	H(C[6]C[6,6a]C[6])	118.7910	0.000	1	118.7910	0.000	1	119.2375	0.112	4	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6,6a]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:C[6a]-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6,6]C[6a])(H)	C[6](N[6,6]C[6,6a]C[6,6])(C[6]C[6,6a]H)(C[6a]C[6a]2)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6,6]C[6a])(H){1|C<4>,1|H<1>,5|C<3>}	C[6](N[6,6]C[6,6a]C[6,6])(C[6]C[6,6a]H)(C[6a]C[6a]2){1|O<2>,3|H<1>,6|C<3>}	H(C[6]C[6,6a]C[6])	119.2370	0.000	1	119.2825	0.004	2	119.2375	0.112	4	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6,6a]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:C[6a]-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6,6]C[6a])(H)	C[6](N[6,6]C[6,6a]C[6,6])(C[6]C[6,6a]H)(C[6a]C[6a]2)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6,6]C[6a])(H){1|C<4>,1|H<1>,5|C<3>}	C[6](N[6,6]C[6,6a]C[6,6])(C[6]C[6,6a]H)(C[6a]C[6a]2){3|H<1>,7|C<3>}	H(C[6]C[6,6a]C[6])	119.3280	0.000	1	119.2825	0.004	2	119.2375	0.112	4	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6,6a]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:C[6a]-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6,6]C[6a])(H)	C[6](N[6,6]N[5a,6]C[6,6])(C[6]C[6,6a]H)(C[6a]C[6a]2)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6,6]C[6a])(H){1|C<4>,1|H<1>,1|N<3>,4|C<3>}	C[6](N[6,6]N[5a,6]C[6,6])(C[6]C[6,6a]H)(C[6a]C[6a]2){1|N<3>,3|H<1>,6|C<3>}	H(C[6]C[6,6a]C[6])	119.5940	0.000	1	119.5940	0.000	1	119.2375	0.112	4	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6,6a]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C[6a]-3:	C[6]-3:	C[6](C[6,6a]C[6,6,6a]C[6a])(C[6]C[6a]N[6])(H)	C[6](N[6]C[6,6]C[6a])(C[6]C[6,6a]H)(C[6a]C[6a]2)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6,6a]C[6a])(C[6]C[6a]N[6])(H){1|C<4>,1|H<1>,5|C<3>}	C[6](N[6]C[6,6]C[6a])(C[6]C[6,6a]H)(C[6a]C[6a]2){3|H<1>,7|C<3>}	H(C[6]C[6,6a]C[6])	119.3470	0.000	1	119.3470	0.000	1	118.4954	2.182	9	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6,6a]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C[6a]-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]N[6])(H)	C[6](N[6]C[6a]C[6])(C[6]C[6,6a]H)(C[6a]C[6a]2)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]N[6])(H){1|C<4>,1|H<1>,5|C<3>}	C[6](N[6]C[6a]C[6])(C[6]C[6,6a]H)(C[6a]C[6a]2){1|C<4>,3|H<1>,6|C<3>}	H(C[6]C[6,6a]C[6])	119.6200	0.000	1	119.0050	0.315	3	118.4954	2.182	9	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6,6a]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C[6a]-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]N[6])(H)	C[6](N[6]C[6a]C[6])(C[6]C[6,6a]H)(C[6a]C[6a]2)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]N[6])(H){1|H<1>,6|C<3>}	C[6](N[6]C[6a]C[6])(C[6]C[6,6a]H)(C[6a]C[6a]2){3|H<1>,6|C<3>}	H(C[6]C[6,6a]C[6])	118.6975	0.250	2	119.0050	0.315	3	118.4954	2.182	9	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6,6a]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C[6a]-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]N[6])(H)	C[6](N[6]C[6a]S[6])(C[6]C[6,6a]H)(C[6a]C[6a]2)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]N[6])(H){1|H<1>,1|S<4>,5|C<3>}	C[6](N[6]C[6a]S[6])(C[6]C[6,6a]H)(C[6a]C[6a]2){2|H<1>,2|O<1>,6|C<3>}	H(C[6]C[6,6a]C[6])	118.0690	0.000	1	118.0690	0.000	1	118.4954	2.182	9	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6,6a]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C[6a]-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]N[6a])(C[6]C[6a]N[6])(H)	C[6](N[6]C[6a]C[6])(C[6]C[6,6a]H)(C[6a]C[6a]2)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]N[6a])(C[6]C[6a]N[6])(H){1|C<4>,5|C<3>}	C[6](N[6]C[6a]C[6])(C[6]C[6,6a]H)(C[6a]C[6a]2){1|C<4>,1|N<2>,3|H<1>,5|C<3>}	H(C[6]C[6,6a]C[6])	119.2390	0.000	1	119.6315	0.308	2	118.4954	2.182	9	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6,6a]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C[6a]-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]N[6a])(C[6]C[6a]N[6])(H)	C[6](N[6]C[6a]C[6])(C[6]C[6,6a]H)(C[6a]C[6a]2)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]N[6a])(C[6]C[6a]N[6])(H){1|C<4>,5|C<3>}	C[6](N[6]C[6a]C[6])(C[6]C[6,6a]H)(C[6a]C[6a]2){1|N<2>,3|H<1>,6|C<3>}	H(C[6]C[6,6a]C[6])	120.0240	0.000	1	119.6315	0.308	2	118.4954	2.182	9	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6,6a]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C[6a]-3:	C[6]-3:	C[6](C[6,6a]N[6,6,6a]C[6a])(C[6]C[6a]N[6])(H)	C[6](N[6]Ge[6,6]Si)(C[6]C[6,6a]H)(C[6a]C[6a]2)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]N[6,6,6a]C[6a])(C[6]C[6a]N[6])(H){1|Ge<3>,1|Si<4>,1|H<1>,4|C<3>}	C[6](N[6]Ge[6,6]Si)(C[6]C[6,6a]H)(C[6a]C[6a]2){2|H<1>,2|N<3>,3|C<3>}	H(C[6]C[6,6a]C[6])	116.3825	1.822	2	116.3825	3.320	2	118.4954	2.182	9	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:As[6]-3:H-1:	C[6a]-3:As[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]As[6]C[6a])(As[6]C[6]C)(H)	C[6](C[6a]C[6a]2)(As[6]C[6]C)(C[6]As[6]H)	H(C[6]As[6]C[6])	C[6](C[6]As[6]C[6a])(As[6]C[6]C)(H){1|C<4>,4|C<3>}	C[6](C[6a]C[6a]2)(As[6]C[6]C)(C[6]As[6]H){1|C<4>,3|C<3>,3|H<1>}	H(C[6]As[6]C[6])	116.1618	0.832	6	116.1618	0.692	6	116.1618	0.692	6	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	As-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[6]As)(C[6]C[6]H)(H)	C[6](AsC[6a]C[6])(N[6]C[6]Co)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[6]As)(C[6]C[6]H)(H){1|Co<4>,1|C<3>,1|H<1>}	C[6](AsC[6a]C[6])(N[6]C[6]Co)(C[6]C[6]H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.2155	0.292	2	120.2155	0.085	2	120.2883	0.036	4	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	As-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[6]As)(C[6]C[6]H)(H)	C[6](AsC[6a]C[6])(N[6]C[6]Ni)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[6]As)(C[6]C[6]H)(H){1|Ni<4>,1|C<3>,1|H<1>}	C[6](AsC[6a]C[6])(N[6]C[6]Ni)(C[6]C[6]H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.3610	0.049	2	120.3610	0.002	2	120.2883	0.036	4	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	B[5]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]B[5]C[6])(C[6]N[6]C)(H)	C[6](B[5]O[5]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]B[5]C[6])(C[6]N[6]C)(H){1|C<3>,2|H<1>,2|O<2>}	C[6](B[5]O[5]2)(C[6]C[6]H)2{1|N<3>,4|C<4>}	H(C[6]C[6]2)	119.5700	0.016	2	119.6887	0.075	8	119.6887	0.075	8	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	B[5]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]B[5]C[6])(C[6]N[6]C)(H)	C[6](B[5]O[5]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]B[5]C[6])(C[6]N[6]C)(H){1|Co<4>,1|C<3>,1|H<1>,2|O<2>}	C[6](B[5]O[5]2)(C[6]C[6]H)2{1|N<3>,4|C<4>}	H(C[6]C[6]2)	119.8090	0.369	4	119.6887	0.075	8	119.6887	0.075	8	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	B[5]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]B[5]C[6])(C[6]N[6]C)(H)	C[6](B[5]O[5]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]B[5]C[6])(C[6]N[6]C)(H){1|Co<6>,1|C<3>,1|H<1>,2|O<2>}	C[6](B[5]O[5]2)(C[6]C[6]H)2{1|N<3>,4|C<4>}	H(C[6]C[6]2)	119.5670	0.054	2	119.6887	0.075	8	119.6887	0.075	8	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	B[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]B[6]C[6])(C[6]C[6]H)(H)	C[6](B[6]C[6]N[6])(C[6]B[6]C[6])(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]B[6]C[6])(C[6]C[6]H)(H){1|B<3>,1|H<1>,1|N<3>,2|C<3>}	C[6](B[6]C[6]N[6])(C[6]B[6]C[6])(C[6]C[6]H){1|N<3>,3|H<1>,5|C<3>}	H(C[6]C[6]2)	118.6565	2.020	2	118.6565	4.081	2	118.6565	4.081	2	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](CC[5a]C[5])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<2>,1|H<1>,1|O<2>}	C[6](CC[5a]C[5])(C[6]C[6]H)2{1|C<3>,1|H<1>}	H(C[6]C[6]2)	126.3970	0.000	1	126.3970	0.000	1	119.7529	6.094	11	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](CC[6a]C[5])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<2>,2|H<1>}	C[6](CC[6a]C[5])(C[6]C[6]H)2{1|C<3>,1|H<1>}	H(C[6]C[6]2)	116.6040	0.000	1	116.6040	0.000	1	119.7529	6.094	11	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](CC[5a]C[5])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](CC[5a]C[5])(C[6]C[6]H)2{1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.8327	0.160	3	119.9060	0.045	6	119.7529	6.094	11	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](CC[5a]C[5])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Hg<4>,1|C<3>,1|H<1>}	C[6](CC[5a]C[5])(C[6]C[6]H)2{1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.9793	0.264	3	119.9060	0.045	6	119.7529	6.094	11	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](CC[5a]C[5])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|H<1>,1|O<1>}	C[6](CC[5a]C[5])(C[6]C[6]H)2{1|C<3>,2|C<4>}	H(C[6]C[6]2)	118.2817	0.117	3	118.2817	0.014	3	119.7529	6.094	11	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](CC[5a]C[6a])(N[6]C[6]Ni)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<4>,1|C<3>,1|H<1>}	C[6](CC[5a]C[6a])(N[6]C[6]Ni)(C[6]C[6]H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	121.2225	0.351	2	121.2225	0.124	2	120.2793	1.237	4	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](CC[5a]C[6a])(N[6]C[6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](CC[5a]C[6a])(N[6]C[6]Pd)(C[6]C[6]H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.3360	0.171	2	119.3360	0.029	2	120.2793	1.237	4	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[4]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[4]C[6])(C[6]C[6]H)(H)	C[6](C[4]C[4]2)(C[6]C[6]H)(C[6]C[6]O)	H(C[6]C[6]2)	C[6](C[6]C[4]C[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<1>,2|C<3>}	C[6](C[4]C[4]2)(C[6]C[6]H)(C[6]C[6]O){1|Si<4>,1|C<4>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	119.2205	0.244	2	119.2205	0.060	2	119.2205	0.060	2	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5,5]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5,5]C[6])(C[6]C[6]H)(H)	C[6](C[5,5]C[5,5,6]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5,5]C[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>,2|C<4>}	C[6](C[5,5]C[5,5,6]2)(C[6]C[6]H)2{1|C<3>,4|C<4>,4|H<1>}	H(C[6]C[6]2)	119.2080	0.010	2	119.2080	0.000	2	119.2080	0.000	2	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[4x6]H)(C[6]C[5,6]C)(H)	C[6](C[5,6]C[5,3x6]C[5])(C[6]C[6]H)(CCH)	H(C[6]C[6]2)	C[6](C[6]C[4x6]H)(C[6]C[5,6]C)(H){2|C<3>,2|C<4>}	C[6](C[5,6]C[5,3x6]C[5])(C[6]C[6]H)(CCH){1|C<3>,1|H<1>,1|O<2>,3|C<4>}	H(C[6]C[6]2)	118.1730	0.000	1	118.3637	0.027	3	118.8606	0.597	8	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[4x6]H)(C[6]C[5,6]C)(H)	C[6](C[5,6]C[5,3x6]C[5])(C[6]C[6]H)(CCH)	H(C[6]C[6]2)	C[6](C[6]C[4x6]H)(C[6]C[5,6]C)(H){2|C<3>,2|C<4>}	C[6](C[5,6]C[5,3x6]C[5])(C[6]C[6]H)(CCH){1|C<3>,2|H<1>,3|C<4>}	H(C[6]C[6]2)	118.4590	0.011	2	118.3637	0.027	3	118.8606	0.597	8	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H)	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[5,6]N[5,6]C[5])(C[6]C[6]H)(COO){1|In<6>,1|C<3>,1|H<1>,1|O<1>,1|O<2>}	H(C[6]C[6]2)	120.0630	0.007	2	120.0630	0.000	2	118.8606	0.597	8	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H)	C[6](C[5,6]N[5,6]N[5])(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[5,6]N[5,6]N[5])(C[6]C[6]H)(COO){1|Co<6>,1|C<3>,1|H<1>,2|N<2>}	H(C[6]C[6]2)	118.1780	0.000	1	118.4755	0.177	2	118.8606	0.597	8	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H)	C[6](C[5,6]N[5,6]N[5])(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[5,6]N[5,6]N[5])(C[6]C[6]H)(COO){1|Mn<6>,1|C<3>,1|H<1>,2|N<2>}	H(C[6]C[6]2)	118.7730	0.000	1	118.4755	0.177	2	118.8606	0.597	8	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[6]N)(H)	C[6](C[5,6]N[5,6]N[5])(C[6]C[6]H)(CC[6a]O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[6]N)(H){1|C<3>,1|H<1>,2|N<3>}	C[6](C[5,6]N[5,6]N[5])(C[6]C[6]H)(CC[6a]O){1|H<1>,1|N<3>,3|C<4>}	H(C[6]C[6]2)	118.7170	0.000	1	118.7170	0.000	1	118.8606	0.597	8	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[5,6]N)(C[6]C[6]C)(H)	C[6](C[5,6]N[5,6]N[5])(C[6]C[6]H)(NOO)	H(C[6]C[6]2)	C[6](C[6]C[5,6]N)(C[6]C[6]C)(H){1|H<1>,2|N<3>}	C[6](C[5,6]N[5,6]N[5])(C[6]C[6]H)(NOO){2|C<3>,3|C<4>}	H(C[6]C[6]2)	119.8780	0.000	1	119.8780	0.000	1	119.3400	0.253	5	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[5,6]N)(C[6]C[6]C)(H)	C[6](C[5,6]N[5,6]O[5])(C[6]C[6]H)(NOO)	H(C[6]C[6]2)	C[6](C[6]C[5,6]N)(C[6]C[6]C)(H){1|H<1>,1|N<3>,1|O<2>}	C[6](C[5,6]N[5,6]O[5])(C[6]C[6]H)(NOO){1|Si<5>,1|C<3>,2|C<4>}	H(C[6]C[6]2)	119.2055	0.465	4	119.2055	0.216	4	119.3400	0.253	5	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5,6]C[6a])(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]P[5])(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C[6a])(C[6]C[6]H)(H){1|P<4>,2|H<1>,3|C<3>}	C[6](C[5,6]C[5,6]P[5])(C[6a]C[6a]2)(C[6]C[6]H){1|Pd<4>,1|H<1>,2|C<3>,3|C<4>,3|O<2>}	H(C[6]C[6]2)	118.2400	0.000	1	118.2400	0.000	1	118.1405	0.020	2	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5,6]C[6a])(C[6]C[6]O)(H)	C[6](C[5,6]C[5,6]N[5])(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C[6a])(C[6]C[6]O)(H){1|N<2>,4|C<3>}	C[6](C[5,6]C[5,6]N[5])(C[6a]C[6a]2)(C[6]C[6]H){1|C<4>,1|O<1>,1|O<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	118.0410	0.000	1	118.0410	0.000	1	118.1405	0.020	2	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6]C)(H)	C[6](C[5]C[5,6a]C[5,5])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6]C)(H){1|C<4>,1|H<1>,1|O<1>,2|C<3>}	C[6](C[5]C[5,6a]C[5,5])(C[6]C[6]H)2{2|C<4>,2|O<2>,4|C<3>}	H(C[6]C[6]2)	118.3775	0.316	2	118.3775	0.100	2	119.7847	0.924	206	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6]C)(H)	C[6](C[5]C[5,6a]C[5,6])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6]C)(H){1|C<4>,1|H<1>,1|O<1>,2|C<3>}	C[6](C[5]C[5,6a]C[5,6])(C[6]C[6]H)2{1|O<2>,2|C<4>,5|C<3>}	H(C[6]C[6]2)	117.9355	0.821	2	117.9355	0.674	2	119.7847	0.924	206	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6]C)(H)	C[6](C[5]C[5,6a]C[5])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6]C)(H){1|C<4>,1|H<1>,1|O<1>,2|C<3>}	C[6](C[5]C[5,6a]C[5])(C[6]C[6]H)2{1|O<2>,2|C<4>,5|C<3>}	H(C[6]C[6]2)	118.3580	0.511	2	118.3580	0.261	2	119.7847	0.924	206	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6]C)(H)	C[6](C[5]C[5]N[5])(C[6]C[6]H)(C[6]C[6]O)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6]C)(H){1|H<1>,1|N<3>,1|O<1>,2|C<3>}	C[6](C[5]C[5]N[5])(C[6]C[6]H)(C[6]C[6]O){1|C<3>,1|H<1>,1|N<2>,1|N<3>,3|C<4>}	H(C[6]C[6]2)	119.2040	0.000	1	119.2040	0.000	1	119.7847	0.924	206	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6]C)(H)	C[6](C[5]C[5]N[5])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6]C)(H){1|H<1>,1|N<2>,1|O<1>,2|C<3>}	C[6](C[5]C[5]N[5])(C[6]C[6]H)2{1|N<2>,2|C<4>,3|C<3>}	H(C[6]C[6]2)	118.8175	0.088	2	118.8175	0.008	2	119.7847	0.924	206	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[5]C[5]2)(C[6]C[6]H)(C[6]N[6]H){1|Cd<6>,1|C<3>,2|N<2>,3|H<1>}	H(C[6]C[6]2)	121.0535	0.216	2	121.0535	0.047	2	119.7847	0.924	206	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]N[5])(C[6]C[6]H)(C[6]C[6]O)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|O<1>,2|C<3>}	C[6](C[5]C[5]N[5])(C[6]C[6]H)(C[6]C[6]O){1|O<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.6520	0.000	1	119.6520	0.000	1	119.7847	0.924	206	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]N[5])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H){1|C<3>,1|N<3>,2|C<4>,2|H<1>}	C[6](C[5]C[5]N[5])(C[6]C[6]H)2{2|H<1>,6|C<4>}	H(C[6]C[6]2)	118.1470	0.134	2	118.1470	0.018	2	119.7847	0.924	206	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H)	C[6](C[5]N[5]2)(C[6]C[6]H)(C[6]C[6]O)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>,2|N<3>}	C[6](C[5]N[5]2)(C[6]C[6]H)(C[6]C[6]O){1|C<3>,2|C<4>,4|H<1>}	H(C[6]C[6]2)	119.1893	0.187	3	119.1893	0.035	3	119.7847	0.924	206	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H)	C[6](C[5]N[5]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>,2|N<2>}	C[6](C[5]N[5]2)(C[6]C[6]H)(C[6]N[6]H){1|Co<6>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.0590	0.000	1	120.5793	1.862	16	119.7847	0.924	206	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H)	C[6](C[5]N[5]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H){1|N<2>,2|H<1>,2|N<3>}	C[6](C[5]N[5]2)(C[6]C[6]H)(C[6]N[6]H){2|C<3>,2|H<1>,2|N<3>}	H(C[6]C[6]2)	119.9540	0.000	1	120.5793	1.862	16	119.7847	0.924	206	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H)	C[6](C[5]N[5]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H){1|N<3>,2|H<1>,2|N<2>}	C[6](C[5]N[5]2)(C[6]C[6]H)(C[6]N[6]H){1|C<3>,2|H<1>,2|N<2>}	H(C[6]C[6]2)	119.8665	0.182	4	120.5793	1.862	16	119.7847	0.924	206	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H)	C[6](C[5]N[5]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H){1|N<3>,2|H<1>,2|N<2>}	C[6](C[5]N[5]2)(C[6]C[6]H)(C[6]N[6]H){1|Mn<6>,1|C<3>,1|H<1>,2|N<2>}	H(C[6]C[6]2)	120.6820	0.000	1	120.5793	1.862	16	119.7847	0.924	206	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H)	C[6](C[5]N[5]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H){1|N<3>,2|H<1>,2|N<2>}	C[6](C[5]N[5]2)(C[6]C[6]H)(C[6]N[6]H){1|Ni<6>,1|H<1>,1|N<2>,2|C<3>}	H(C[6]C[6]2)	120.4250	0.000	1	120.5793	1.862	16	119.7847	0.924	206	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H)	C[6](C[5]N[5]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H){2|H<1>,3|N<3>}	C[6](C[5]N[5]2)(C[6]C[6]H)(C[6]N[6]H){1|Mn<6>,1|C<3>,1|H<1>,1|O<1>,1|O<2>,2|C<4>}	H(C[6]C[6]2)	123.7825	1.610	2	120.5793	1.862	16	119.7847	0.924	206	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H)	C[6](C[5]N[5]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H){2|H<1>,3|N<3>}	C[6](C[5]N[5]2)(C[6]C[6]H)(C[6]N[6]H){3|C<3>,4|H<1>}	H(C[6]C[6]2)	119.9900	0.332	4	120.5793	1.862	16	119.7847	0.924	206	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H)	C[6](C[5]N[5]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H){2|H<1>,3|N<3>}	C[6](C[5]N[5]2)(C[6]C[6]H)(C[6]N[6]H){3|Rh<8>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.5785	0.514	2	120.5793	1.862	16	119.7847	0.924	206	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H)	C[6](C[5]N[5]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H){1|C<2>,1|N<2>,1|N<3>,2|H<1>}	C[6](C[5]N[5]2)(C[6]C[6]H)2{1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	122.0420	0.000	1	120.2500	1.019	5	119.7847	0.924	206	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H)	C[6](C[5]N[5]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[5]N[5]2)(C[6]C[6]H)2{1|C<2>,1|C<3>,1|C<4>,1|O<2>,2|H<1>}	H(C[6]C[6]2)	119.7000	0.141	2	120.2500	1.019	5	119.7847	0.924	206	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H)	C[6](C[5]N[5]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>,2|N<3>}	C[6](C[5]N[5]2)(C[6]C[6]H)2{1|C<3>,1|N<3>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	119.9040	0.037	2	120.2500	1.019	5	119.7847	0.924	206	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H)	C[6](C[5]S[5]2)(C[6]C[6]H)(C[6]O[6]O)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>,1|O<2>,2|S<2>}	C[6](C[5]S[5]2)(C[6]C[6]H)(C[6]O[6]O){1|H<1>,3|C<4>}	H(C[6]C[6]2)	118.8040	0.042	2	118.8040	0.002	2	119.7847	0.924	206	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6]N)(H)	C[6](C[5]N[5]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|N<2>,1|N<3>,1|O<1>}	C[6](C[5]N[5]2)(C[6]C[6]H)2{1|C<3>,1|H<1>,1|N<2>,3|N<3>}	H(C[6]C[6]2)	119.3315	0.163	2	119.4557	0.032	4	119.7847	0.924	206	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6]N)(H)	C[6](C[5]N[5]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<1>,2|N<3>}	C[6](C[5]N[5]2)(C[6]C[6]H)2{1|C<3>,1|N<3>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	119.5800	0.079	2	119.4557	0.032	4	119.7847	0.924	206	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6]O)(H)	C[6](C[5]S[5]2)(C[6]C[6]H)(C[6]C[6]O)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|O<1>,2|S<2>}	C[6](C[5]S[5]2)(C[6]C[6]H)(C[6]C[6]O){1|H<1>,1|O<2>,3|C<3>}	H(C[6]C[6]2)	116.7560	0.000	1	116.7560	0.000	1	119.7847	0.924	206	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]N[6]C)(H)	C[6](C[5]C[5]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]N[6]C)(H){1|C<4>,1|H<1>,3|C<3>}	C[6](C[5]C[5]2)(C[6]C[6]H)2{1|N<3>,2|C<3>,2|C<4>,2|O<1>}	H(C[6]C[6]2)	118.8745	0.181	6	118.8745	0.033	6	119.7847	0.924	206	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]N[6]C)(H)	C[6](C[5]N[5]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]N[6]C)(H){1|C<3>,1|C<4>,1|H<1>,2|N<3>}	C[6](C[5]N[5]2)(C[6]C[6]H)2{1|N<3>,2|C<4>,4|C<3>}	H(C[6]C[6]2)	118.3475	0.127	4	118.3475	0.016	4	119.7847	0.924	206	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H)	C[6](C[5]C[5]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H){2|H<1>,3|C<3>}	C[6](C[5]C[5]2)(C[6]C[6]H)2{1|N<3>,2|C<3>,2|H<1>,2|O<1>}	H(C[6]C[6]2)	119.5980	0.000	1	119.9957	0.098	7	119.7847	0.924	206	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H)	C[6](C[5]C[5]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H){2|H<1>,3|C<3>}	C[6](C[5]C[5]2)(C[6]C[6]H)2{3|N<3>,4|H<1>}	H(C[6]C[6]2)	120.0620	0.284	6	119.9957	0.098	7	119.7847	0.924	206	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H)	C[6](C[5]C[5]O[5])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H){1|H<1>,1|O<2>,3|C<3>}	C[6](C[5]C[5]O[5])(C[6]C[6]H)2{1|C<4>,1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.0385	0.043	2	119.0385	0.002	2	119.7847	0.924	206	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H)	C[6](C[5]C[5]S[5])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H){1|Ni<6>,1|H<1>,1|S<2>,2|C<3>}	C[6](C[5]C[5]S[5])(C[6]C[6]H)2{1|C<3>,1|N<3>,1|S<2>,3|H<1>}	H(C[6]C[6]2)	119.9435	0.463	2	120.0937	0.252	26	119.7847	0.924	206	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H)	C[6](C[5]C[5]S[5])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H){1|Pd<4>,1|H<1>,1|S<2>,2|C<3>}	C[6](C[5]C[5]S[5])(C[6]C[6]H)2{1|N<3>,1|S<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1226	0.548	18	120.0937	0.252	26	119.7847	0.924	206	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H)	C[6](C[5]C[5]S[5])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H){1|S<2>,2|C<3>,2|H<1>}	C[6](C[5]C[5]S[5])(C[6]C[6]H)2{1|C<3>,1|N<3>,1|S<2>,3|H<1>}	H(C[6]C[6]2)	120.0572	0.426	6	120.0937	0.252	26	119.7847	0.924	206	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H)	C[6](C[5]N[5]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>,2|N<2>}	C[6](C[5]N[5]2)(C[6]C[6]H)2{1|N<3>,2|H<1>,2|N<2>}	H(C[6]C[6]2)	120.0658	0.204	30	120.2295	0.269	86	119.7847	0.924	206	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H)	C[6](C[5]N[5]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>,2|N<3>}	C[6](C[5]N[5]2)(C[6]C[6]H)2{1|N<3>,2|C<4>,2|H<1>,2|O<1>}	H(C[6]C[6]2)	119.9518	0.536	6	120.2295	0.269	86	119.7847	0.924	206	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H)	C[6](C[5]N[5]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<1>,2|N<3>}	C[6](C[5]N[5]2)(C[6]C[6]H)2{1|N<3>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	121.7460	0.192	2	120.2295	0.269	86	119.7847	0.924	206	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H)	C[6](C[5]N[5]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H){1|C<3>,1|N<2>,1|N<3>,2|H<1>}	C[6](C[5]N[5]2)(C[6]C[6]H)2{1|C<3>,2|H<1>,3|N<3>}	H(C[6]C[6]2)	120.3120	0.098	2	120.2295	0.269	86	119.7847	0.924	206	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H)	C[6](C[5]N[5]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H){1|C<3>,2|H<1>,2|N<2>}	C[6](C[5]N[5]2)(C[6]C[6]H)2{1|N<3>,2|H<1>,2|N<2>}	H(C[6]C[6]2)	119.9505	0.340	2	120.2295	0.269	86	119.7847	0.924	206	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H)	C[6](C[5]N[5]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H){1|C<3>,2|H<1>,2|N<3>}	C[6](C[5]N[5]2)(C[6]C[6]H)2{1|C<4>,1|N<3>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	120.2210	0.346	2	120.2295	0.269	86	119.7847	0.924	206	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H)	C[6](C[5]N[5]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H){1|C<3>,2|H<1>,2|N<3>}	C[6](C[5]N[5]2)(C[6]C[6]H)2{1|N<3>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	120.3550	0.432	8	120.2295	0.269	86	119.7847	0.924	206	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H)	C[6](C[5]N[5]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H){1|C<3>,2|H<1>,2|N<3>}	C[6](C[5]N[5]2)(C[6]C[6]H)2{1|N<3>,2|C<4>,2|H<1>,2|O<1>}	H(C[6]C[6]2)	120.3945	0.217	2	120.2295	0.269	86	119.7847	0.924	206	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H)	C[6](C[5]N[5]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H){1|Cd<6>,1|C<3>,1|H<1>,2|N<2>}	C[6](C[5]N[5]2)(C[6]C[6]H)2{1|C<3>,1|N<2>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.0045	0.275	2	120.2295	0.269	86	119.7847	0.924	206	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H)	C[6](C[5]N[5]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H){1|Cd<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](C[5]N[5]2)(C[6]C[6]H)2{1|N<3>,2|C<4>,2|H<1>,2|O<1>}	H(C[6]C[6]2)	120.7032	0.663	4	120.2295	0.269	86	119.7847	0.924	206	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H)	C[6](C[5]N[5]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>,2|N<2>}	C[6](C[5]N[5]2)(C[6]C[6]H)2{1|C<3>,1|N<2>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.6015	1.800	2	120.2295	0.269	86	119.7847	0.924	206	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H)	C[6](C[5]N[5]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>,2|N<2>}	C[6](C[5]N[5]2)(C[6]C[6]H)2{1|N<3>,2|H<1>,2|N<2>}	H(C[6]C[6]2)	120.0905	0.025	2	120.2295	0.269	86	119.7847	0.924	206	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H)	C[6](C[5]N[5]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](C[5]N[5]2)(C[6]C[6]H)2{1|N<3>,2|C<4>,2|H<1>,2|O<1>}	H(C[6]C[6]2)	120.3070	0.137	4	120.2295	0.269	86	119.7847	0.924	206	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H)	C[6](C[5]N[5]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>,2|N<3>}	C[6](C[5]N[5]2)(C[6]C[6]H)2{1|N<3>,2|C<4>,2|H<1>,2|O<1>}	H(C[6]C[6]2)	120.6555	0.227	2	120.2295	0.269	86	119.7847	0.924	206	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H)	C[6](C[5]N[5]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](C[5]N[5]2)(C[6]C[6]H)2{1|N<3>,2|C<4>,2|H<1>,2|O<1>}	H(C[6]C[6]2)	119.9005	1.877	2	120.2295	0.269	86	119.7847	0.924	206	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H)	C[6](C[5]N[5]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>,2|N<2>}	C[6](C[5]N[5]2)(C[6]C[6]H)2{1|C<3>,1|N<2>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.9930	0.137	2	120.2295	0.269	86	119.7847	0.924	206	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H)	C[6](C[5]N[5]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](C[5]N[5]2)(C[6]C[6]H)2{1|N<3>,2|C<4>,2|H<1>,2|O<1>}	H(C[6]C[6]2)	120.3065	0.286	2	120.2295	0.269	86	119.7847	0.924	206	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H)	C[6](C[5]N[5]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>,2|N<3>}	C[6](C[5]N[5]2)(C[6]C[6]H)2{1|N<3>,2|C<4>,2|H<1>,2|O<1>}	H(C[6]C[6]2)	120.3905	0.274	2	120.2295	0.269	86	119.7847	0.924	206	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H)	C[6](C[5]N[5]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H){1|Zn<4>,1|C<3>,1|H<1>,2|N<3>}	C[6](C[5]N[5]2)(C[6]C[6]H)2{1|N<3>,2|C<4>,2|H<1>,2|O<1>}	H(C[6]C[6]2)	120.3950	0.322	2	120.2295	0.269	86	119.7847	0.924	206	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H)	C[6](C[5]N[5]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H){1|Zn<6>,1|C<3>,1|H<1>,2|N<2>}	C[6](C[5]N[5]2)(C[6]C[6]H)2{1|N<3>,2|H<1>,2|N<2>}	H(C[6]C[6]2)	120.2230	0.024	2	120.2295	0.269	86	119.7847	0.924	206	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H)	C[6](C[5]N[5]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H){1|Zn<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](C[5]N[5]2)(C[6]C[6]H)2{1|N<3>,2|C<4>,2|H<1>,2|O<1>}	H(C[6]C[6]2)	120.6997	0.297	4	120.2295	0.269	86	119.7847	0.924	206	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]O[6]C)(H)	C[6](C[5]C[5]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]O[6]C)(H){1|H<1>,3|C<3>}	C[6](C[5]C[5]2)(C[6]C[6]H)2{1|O<2>,2|C<3>,2|C<4>,2|O<1>}	H(C[6]C[6]2)	119.1295	0.040	2	119.1295	0.002	2	119.7847	0.924	206	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]O[6]C)(H)	C[6](C[5]C[5]N[5])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]O[6]C)(H){1|C<3>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[5]C[5]N[5])(C[6]C[6]H)2{1|C<3>,1|O<2>,6|C<4>}	H(C[6]C[6]2)	118.3290	0.000	1	118.3290	0.000	1	119.7847	0.924	206	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]O[6]C)(H)	C[6](C[5]N[5]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]O[6]C)(H){1|C<3>,1|H<1>,2|N<3>}	C[6](C[5]N[5]2)(C[6]C[6]H)2{1|O<2>,2|C<4>,4|C<3>}	H(C[6]C[6]2)	118.8208	0.244	11	118.8208	0.059	11	119.7847	0.924	206	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]O[6]H)(H)	C[6](C[5]S[5]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]O[6]H)(H){1|C<3>,1|H<1>,2|S<2>}	C[6](C[5]S[5]2)(C[6]C[6]H)2{1|O<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.4450	0.085	2	119.4450	0.007	2	119.7847	0.924	206	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]S[6]H)(H)	C[6](C[5]S[5]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]S[6]H)(H){1|C<3>,1|H<1>,2|S<2>}	C[6](C[5]S[5]2)(C[6]C[6]H)2{1|S<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	117.7090	1.102	2	117.7090	1.214	2	119.7847	0.924	206	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])2(H)	C[6](C[5]C[5]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])2(H){1|C<2>,2|H<1>,4|C<3>}	C[6](C[5]C[5]2)(C[6]C[6]H)2{2|H<1>,4|C<3>}	H(C[6]C[6]2)	118.8885	0.026	2	118.8885	0.001	2	119.7847	0.924	206	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])2(H)	C[6](C[5]N[5]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])2(H){2|H<1>,5|N<3>}	C[6](C[5]N[5]2)(C[6]C[6]H)(C[6]N[6]H){2|C<3>,2|O<1>,3|C<4>}	H(C[6]C[6]2)	120.4625	0.183	2	120.4625	0.034	2	119.7847	0.924	206	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[5]C[6])(H)	C[6](C[5]C[5]N[5])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[5]C[6])(H){1|C<4>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[5]C[5]N[5])(C[6]C[6]H)2{1|N<3>,3|C<3>,4|C<4>}	H(C[6]C[6]2)	118.9845	0.013	2	118.9845	0.000	2	119.7847	0.924	206	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]O[6])(C[6]C[5]C[6])(H)	C[6](C[5]C[5,6]N[5])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]O[6])(C[6]C[5]C[6])(H){1|C<4>,1|H<1>,1|N<3>,3|C<3>}	C[6](C[5]C[5,6]N[5])(C[6]C[6]H)2{1|O<2>,3|C<3>,4|C<4>}	H(C[6]C[6]2)	117.7475	0.589	2	117.7475	0.347	2	119.7847	0.924	206	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]O[6])(C[6]C[5]C[6])(H)	C[6](C[5]C[5]N[5])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]O[6])(C[6]C[5]C[6])(H){1|C<4>,1|H<1>,1|N<3>,3|C<3>}	C[6](C[5]C[5]N[5])(C[6]C[6]H)2{1|O<2>,3|C<3>,4|C<4>}	H(C[6]C[6]2)	118.3865	0.032	2	118.3865	0.001	2	119.7847	0.924	206	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]O[6])(C[6]C[5]C[6])(H)	C[6](C[5]N[5]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]O[6])(C[6]C[5]C[6])(H){1|H<1>,2|N<3>,3|C<3>}	C[6](C[5]N[5]2)(C[6]C[6]H)2{1|O<2>,2|C<4>,4|C<3>}	H(C[6]C[6]2)	118.7115	0.182	2	118.7115	0.033	2	119.7847	0.924	206	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5,6a]C[5])(C[6]C[6]H)(N[6]C[6]C)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,3|C<3>}	C[6](C[5]C[5,6a]C[5])(C[6]C[6]H)(N[6]C[6]C){1|O<1>,1|O<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.0170	0.000	1	119.0170	0.000	1	119.2738	1.774	13	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5,6a]C[5])(C[6]C[6]H)(N[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){2|H<1>,3|C<3>}	C[6](C[5]C[5,6a]C[5])(C[6]C[6]H)(N[6]C[6]H){1|Pt<4>,1|H<1>,2|C<4>,3|C<3>}	H(C[6]C[6]2)	119.7830	0.000	1	119.7830	0.000	1	119.2738	1.774	13	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]N[5])(C[6]C[6]H)(N[6]C[6]C)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<2>,2|C<3>}	C[6](C[5]C[5]N[5])(C[6]C[6]H)(N[6]C[6]C){1|C<3>,2|N<3>,3|H<1>}	H(C[6]C[6]2)	119.9320	0.000	1	119.7553	0.026	3	119.2738	1.774	13	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]N[5])(C[6]C[6]H)(N[6]C[6]C)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5]C[5]N[5])(C[6]C[6]H)(N[6]C[6]C){1|Ir<8>,1|C<3>,1|C<4>,1|N<2>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.6670	0.066	2	119.7553	0.026	3	119.2738	1.774	13	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]N[5])(C[6]C[6]H)(N[6]C[6]V)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|V<6>,2|C<3>}	C[6](C[5]C[5]N[5])(C[6]C[6]H)(N[6]C[6]V){1|Cl<1>,1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5990	0.000	1	120.6245	0.001	2	119.2738	1.774	13	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]N[5])(C[6]C[6]H)(N[6]C[6]V)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|V<7>,2|C<3>}	C[6](C[5]C[5]N[5])(C[6]C[6]H)(N[6]C[6]V){1|N<3>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	120.6500	0.000	1	120.6245	0.001	2	119.2738	1.774	13	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]N[5]2)(C[6]C[6]H)(N[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|C<3>,2|H<1>,2|N<3>}	C[6](C[5]N[5]2)(C[6]C[6]H)(N[6]C[6]H){3|C<3>,4|H<1>}	H(C[6]C[6]2)	120.3870	0.000	1	120.3870	0.000	1	119.2738	1.774	13	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]N[5]2)(C[6]C[6]H)(N[6]C[6]O)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>,2|N<3>}	C[6](C[5]N[5]2)(C[6]C[6]H)(N[6]C[6]O){1|C<3>,2|C<4>,2|H<1>,2|O<1>}	H(C[6]C[6]2)	117.4765	2.692	2	117.7923	3.923	3	119.2738	1.774	13	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]N[5]2)(C[6]C[6]H)(N[6]C[6]O)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>,2|N<3>}	C[6](C[5]N[5]2)(C[6]C[6]H)(N[6]C[6]O){1|H<1>,2|C<3>,2|C<4>,2|O<1>}	H(C[6]C[6]2)	118.4240	0.000	1	117.7923	3.923	3	119.2738	1.774	13	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[5]N[6])(H)	C[6](C[5]C[5]2)(C[6]C[6]H)(N[6]C[6]N)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[5]N[6])(H){1|C<2>,1|N<3>,5|C<3>}	C[6](C[5]C[5]2)(C[6]C[6]H)(N[6]C[6]N){1|C<4>,1|N<2>,1|O<1>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	118.7400	0.573	2	118.7400	0.328	2	119.2738	1.774	13	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6,6]H)(H)	C[6](C[5]C[5]S[5])(N[6]C[6,6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6,6]H)(H){1|Ru<5>,1|S<3>,3|C<3>}	C[6](C[5]C[5]S[5])(N[6]C[6,6]Ru)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.4090	0.000	1	120.4090	0.000	1	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6,6]H)(H)	C[6](C[5]N[5]S[5])(N[6]C[6,6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6,6]H)(H){1|Ru<5>,1|N<3>,1|S<2>,2|C<3>}	C[6](C[5]N[5]S[5])(N[6]C[6,6]Ru)(C[6]C[6]H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.3930	0.320	3	120.3930	0.103	3	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H)	C[6](C[5]C[5,6a]C[5])(N[6]C[6,6a]H)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H){1|H<1>,4|C<3>}	C[6](C[5]C[5,6a]C[5])(N[6]C[6,6a]H)(C[6]C[6]H){1|H<1>,1|O<1>,1|O<2>,4|C<3>}	H(C[6]C[6]2)	119.5590	0.000	1	119.5590	0.000	1	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]C)(H)	C[6](C[5]C[5]N[5])(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]C)(H){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5]C[5]N[5])(N[6]C[6]Fe)(C[6]C[6]H){1|H<1>,1|N<2>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	119.6435	1.292	2	119.6435	1.669	2	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]C)(H)	C[6](C[5]N[5]S[5])(N[6]C[6]Re)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]C)(H){1|Re<6>,1|C<3>,1|H<1>,1|N<3>,1|S<2>}	C[6](C[5]N[5]S[5])(N[6]C[6]Re)(C[6]C[6]H){5|C<3>}	H(C[6]C[6]2)	119.4230	0.000	1	119.4230	0.000	1	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5,6]N[5])(N[6]C[6]Co)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Co<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5]C[5,6]N[5])(N[6]C[6]Co)(C[6]C[6]H){1|N<2>,1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3570	0.000	1	120.2020	0.028	3	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5,6]N[5])(N[6]C[6]Co)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Co<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5]C[5,6]N[5])(N[6]C[6]Co)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.1245	0.142	2	120.2020	0.028	3	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5,6]N[5])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5]C[5,6]N[5])(N[6]C[6]Cu)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.1760	0.219	2	120.1760	0.048	2	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5,6]N[5])(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5]C[5,6]N[5])(N[6]C[6]Fe)(C[6]C[6]H){1|N<2>,1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3610	0.114	3	120.3800	0.010	4	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5,6]N[5])(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5]C[5,6]N[5])(N[6]C[6]Fe)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.4370	0.000	1	120.3800	0.010	4	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5,6]N[5])(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5]C[5,6]N[5])(N[6]C[6]Pt)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.2885	0.504	2	120.2885	0.254	2	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5,6]N[5])(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ru<9>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5]C[5,6]N[5])(N[6]C[6]Ru)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.3135	0.153	2	120.3135	0.024	2	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5,6]P[5])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|H<1>,1|P<4>,2|C<3>}	C[6](C[5]C[5,6]P[5])(N[6]C[6]Cu)(C[6]C[6]H){1|C<4>,1|S<3>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.1871	0.490	11	120.2080	0.167	16	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5,6]P[5])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|H<1>,1|P<4>,2|C<3>}	C[6](C[5]C[5,6]P[5])(N[6]C[6]Cu)(C[6]C[6]H){1|Cu<4>,1|C<4>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.4200	0.000	1	120.2080	0.167	16	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5,6]P[5])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|H<1>,1|P<5>,2|C<3>}	C[6](C[5]C[5,6]P[5])(N[6]C[6]Cu)(C[6]C[6]H){1|Cu<4>,1|C<4>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.2125	0.130	4	120.2080	0.167	16	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5,6]P[5])(N[6]C[6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,1|P<4>,2|C<3>}	C[6](C[5]C[5,6]P[5])(N[6]C[6]Pd)(C[6]C[6]H){2|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.3850	0.000	1	120.3850	0.000	1	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5,6]P[5])(N[6]C[6]Re)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Re<6>,1|H<1>,1|P<4>,2|C<3>}	C[6](C[5]C[5,6]P[5])(N[6]C[6]Re)(C[6]C[6]H){1|C<4>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.7620	0.173	2	119.7620	0.030	2	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5,6a]C[5])(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ru<5>,1|H<1>,3|C<3>}	C[6](C[5]C[5,6a]C[5])(N[6]C[6]Ru)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.8050	0.000	1	120.1000	0.153	6	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5,6a]C[5])(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|H<1>,3|C<3>}	C[6](C[5]C[5,6a]C[5])(N[6]C[6]Ru)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.9310	0.280	3	120.1000	0.153	6	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5,6a]C[5])(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|H<1>,3|C<3>}	C[6](C[5]C[5,6a]C[5])(N[6]C[6]Ru)(C[6]C[6]H){1|Ru<8>,1|C<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.0660	0.000	1	120.1000	0.153	6	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5,6a]C[5])(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|H<1>,3|C<3>}	C[6](C[5]C[5,6a]C[5])(N[6]C[6]Ru)(C[6]C[6]H){2|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.9360	0.000	1	120.1000	0.153	6	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]N[5])(N[6]C[6]Ag)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ag<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5]C[5]N[5])(N[6]C[6]Ag)(C[6]C[6]H){1|N<3>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	120.2809	0.182	10	120.3662	0.085	12	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]N[5])(N[6]C[6]Ag)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ag<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5]C[5]N[5])(N[6]C[6]Ag)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.7925	0.455	2	120.3662	0.085	12	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]N[5])(N[6]C[6]Cd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cd<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5]C[5]N[5])(N[6]C[6]Cd)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.3995	0.135	2	120.3629	0.063	10	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]N[5])(N[6]C[6]Cd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cd<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5]C[5]N[5])(N[6]C[6]Cd)(C[6]C[6]H){1|N<3>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.7990	0.000	1	120.3629	0.063	10	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]N[5])(N[6]C[6]Cd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cd<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5]C[5]N[5])(N[6]C[6]Cd)(C[6]C[6]H){1|N<3>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	120.4330	0.181	7	120.3629	0.063	10	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]N[5])(N[6]C[6]Co)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Co<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5]C[5]N[5])(N[6]C[6]Co)(C[6]C[6]H){1|C<3>,1|N<2>,1|N<3>,3|H<1>}	H(C[6]C[6]2)	120.7720	0.000	1	120.4196	0.169	8	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]N[5])(N[6]C[6]Co)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Co<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5]C[5]N[5])(N[6]C[6]Co)(C[6]C[6]H){1|N<2>,2|C<3>,2|H<1>,2|O<2>}	H(C[6]C[6]2)	120.6540	0.153	2	120.4196	0.169	8	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]N[5])(N[6]C[6]Co)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Co<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5]C[5]N[5])(N[6]C[6]Co)(C[6]C[6]H){1|N<3>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	120.2025	0.494	4	120.4196	0.169	8	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]N[5])(N[6]C[6]Co)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Co<8>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5]C[5]N[5])(N[6]C[6]Co)(C[6]C[6]H){1|N<3>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	120.4670	0.000	1	120.4196	0.169	8	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]N[5])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5]C[5]N[5])(N[6]C[6]Cu)(C[6]C[6]H){1|C<3>,1|N<2>,1|N<3>,3|H<1>}	H(C[6]C[6]2)	120.5107	0.293	3	120.5441	0.402	52	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]N[5])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5]C[5]N[5])(N[6]C[6]Cu)(C[6]C[6]H){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.8037	0.253	11	120.5441	0.402	52	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]N[5])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5]C[5]N[5])(N[6]C[6]Cu)(C[6]C[6]H){1|N<3>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	120.2340	0.741	10	120.5441	0.402	52	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]N[5])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<5>,1|C<2>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[5]C[5]N[5])(N[6]C[6]Cu)(C[6]C[6]H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	123.6920	0.000	1	120.5441	0.402	52	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]N[5])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5]C[5]N[5])(N[6]C[6]Cu)(C[6]C[6]H){1|C<3>,1|N<2>,1|N<3>,3|H<1>}	H(C[6]C[6]2)	120.6475	0.302	4	120.5441	0.402	52	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]N[5])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5]C[5]N[5])(N[6]C[6]Cu)(C[6]C[6]H){1|N<3>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	120.3723	0.350	18	120.5441	0.402	52	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]N[5])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5]C[5]N[5])(N[6]C[6]Cu)(C[6]C[6]H){1|S<2>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	120.5460	0.274	2	120.5441	0.402	52	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]N[5])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5]C[5]N[5])(N[6]C[6]Cu)(C[6]C[6]H){1|C<3>,1|N<2>,1|N<3>,3|H<1>}	H(C[6]C[6]2)	120.5020	0.231	3	120.5441	0.402	52	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]N[5])(N[6]C[6]Eu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Eu<13>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5]C[5]N[5])(N[6]C[6]Eu)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.7562	0.234	4	120.7562	0.055	4	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]N[5])(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<4>,1|H<1>,1|N<2>,2|C<3>}	C[6](C[5]C[5]N[5])(N[6]C[6]Fe)(C[6]C[6]H){1|C<4>,1|H<1>,4|C<3>}	H(C[6]C[6]2)	120.4700	0.000	1	120.6726	0.591	167	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]N[5])(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5]C[5]N[5])(N[6]C[6]Fe)(C[6]C[6]H){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.9012	0.092	9	120.6726	0.591	167	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]N[5])(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5]C[5]N[5])(N[6]C[6]Fe)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.6885	0.309	11	120.6726	0.591	167	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]N[5])(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5]C[5]N[5])(N[6]C[6]Fe)(C[6]C[6]H){1|C<3>,1|N<2>,1|N<3>,3|H<1>}	H(C[6]C[6]2)	120.6987	0.221	6	120.6726	0.591	167	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]N[5])(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5]C[5]N[5])(N[6]C[6]Fe)(C[6]C[6]H){1|N<3>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	119.9519	1.946	18	120.6726	0.591	167	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]N[5])(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5]C[5]N[5])(N[6]C[6]Fe)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.7359	0.368	110	120.6726	0.591	167	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]N[5])(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5]C[5]N[5])(N[6]C[6]Fe)(C[6]C[6]H){1|S<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.6800	0.175	4	120.6726	0.591	167	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]N[5])(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5]C[5]N[5])(N[6]C[6]Fe)(C[6]C[6]H){2|C<3>,2|H<1>,2|N<3>}	H(C[6]C[6]2)	121.1475	0.885	8	120.6726	0.591	167	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]N[5])(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5]C[5]N[5])(N[6]C[6]Ir)(C[6]C[6]H){1|C<3>,1|N<2>,1|N<3>,3|H<1>}	H(C[6]C[6]2)	120.5383	0.128	7	120.4088	0.344	34	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]N[5])(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5]C[5]N[5])(N[6]C[6]Ir)(C[6]C[6]H){1|N<3>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	120.2944	0.767	18	120.4088	0.344	34	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]N[5])(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5]C[5]N[5])(N[6]C[6]Ir)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.3870	0.518	3	120.4088	0.344	34	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]N[5])(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ir<8>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5]C[5]N[5])(N[6]C[6]Ir)(C[6]C[6]H){1|C<3>,1|C<4>,1|N<2>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.5597	0.028	3	120.4088	0.344	34	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]N[5])(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ir<8>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5]C[5]N[5])(N[6]C[6]Ir)(C[6]C[6]H){1|C<3>,1|N<2>,1|N<3>,3|H<1>}	H(C[6]C[6]2)	120.8800	0.000	1	120.4088	0.344	34	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]N[5])(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ir<8>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5]C[5]N[5])(N[6]C[6]Ir)(C[6]C[6]H){1|N<3>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	120.5555	0.127	2	120.4088	0.344	34	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]N[5])(N[6]C[6]Li)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Li<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5]C[5]N[5])(N[6]C[6]Li)(C[6]C[6]H){1|N<3>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	120.2280	0.000	1	120.2280	0.000	1	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]N[5])(N[6]C[6]Mn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Mn<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5]C[5]N[5])(N[6]C[6]Mn)(C[6]C[6]H){1|N<3>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	120.6650	0.000	1	120.5359	0.034	10	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]N[5])(N[6]C[6]Mn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Mn<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5]C[5]N[5])(N[6]C[6]Mn)(C[6]C[6]H){1|N<3>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	120.5216	0.190	9	120.5359	0.034	10	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]N[5])(N[6]C[6]Mo)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Mo<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5]C[5]N[5])(N[6]C[6]Mo)(C[6]C[6]H){1|N<3>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	120.6218	0.129	5	120.5905	0.019	6	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]N[5])(N[6]C[6]Mo)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Mo<7>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5]C[5]N[5])(N[6]C[6]Mo)(C[6]C[6]H){1|N<3>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	120.4340	0.000	1	120.5905	0.019	6	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]N[5])(N[6]C[6]Nd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Nd<12>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5]C[5]N[5])(N[6]C[6]Nd)(C[6]C[6]H){1|N<3>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	120.2817	0.026	3	120.2817	0.001	3	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]N[5])(N[6]C[6]Ni)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ni<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5]C[5]N[5])(N[6]C[6]Ni)(C[6]C[6]H){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.8840	0.000	1	120.6496	0.078	9	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]N[5])(N[6]C[6]Ni)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ni<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5]C[5]N[5])(N[6]C[6]Ni)(C[6]C[6]H){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.8495	0.138	2	120.6496	0.078	9	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]N[5])(N[6]C[6]Ni)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5]C[5]N[5])(N[6]C[6]Ni)(C[6]C[6]H){1|N<3>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	120.4844	0.273	5	120.6496	0.078	9	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]N[5])(N[6]C[6]Ni)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ni<7>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5]C[5]N[5])(N[6]C[6]Ni)(C[6]C[6]H){1|C<3>,1|C<4>,1|N<2>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.8410	0.000	1	120.6496	0.078	9	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]N[5])(N[6]C[6]Os)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Os<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5]C[5]N[5])(N[6]C[6]Os)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.6730	0.000	1	120.6730	0.000	1	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]N[5])(N[6]C[6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5]C[5]N[5])(N[6]C[6]Pd)(C[6]C[6]H){1|C<3>,1|C<4>,1|N<2>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.4875	0.244	2	120.2697	0.169	14	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]N[5])(N[6]C[6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5]C[5]N[5])(N[6]C[6]Pd)(C[6]C[6]H){1|C<3>,1|N<2>,1|N<3>,3|H<1>}	H(C[6]C[6]2)	120.5712	0.165	4	120.2697	0.169	14	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]N[5])(N[6]C[6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5]C[5]N[5])(N[6]C[6]Pd)(C[6]C[6]H){1|C<3>,1|N<2>,2|H<1>,2|N<3>}	H(C[6]C[6]2)	120.8890	0.000	1	120.2697	0.169	14	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]N[5])(N[6]C[6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5]C[5]N[5])(N[6]C[6]Pd)(C[6]C[6]H){1|C<4>,1|H<1>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.1410	0.000	1	120.2697	0.169	14	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]N[5])(N[6]C[6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5]C[5]N[5])(N[6]C[6]Pd)(C[6]C[6]H){1|N<3>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	120.0045	0.274	4	120.2697	0.169	14	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]N[5])(N[6]C[6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5]C[5]N[5])(N[6]C[6]Pd)(C[6]C[6]H){1|Pd<4>,1|C<3>,1|C<4>,1|N<2>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.7340	0.338	2	120.2697	0.169	14	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]N[5])(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5]C[5]N[5])(N[6]C[6]Pt)(C[6]C[6]H){1|C<3>,1|N<2>,1|N<3>,3|H<1>}	H(C[6]C[6]2)	120.7120	0.214	4	120.8472	0.284	35	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]N[5])(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5]C[5]N[5])(N[6]C[6]Pt)(C[6]C[6]H){1|N<2>,1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	121.3344	0.636	9	120.8472	0.284	35	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]N[5])(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5]C[5]N[5])(N[6]C[6]Pt)(C[6]C[6]H){1|N<3>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	120.7110	0.049	2	120.8472	0.284	35	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]N[5])(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5]C[5]N[5])(N[6]C[6]Pt)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.7006	0.433	18	120.8472	0.284	35	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]N[5])(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|N<3>,3|C<3>}	C[6](C[5]C[5]N[5])(N[6]C[6]Pt)(C[6]C[6]H){1|C<3>,1|N<2>,1|N<3>,3|H<1>}	H(C[6]C[6]2)	120.3810	0.181	2	120.8472	0.284	35	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]N[5])(N[6]C[6]Re)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Re<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5]C[5]N[5])(N[6]C[6]Re)(C[6]C[6]H){1|C<3>,1|C<4>,1|N<2>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.3360	0.000	1	120.4763	0.070	12	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]N[5])(N[6]C[6]Re)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Re<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5]C[5]N[5])(N[6]C[6]Re)(C[6]C[6]H){1|C<3>,1|N<2>,1|N<3>,3|H<1>}	H(C[6]C[6]2)	120.4528	0.284	6	120.4763	0.070	12	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]N[5])(N[6]C[6]Re)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Re<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5]C[5]N[5])(N[6]C[6]Re)(C[6]C[6]H){1|N<3>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	120.5468	0.327	4	120.4763	0.070	12	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]N[5])(N[6]C[6]Re)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Re<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5]C[5]N[5])(N[6]C[6]Re)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.4760	0.000	1	120.4763	0.070	12	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]N[5])(N[6]C[6]Rh)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Rh<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5]C[5]N[5])(N[6]C[6]Rh)(C[6]C[6]H){1|N<3>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	120.2215	0.593	2	120.2356	0.707	5	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]N[5])(N[6]C[6]Rh)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Rh<6>,1|C<3>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[5]C[5]N[5])(N[6]C[6]Rh)(C[6]C[6]H){2|C<3>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	120.8775	0.274	2	120.2356	0.707	5	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]N[5])(N[6]C[6]Rh)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Rh<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5]C[5]N[5])(N[6]C[6]Rh)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	118.9800	0.000	1	120.2356	0.707	5	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]N[5])(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5]C[5]N[5])(N[6]C[6]Ru)(C[6]C[6]H){1|C<3>,1|C<4>,1|N<2>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.4300	0.000	1	120.5222	0.068	37	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]N[5])(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5]C[5]N[5])(N[6]C[6]Ru)(C[6]C[6]H){1|C<3>,1|N<2>,1|N<3>,3|H<1>}	H(C[6]C[6]2)	120.3878	0.277	6	120.5222	0.068	37	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]N[5])(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5]C[5]N[5])(N[6]C[6]Ru)(C[6]C[6]H){1|N<3>,1|O<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3745	0.353	2	120.5222	0.068	37	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]N[5])(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5]C[5]N[5])(N[6]C[6]Ru)(C[6]C[6]H){1|N<3>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	120.5058	0.274	11	120.5222	0.068	37	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]N[5])(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5]C[5]N[5])(N[6]C[6]Ru)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.6185	0.259	8	120.5222	0.068	37	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]N[5])(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ru<8>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5]C[5]N[5])(N[6]C[6]Ru)(C[6]C[6]H){1|N<3>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	120.6730	0.000	1	120.5222	0.068	37	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]N[5])(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ru<9>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5]C[5]N[5])(N[6]C[6]Ru)(C[6]C[6]H){1|C<3>,1|C<4>,1|N<2>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.7198	0.171	4	120.5222	0.068	37	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]N[5])(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ru<9>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5]C[5]N[5])(N[6]C[6]Ru)(C[6]C[6]H){1|C<3>,1|N<2>,1|N<3>,3|H<1>}	H(C[6]C[6]2)	120.6870	0.000	1	120.5222	0.068	37	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]N[5])(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ru<9>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5]C[5]N[5])(N[6]C[6]Ru)(C[6]C[6]H){1|N<3>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	120.3553	0.218	3	120.5222	0.068	37	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]N[5])(N[6]C[6]Sm)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Sm<13>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5]C[5]N[5])(N[6]C[6]Sm)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.3158	0.174	4	120.3158	0.030	4	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]N[5])(N[6]C[6]Zn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Zn<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5]C[5]N[5])(N[6]C[6]Zn)(C[6]C[6]H){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.9053	0.140	13	120.7341	0.052	34	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]N[5])(N[6]C[6]Zn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Zn<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5]C[5]N[5])(N[6]C[6]Zn)(C[6]C[6]H){1|N<2>,2|C<3>,2|H<1>,2|O<2>}	H(C[6]C[6]2)	120.4670	0.000	1	120.7341	0.052	34	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]N[5])(N[6]C[6]Zn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Zn<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5]C[5]N[5])(N[6]C[6]Zn)(C[6]C[6]H){1|N<3>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	120.6202	0.215	9	120.7341	0.052	34	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]N[5])(N[6]C[6]Zn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Zn<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5]C[5]N[5])(N[6]C[6]Zn)(C[6]C[6]H){1|N<3>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	120.9300	0.000	1	120.7341	0.052	34	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]N[5])(N[6]C[6]Zn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Zn<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5]C[5]N[5])(N[6]C[6]Zn)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.6400	0.139	5	120.7341	0.052	34	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]N[5])(N[6]C[6]Zn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Zn<6>,1|C<2>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[5]C[5]N[5])(N[6]C[6]Zn)(C[6]C[6]H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	121.0230	0.000	1	120.7341	0.052	34	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]N[5])(N[6]C[6]Zn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Zn<6>,1|C<2>,1|C<3>,1|N<3>}	C[6](C[5]C[5]N[5])(N[6]C[6]Zn)(C[6]C[6]H){1|N<2>,2|C<2>,2|H<1>}	H(C[6]C[6]2)	120.6040	0.000	1	120.7341	0.052	34	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]N[5])(N[6]C[6]Zn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Zn<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5]C[5]N[5])(N[6]C[6]Zn)(C[6]C[6]H){1|N<3>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	120.4617	0.172	3	120.7341	0.052	34	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]S[5])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|H<1>,1|S<3>,2|C<3>}	C[6](C[5]C[5]S[5])(N[6]C[6]Cu)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.5510	0.393	2	120.4417	0.068	4	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]S[5])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|H<1>,1|S<3>,2|C<3>}	C[6](C[5]C[5]S[5])(N[6]C[6]Cu)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.3325	0.043	2	120.4417	0.068	4	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]S[5])(N[6]C[6]Yb)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Yb<12>,1|H<1>,1|S<3>,2|C<3>}	C[6](C[5]C[5]S[5])(N[6]C[6]Yb)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.5730	0.000	1	120.5730	0.000	1	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]S[5])(N[6]C[6]Zn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Zn<4>,1|H<1>,1|S<2>,2|C<3>}	C[6](C[5]C[5]S[5])(N[6]C[6]Zn)(C[6]C[6]H){2|C<3>,2|H<1>,2|S<2>}	H(C[6]C[6]2)	119.0580	0.000	1	119.0580	0.000	1	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]N[5,6]N[5])(N[6]C[6]Cd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cd<5>,1|C<3>,1|H<1>,2|N<3>}	C[6](C[5]N[5,6]N[5])(N[6]C[6]Cd)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	121.0810	0.000	1	120.7593	0.566	4	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]N[5,6]N[5])(N[6]C[6]Cd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cd<5>,1|C<3>,1|H<1>,2|N<3>}	C[6](C[5]N[5,6]N[5])(N[6]C[6]Cd)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.6520	0.883	3	120.7593	0.566	4	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]N[5,6]N[5])(N[6]C[6]Co)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Co<5>,1|C<3>,1|H<1>,2|N<3>}	C[6](C[5]N[5,6]N[5])(N[6]C[6]Co)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.7630	0.000	1	120.8363	0.087	3	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]N[5,6]N[5])(N[6]C[6]Co)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Co<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](C[5]N[5,6]N[5])(N[6]C[6]Co)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.8730	0.407	2	120.8363	0.087	3	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]N[5,6]N[5])(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<5>,1|C<3>,1|H<1>,2|N<3>}	C[6](C[5]N[5,6]N[5])(N[6]C[6]Fe)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.6930	0.094	3	120.6917	0.149	6	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]N[5,6]N[5])(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](C[5]N[5,6]N[5])(N[6]C[6]Fe)(C[6]C[6]H){1|N<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.9950	0.000	1	120.6917	0.149	6	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]N[5,6]N[5])(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](C[5]N[5,6]N[5])(N[6]C[6]Fe)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.5380	0.768	2	120.6917	0.149	6	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]N[5,6]N[5])(N[6]C[6]Zn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Zn<4>,1|C<3>,1|H<1>,2|N<3>}	C[6](C[5]N[5,6]N[5])(N[6]C[6]Zn)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.4100	0.000	1	120.8597	0.140	4	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]N[5,6]N[5])(N[6]C[6]Zn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Zn<5>,1|C<3>,1|H<1>,2|N<3>}	C[6](C[5]N[5,6]N[5])(N[6]C[6]Zn)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	121.0097	0.273	3	120.8597	0.140	4	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]N[5,6a]N[5])(N[6]C[6]Co)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Co<4>,1|C<3>,1|H<1>,2|N<3>}	C[6](C[5]N[5,6a]N[5])(N[6]C[6]Co)(C[6]C[6]H){1|C<4>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.6490	0.000	1	120.6490	0.000	1	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]N[5,6a]N[5])(N[6]C[6]Zn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Zn<4>,1|C<3>,1|H<1>,2|N<3>}	C[6](C[5]N[5,6a]N[5])(N[6]C[6]Zn)(C[6]C[6]H){1|C<4>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.4990	0.000	1	120.4990	0.000	1	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]N[5]O[5])(N[6]C[6]Ag)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ag<6>,1|C<3>,1|H<1>,1|N<3>,1|O<2>}	C[6](C[5]N[5]O[5])(N[6]C[6]Ag)(C[6]C[6]H){1|H<1>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	120.5660	0.265	4	120.5660	0.070	4	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]N[5]O[5])(N[6]C[6]Co)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Co<4>,1|C<3>,1|H<1>,1|N<3>,1|O<2>}	C[6](C[5]N[5]O[5])(N[6]C[6]Co)(C[6]C[6]H){1|C<3>,1|H<1>,3|C<4>}	H(C[6]C[6]2)	121.2655	0.251	2	121.1134	0.066	10	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]N[5]O[5])(N[6]C[6]Co)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Co<5>,1|C<3>,1|H<1>,1|N<3>,1|O<2>}	C[6](C[5]N[5]O[5])(N[6]C[6]Co)(C[6]C[6]H){1|C<3>,1|H<1>,1|N<3>,2|C<4>}	H(C[6]C[6]2)	121.5240	0.000	1	121.1134	0.066	10	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]N[5]O[5])(N[6]C[6]Co)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Co<5>,1|C<3>,1|H<1>,1|N<3>,1|O<2>}	C[6](C[5]N[5]O[5])(N[6]C[6]Co)(C[6]C[6]H){1|H<1>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	121.1797	0.076	3	121.1134	0.066	10	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]N[5]O[5])(N[6]C[6]Co)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Co<6>,1|C<3>,1|H<1>,1|N<3>,1|O<2>}	C[6](C[5]N[5]O[5])(N[6]C[6]Co)(C[6]C[6]H){1|H<1>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	120.8850	0.165	4	121.1134	0.066	10	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]N[5]O[5])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>,1|N<3>,1|O<2>}	C[6](C[5]N[5]O[5])(N[6]C[6]Cu)(C[6]C[6]H){1|C<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.4740	0.310	2	120.6866	0.309	22	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]N[5]O[5])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>,1|N<3>,1|O<2>}	C[6](C[5]N[5]O[5])(N[6]C[6]Cu)(C[6]C[6]H){1|Cu<2>,1|H<1>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	121.6220	0.634	2	120.6866	0.309	22	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]N[5]O[5])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>,1|N<3>,1|O<2>}	C[6](C[5]N[5]O[5])(N[6]C[6]Cu)(C[6]C[6]H){1|Cu<4>,1|H<1>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	120.3457	0.377	6	120.6866	0.309	22	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]N[5]O[5])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>,1|N<3>,1|O<2>}	C[6](C[5]N[5]O[5])(N[6]C[6]Cu)(C[6]C[6]H){1|H<1>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	120.6453	0.565	8	120.6866	0.309	22	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]N[5]O[5])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>,1|N<3>,1|O<2>}	C[6](C[5]N[5]O[5])(N[6]C[6]Cu)(C[6]C[6]H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	120.6645	0.105	2	120.6866	0.309	22	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]N[5]O[5])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>,1|N<3>,1|O<2>}	C[6](C[5]N[5]O[5])(N[6]C[6]Cu)(C[6]C[6]H){1|H<1>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	121.1740	0.083	2	120.6866	0.309	22	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]N[5]O[5])(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<5>,1|C<3>,1|H<1>,1|N<3>,1|O<2>}	C[6](C[5]N[5]O[5])(N[6]C[6]Fe)(C[6]C[6]H){1|H<1>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	120.1415	1.829	6	120.8823	0.309	101	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]N[5]O[5])(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>,1|N<3>,1|O<2>}	C[6](C[5]N[5]O[5])(N[6]C[6]Fe)(C[6]C[6]H){1|H<1>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	120.9278	0.337	92	120.8823	0.309	101	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]N[5]O[5])(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>,1|N<3>,1|O<2>}	C[6](C[5]N[5]O[5])(N[6]C[6]Fe)(C[6]C[6]H){1|N<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.9710	0.442	3	120.8823	0.309	101	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]N[5]O[5])(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>,1|N<3>,1|O<2>}	C[6](C[5]N[5]O[5])(N[6]C[6]Ir)(C[6]C[6]H){1|N<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.4920	2.038	2	120.3445	1.511	6	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]N[5]O[5])(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>,1|N<3>,1|O<2>}	C[6](C[5]N[5]O[5])(N[6]C[6]Ir)(C[6]C[6]H){2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.1570	0.000	1	120.3445	1.511	6	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]N[5]O[5])(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ir<7>,1|C<3>,1|H<1>,1|N<3>,1|O<2>}	C[6](C[5]N[5]O[5])(N[6]C[6]Ir)(C[6]C[6]H){1|H<1>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	121.6260	0.000	1	120.3445	1.511	6	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]N[5]O[5])(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ir<9>,1|C<3>,1|H<1>,1|N<3>,1|O<2>}	C[6](C[5]N[5]O[5])(N[6]C[6]Ir)(C[6]C[6]H){1|H<1>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	120.6500	0.293	2	120.3445	1.511	6	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]N[5]O[5])(N[6]C[6]Mn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Mn<5>,1|C<3>,1|H<1>,1|N<3>,1|O<2>}	C[6](C[5]N[5]O[5])(N[6]C[6]Mn)(C[6]C[6]H){1|H<1>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	121.1170	0.010	2	121.1170	0.000	2	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]N[5]O[5])(N[6]C[6]Ni)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ni<4>,1|C<3>,1|H<1>,1|N<3>,1|O<2>}	C[6](C[5]N[5]O[5])(N[6]C[6]Ni)(C[6]C[6]H){1|H<1>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	120.5803	0.417	3	121.1453	0.175	12	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]N[5]O[5])(N[6]C[6]Ni)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ni<5>,1|C<3>,1|H<1>,1|N<3>,1|O<2>}	C[6](C[5]N[5]O[5])(N[6]C[6]Ni)(C[6]C[6]H){1|C<3>,1|H<1>,3|C<4>}	H(C[6]C[6]2)	121.2727	0.100	3	121.1453	0.175	12	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]N[5]O[5])(N[6]C[6]Ni)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ni<5>,1|C<3>,1|H<1>,1|N<3>,1|O<2>}	C[6](C[5]N[5]O[5])(N[6]C[6]Ni)(C[6]C[6]H){1|C<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	121.3480	0.000	1	121.1453	0.175	12	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]N[5]O[5])(N[6]C[6]Ni)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ni<5>,1|C<3>,1|H<1>,1|N<3>,1|O<2>}	C[6](C[5]N[5]O[5])(N[6]C[6]Ni)(C[6]C[6]H){1|H<1>,4|C<3>}	H(C[6]C[6]2)	121.3670	0.484	2	121.1453	0.175	12	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]N[5]O[5])(N[6]C[6]Ni)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>,1|N<3>,1|O<2>}	C[6](C[5]N[5]O[5])(N[6]C[6]Ni)(C[6]C[6]H){1|C<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	121.4970	0.000	1	121.1453	0.175	12	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]N[5]O[5])(N[6]C[6]Ni)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>,1|N<3>,1|O<2>}	C[6](C[5]N[5]O[5])(N[6]C[6]Ni)(C[6]C[6]H){1|H<1>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	121.2770	0.000	1	121.1453	0.175	12	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]N[5]O[5])(N[6]C[6]Ni)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>,1|N<3>,1|O<2>}	C[6](C[5]N[5]O[5])(N[6]C[6]Ni)(C[6]C[6]H){1|H<1>,4|C<3>}	H(C[6]C[6]2)	121.3290	0.000	1	121.1453	0.175	12	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]N[5]O[5])(N[6]C[6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>,1|N<3>,1|O<2>}	C[6](C[5]N[5]O[5])(N[6]C[6]Pd)(C[6]C[6]H){1|H<1>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	121.2526	0.514	11	121.2526	0.264	11	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]N[5]O[5])(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Pt<6>,1|C<3>,1|H<1>,1|N<3>,1|O<2>}	C[6](C[5]N[5]O[5])(N[6]C[6]Pt)(C[6]C[6]H){1|N<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6077	0.550	3	120.6077	0.302	3	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]N[5]O[5])(N[6]C[6]Re)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Re<6>,1|C<3>,1|H<1>,1|N<3>,1|O<2>}	C[6](C[5]N[5]O[5])(N[6]C[6]Re)(C[6]C[6]H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	120.9720	0.000	1	120.9750	0.000	2	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]N[5]O[5])(N[6]C[6]Re)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Re<6>,1|C<3>,1|H<1>,1|N<3>,1|O<2>}	C[6](C[5]N[5]O[5])(N[6]C[6]Re)(C[6]C[6]H){1|N<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.9780	0.000	1	120.9750	0.000	2	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]N[5]O[5])(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>,1|N<3>,1|O<2>}	C[6](C[5]N[5]O[5])(N[6]C[6]Ru)(C[6]C[6]H){1|C<3>,1|H<1>,1|N<3>,2|C<4>}	H(C[6]C[6]2)	121.2920	0.000	1	120.9855	0.188	2	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]N[5]O[5])(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ru<9>,1|C<3>,1|H<1>,1|N<3>,1|O<2>}	C[6](C[5]N[5]O[5])(N[6]C[6]Ru)(C[6]C[6]H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	120.6790	0.000	1	120.9855	0.188	2	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]N[5]O[5])(N[6]C[6]Zn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Zn<5>,1|C<3>,1|H<1>,1|N<3>,1|O<2>}	C[6](C[5]N[5]O[5])(N[6]C[6]Zn)(C[6]C[6]H){1|H<1>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	121.2070	0.171	2	121.2070	0.029	2	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]N[5]S[5])(N[6]C[6]Cd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cd<6>,1|C<3>,1|H<1>,1|N<3>,1|S<2>}	C[6](C[5]N[5]S[5])(N[6]C[6]Cd)(C[6]C[6]H){1|H<1>,4|C<3>}	H(C[6]C[6]2)	121.0445	0.317	2	121.0445	0.101	2	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]N[5]S[5])(N[6]C[6]Co)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Co<5>,1|C<3>,1|H<1>,1|N<3>,1|S<2>}	C[6](C[5]N[5]S[5])(N[6]C[6]Co)(C[6]C[6]H){1|H<1>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	120.9727	0.085	3	120.8270	0.234	13	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]N[5]S[5])(N[6]C[6]Co)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Co<5>,1|C<3>,1|H<1>,1|N<3>,1|S<2>}	C[6](C[5]N[5]S[5])(N[6]C[6]Co)(C[6]C[6]H){1|H<1>,4|C<3>}	H(C[6]C[6]2)	120.8250	0.238	2	120.8270	0.234	13	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]N[5]S[5])(N[6]C[6]Co)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Co<6>,1|C<3>,1|H<1>,1|N<3>,1|S<2>}	C[6](C[5]N[5]S[5])(N[6]C[6]Co)(C[6]C[6]H){1|H<1>,4|C<3>}	H(C[6]C[6]2)	121.2420	0.127	2	120.8270	0.234	13	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]N[5]S[5])(N[6]C[6]Co)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Co<6>,1|C<3>,1|H<1>,1|N<3>,1|S<2>}	C[6](C[5]N[5]S[5])(N[6]C[6]Co)(C[6]C[6]H){1|N<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6420	0.160	3	120.8270	0.234	13	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]N[5]S[5])(N[6]C[6]Co)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Co<6>,1|C<3>,1|H<1>,1|N<3>,1|S<2>}	C[6](C[5]N[5]S[5])(N[6]C[6]Co)(C[6]C[6]H){2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.5910	0.997	3	120.8270	0.234	13	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]N[5]S[5])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>,1|N<3>,1|S<2>}	C[6](C[5]N[5]S[5])(N[6]C[6]Cu)(C[6]C[6]H){1|C<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	121.0025	0.067	2	120.7640	0.059	11	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]N[5]S[5])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>,1|N<3>,1|S<2>}	C[6](C[5]N[5]S[5])(N[6]C[6]Cu)(C[6]C[6]H){1|H<1>,4|C<3>}	H(C[6]C[6]2)	120.7041	0.251	8	120.7640	0.059	11	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]N[5]S[5])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<6>,1|C<3>,1|H<1>,1|N<3>,1|S<2>}	C[6](C[5]N[5]S[5])(N[6]C[6]Cu)(C[6]C[6]H){1|N<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.7660	0.000	1	120.7640	0.059	11	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]N[5]S[5])(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>,1|N<3>,1|S<2>}	C[6](C[5]N[5]S[5])(N[6]C[6]Fe)(C[6]C[6]H){1|H<1>,4|C<3>}	H(C[6]C[6]2)	120.8847	0.076	3	120.6638	0.032	10	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]N[5]S[5])(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>,1|N<3>,1|S<2>}	C[6](C[5]N[5]S[5])(N[6]C[6]Fe)(C[6]C[6]H){1|N<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5691	0.103	7	120.6638	0.032	10	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]N[5]S[5])(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>,1|N<3>,1|S<2>}	C[6](C[5]N[5]S[5])(N[6]C[6]Ir)(C[6]C[6]H){2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.6470	0.000	1	120.6470	0.000	1	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]N[5]S[5])(N[6]C[6]Mn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>,1|N<3>,1|S<2>}	C[6](C[5]N[5]S[5])(N[6]C[6]Mn)(C[6]C[6]H){2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.6607	0.134	3	120.6607	0.018	3	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]N[5]S[5])(N[6]C[6]Ni)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>,1|N<3>,1|S<2>}	C[6](C[5]N[5]S[5])(N[6]C[6]Ni)(C[6]C[6]H){1|N<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6273	0.063	3	120.6273	0.004	3	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]N[5]S[5])(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Pt<6>,1|C<3>,1|H<1>,1|N<3>,1|S<2>}	C[6](C[5]N[5]S[5])(N[6]C[6]Pt)(C[6]C[6]H){2|H<1>,3|C<3>}	H(C[6]C[6]2)	121.0180	0.000	1	121.0180	0.000	1	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]N[5]S[5])(N[6]C[6]Re)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Re<6>,1|C<3>,1|H<1>,1|N<3>,1|S<2>}	C[6](C[5]N[5]S[5])(N[6]C[6]Re)(C[6]C[6]H){2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.3970	0.367	4	120.3970	0.134	4	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]N[5]S[5])(N[6]C[6]Zn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Zn<6>,1|C<3>,1|H<1>,1|N<3>,1|S<2>}	C[6](C[5]N[5]S[5])(N[6]C[6]Zn)(C[6]C[6]H){1|H<1>,4|C<3>}	H(C[6]C[6]2)	121.6680	0.014	2	121.6680	0.000	2	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]Se[5]C[5])(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|Se<2>,1|H<1>,2|C<3>}	C[6](C[5]Se[5]C[5])(N[6]C[6]Pt)(C[6]C[6]H){2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.4153	0.056	3	120.4153	0.003	3	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]N)(H)	C[6](C[5]C[5]N[5])(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]N)(H){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5]C[5]N[5])(N[6]C[6]Fe)(C[6]C[6]H){1|C<3>,1|H<1>,1|N<2>,3|N<3>}	H(C[6]C[6]2)	120.8755	0.070	2	120.8755	0.005	2	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[5]N[6])(H)	C[6](C[5]N[5]S[5])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[5]N[6])(H){1|Cu<5>,1|H<1>,1|N<3>,1|O<2>,1|S<2>,2|C<3>}	C[6](C[5]N[5]S[5])(N[6]C[6]Cu)(C[6]C[6]H){5|C<3>}	H(C[6]C[6]2)	120.6525	0.015	2	120.4800	0.056	4	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[5]N[6])(H)	C[6](C[5]N[5]S[5])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[5]N[6])(H){1|Cu<5>,1|H<1>,1|N<3>,2|C<3>,2|S<2>}	C[6](C[5]N[5]S[5])(N[6]C[6]Cu)(C[6]C[6]H){5|C<3>}	H(C[6]C[6]2)	120.3075	0.224	2	120.4800	0.056	4	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[5]N[6])(H)	C[6](C[5]N[5]S[5])(N[6]C[6]Re)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[5]N[6])(H){1|Re<6>,1|H<1>,1|N<3>,2|C<3>,2|S<2>}	C[6](C[5]N[5]S[5])(N[6]C[6]Re)(C[6]C[6]H){5|C<3>}	H(C[6]C[6]2)	119.8230	0.000	1	120.0065	0.067	2	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[5]N[6])(H)	C[6](C[5]N[5]S[5])(N[6]C[6]Re)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[5]N[6])(H){1|Re<6>,1|H<1>,1|S<2>,2|C<3>,2|N<3>}	C[6](C[5]N[5]S[5])(N[6]C[6]Re)(C[6]C[6]H){5|C<3>}	H(C[6]C[6]2)	120.1900	0.000	1	120.0065	0.067	2	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[5]N[6])(H)	C[6](C[5]N[5]O[5])(N[6]C[6]Co)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[5]N[6])(H){1|Co<6>,1|H<1>,1|N<3>,1|O<2>,3|C<3>}	C[6](C[5]N[5]O[5])(N[6]C[6]Co)(C[6]C[6]H){2|C<4>,3|C<3>}	H(C[6]C[6]2)	120.4794	0.299	11	120.4794	0.089	11	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[5]N[6])(H)	C[6](C[5]N[5]O[5])(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[5]N[6])(H){1|Fe<6>,1|H<1>,1|N<3>,1|O<2>,3|C<3>}	C[6](C[5]N[5]O[5])(N[6]C[6]Fe)(C[6]C[6]H){2|C<4>,3|C<3>}	H(C[6]C[6]2)	120.7768	0.120	4	120.7768	0.014	4	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[5]N[6])(H)	C[6](C[5]N[5]S[5])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[5]N[6])(H){1|Cu<5>,1|H<1>,1|N<3>,1|S<2>,3|C<3>}	C[6](C[5]N[5]S[5])(N[6]C[6]Cu)(C[6]C[6]H){5|C<3>}	H(C[6]C[6]2)	120.3895	0.344	2	120.3895	0.119	2	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[5]N[6])(H)	C[6](C[5]N[5]S[5])(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[5]N[6])(H){1|Pt<4>,1|H<1>,1|N<3>,1|S<2>,3|C<3>}	C[6](C[5]N[5]S[5])(N[6]C[6]Pt)(C[6]C[6]H){5|C<3>}	H(C[6]C[6]2)	120.1355	0.391	2	120.1355	0.153	2	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[5]N[6])(H)	C[6](C[5]N[5]S[5])(N[6]C[6]Re)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[5]N[6])(H){1|Re<6>,1|H<1>,1|N<2>,1|N<3>,1|S<2>,2|C<3>}	C[6](C[5]N[5]S[5])(N[6]C[6]Re)(C[6]C[6]H){5|C<3>}	H(C[6]C[6]2)	120.3500	0.000	1	119.7570	0.409	3	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[5]N[6])(H)	C[6](C[5]N[5]S[5])(N[6]C[6]Re)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[5]N[6])(H){1|Re<6>,1|H<1>,1|N<3>,1|S<2>,3|C<3>}	C[6](C[5]N[5]S[5])(N[6]C[6]Re)(C[6]C[6]H){5|C<3>}	H(C[6]C[6]2)	119.4605	0.540	2	119.7570	0.409	3	120.6387	0.346	789	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a,6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[5a,6]N)(C[6]C[6,6]N)(H)	C[6](C[5a,6]C[5a,6]N[5a])(C[6]C[6]H)(NOO)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]N)(C[6]C[6,6]N)(H){1|N<2>,1|N<3>,2|C<3>}	C[6](C[5a,6]C[5a,6]N[5a])(C[6]C[6]H)(NOO){1|C<4>,1|N<2>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	117.7570	0.000	1	117.7570	0.000	1	119.1737	7.771	4	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a,6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[5a,6]N)(C[6]C[6]O)(H)	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(NCC)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]N)(C[6]C[6]O)(H){1|O<1>,2|C<3>}	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(NCC){1|C<4>,1|N<3>,1|O<1>,2|C<3>}	H(C[6]C[6]2)	119.6055	4.542	2	119.6055	20.627	2	119.1737	7.771	4	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a,6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[5a,6]N)(C[6]N[6]H)(H)	C[6](C[5a,6]C[5a,6]N[5a])(C[6]C[6]H)(NOO)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]N)(C[6]N[6]H)(H){1|C<3>,1|N<2>,1|O<1>}	C[6](C[5a,6]C[5a,6]N[5a])(C[6]C[6]H)(NOO){1|C<3>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	119.7270	0.000	1	119.7270	0.000	1	119.1737	7.771	4	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[5]N[6])(H)	C[6](C[5a]C[5a]N[5a])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[5]N[6])(H){1|Re<6>,1|H<1>,1|S<2>,2|C<3>,2|N<3>}	C[6](C[5a]C[5a]N[5a])(C[6]C[6]H)2{1|C<4>,1|H<1>,1|N<3>,4|C<3>}	H(C[6]C[6]2)	120.2830	0.000	1	120.2830	0.000	1	120.0840	0.540	294	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[5]N[6])(H)	C[6](C[5a]C[5a]O[5a])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[5]N[6])(H){1|Cu<5>,1|H<1>,1|N<3>,1|O<2>,1|S<2>,2|C<3>}	C[6](C[5a]C[5a]O[5a])(C[6]C[6]H)2{1|H<1>,1|N<3>,4|C<3>}	H(C[6]C[6]2)	120.6900	0.082	2	120.6900	0.007	2	120.0840	0.540	294	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[5]N[6])(H)	C[6](C[5a]C[5a]S[5a])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[5]N[6])(H){1|Cu<5>,1|H<1>,1|N<3>,2|C<3>,2|S<2>}	C[6](C[5a]C[5a]S[5a])(C[6]C[6]H)2{1|H<1>,1|N<3>,4|C<3>}	H(C[6]C[6]2)	120.3840	0.205	2	120.1713	0.157	3	120.0840	0.540	294	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[5]N[6])(H)	C[6](C[5a]C[5a]S[5a])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[5]N[6])(H){1|Re<6>,1|H<1>,1|N<3>,2|C<3>,2|S<2>}	C[6](C[5a]C[5a]S[5a])(C[6]C[6]H)2{1|H<1>,1|N<3>,4|C<3>}	H(C[6]C[6]2)	119.7460	0.000	1	120.1713	0.157	3	120.0840	0.540	294	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[5a]N[6])(H)	C[6](C[5a]C[5a]N[5a])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[5a]N[6])(H){1|Re<6>,1|H<1>,1|N<2>,1|N<3>,1|S<2>,2|C<3>}	C[6](C[5a]C[5a]N[5a])(C[6]C[6]H)2{1|C<4>,1|H<1>,1|N<3>,4|C<3>}	H(C[6]C[6]2)	119.3140	0.000	1	119.3140	0.000	1	120.0840	0.540	294	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[5a]N[6])(H)	C[6](C[5a]C[5a]S[5a])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[5a]N[6])(H){1|Re<6>,1|H<1>,1|N<2>,2|C<3>,2|S<2>}	C[6](C[5a]C[5a]S[5a])(C[6]C[6]H)2{1|H<1>,1|N<3>,4|C<3>}	H(C[6]C[6]2)	119.1130	0.000	1	119.1130	0.000	1	120.0840	0.540	294	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]C)(H)	C[6](C[5a]C[5a]N[5a])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]C)(H){1|H<1>,1|N<2>,1|O<1>,2|C<3>}	C[6](C[5a]C[5a]N[5a])(C[6]C[6]H)2{1|N<3>,2|C<4>,3|C<3>}	H(C[6]C[6]2)	118.3470	0.194	2	118.4375	0.041	4	120.0840	0.540	294	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]C)(H)	C[6](C[5a]C[5a]N[5a])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]C)(H){1|H<1>,1|N<3>,1|O<1>,2|C<3>}	C[6](C[5a]C[5a]N[5a])(C[6]C[6]H)2{1|H<1>,1|N<2>,2|C<4>,3|C<3>}	H(C[6]C[6]2)	118.5280	0.228	2	118.4375	0.041	4	120.0840	0.540	294	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]C)(H)	C[6](C[5a]C[5a]S[5a])(C[6]C[6]C)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]C)(H){1|C<4>,1|S<2>,3|C<3>}	C[6](C[5a]C[5a]S[5a])(C[6]C[6]C)(C[6]C[6]H){1|C<4>,1|H<1>,1|O<1>,3|C<3>}	H(C[6]C[6]2)	118.4940	0.000	1	118.4940	0.000	1	120.0840	0.540	294	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H)	C[6](C[5a]C[5a,6]C[5a])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H){1|C<2>,1|H<1>,2|C<3>}	C[6](C[5a]C[5a,6]C[5a])(C[6]C[6]H)2{1|Br<1>,1|C<2>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.9630	0.000	1	120.9940	0.002	2	120.0840	0.540	294	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H)	C[6](C[5a]C[5a,6]C[5a])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H){1|C<2>,2|C<3>,2|H<1>}	C[6](C[5a]C[5a,6]C[5a])(C[6]C[6]H)2{1|Br<1>,1|H<1>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	121.0250	0.000	1	120.9940	0.002	2	120.0840	0.540	294	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H)	C[6](C[5a]C[5a]N[5a])(C[6]C[6]H)(C[6]C[6]O)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>,2|C<3>}	C[6](C[5a]C[5a]N[5a])(C[6]C[6]H)(C[6]C[6]O){1|O<2>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.8650	0.000	1	119.8650	0.000	1	120.0840	0.540	294	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H)	C[6](C[5a]C[5a]N[5a])(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H){1|C<3>,2|H<1>,2|N<3>}	C[6](C[5a]C[5a]N[5a])(C[6]C[6]H)(C[6]N[6]H){3|H<1>,4|C<3>}	H(C[6]C[6]2)	119.8450	0.145	4	119.8450	0.021	4	120.0840	0.540	294	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H)	C[6](C[5a]C[5a]N[5a])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|N<3>,2|H<1>}	C[6](C[5a]C[5a]N[5a])(C[6]C[6]H)2{1|C<4>,1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	116.6740	0.000	1	116.6740	0.000	1	120.0840	0.540	294	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H)	C[6](C[5a]N[5a,6]C[5a])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>}	C[6](C[5a]N[5a,6]C[5a])(C[6]C[6]H)2{1|Br<1>,1|B<4>,1|C<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	118.6330	6.985	2	118.6330	48.787	2	120.0840	0.540	294	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H)	C[6](C[5a]N[5a]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>,2|N<3>}	C[6](C[5a]N[5a]2)(C[6]C[6]H)(C[6]N[6]H){1|Co<6>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.3450	0.061	2	120.2349	0.202	20	120.0840	0.540	294	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H)	C[6](C[5a]N[5a]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<2>,3|N<3>}	C[6](C[5a]N[5a]2)(C[6]C[6]H)(C[6]N[6]H){1|C<3>,2|N<2>,3|H<1>}	H(C[6]C[6]2)	119.5767	0.044	3	120.2349	0.202	20	120.0840	0.540	294	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H)	C[6](C[5a]N[5a]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H){1|N<2>,2|H<1>,2|N<3>}	C[6](C[5a]N[5a]2)(C[6]C[6]H)(C[6]N[6]H){1|C<3>,2|N<2>,3|H<1>}	H(C[6]C[6]2)	119.8985	0.136	2	120.2349	0.202	20	120.0840	0.540	294	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H)	C[6](C[5a]N[5a]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H){1|N<2>,2|H<1>,2|N<3>}	C[6](C[5a]N[5a]2)(C[6]C[6]H)(C[6]N[6]H){1|Co<6>,1|H<1>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.7700	0.000	1	120.2349	0.202	20	120.0840	0.540	294	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H)	C[6](C[5a]N[5a]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H){1|N<2>,2|H<1>,2|N<3>}	C[6](C[5a]N[5a]2)(C[6]C[6]H)(C[6]N[6]H){1|Co<6>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.2380	0.000	1	120.2349	0.202	20	120.0840	0.540	294	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H)	C[6](C[5a]N[5a]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H){1|N<2>,2|H<1>,2|N<3>}	C[6](C[5a]N[5a]2)(C[6]C[6]H)(C[6]N[6]H){1|Cu<5>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.6410	0.000	1	120.2349	0.202	20	120.0840	0.540	294	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H)	C[6](C[5a]N[5a]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H){1|N<2>,2|H<1>,2|N<3>}	C[6](C[5a]N[5a]2)(C[6]C[6]H)(C[6]N[6]H){1|H<1>,1|N<2>,1|N<3>,1|O<1>,2|C<3>}	H(C[6]C[6]2)	120.7605	0.026	2	120.2349	0.202	20	120.0840	0.540	294	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H)	C[6](C[5a]N[5a]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H){1|N<2>,2|H<1>,2|N<3>}	C[6](C[5a]N[5a]2)(C[6]C[6]H)(C[6]N[6]H){1|Zn<6>,1|H<1>,2|C<3>,2|N<2>}	H(C[6]C[6]2)	120.6360	0.000	1	120.2349	0.202	20	120.0840	0.540	294	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H)	C[6](C[5a]N[5a]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H){1|N<2>,2|H<1>,2|N<3>}	C[6](C[5a]N[5a]2)(C[6]C[6]H)(C[6]N[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.7630	0.000	1	120.2349	0.202	20	120.0840	0.540	294	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H)	C[6](C[5a]N[5a]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H){1|N<3>,2|H<1>,2|N<2>}	C[6](C[5a]N[5a]2)(C[6]C[6]H)(C[6]N[6]H){1|C<3>,1|N<2>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.8110	0.000	1	120.2349	0.202	20	120.0840	0.540	294	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H)	C[6](C[5a]N[5a]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H){1|N<3>,2|H<1>,2|N<2>}	C[6](C[5a]N[5a]2)(C[6]C[6]H)(C[6]N[6]H){1|Co<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.5395	0.199	2	120.2349	0.202	20	120.0840	0.540	294	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H)	C[6](C[5a]N[5a]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H){1|N<3>,2|H<1>,2|N<2>}	C[6](C[5a]N[5a]2)(C[6]C[6]H)(C[6]N[6]H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8800	0.000	1	120.2349	0.202	20	120.0840	0.540	294	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H)	C[6](C[5a]N[5a]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H){1|N<3>,2|H<1>,2|N<2>}	C[6](C[5a]N[5a]2)(C[6]C[6]H)(C[6]N[6]H){1|Ni<6>,1|H<1>,1|S<2>,2|C<3>}	H(C[6]C[6]2)	120.8130	0.000	1	120.2349	0.202	20	120.0840	0.540	294	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H)	C[6](C[5a]N[5a]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H){1|N<3>,2|H<1>,2|N<2>}	C[6](C[5a]N[5a]2)(C[6]C[6]H)(C[6]N[6]H){1|S<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3290	0.000	1	120.2349	0.202	20	120.0840	0.540	294	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H)	C[6](C[5a]N[5a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	C[6](C[5a]N[5a]2)(C[6]C[6]H)2{3|C<3>,3|H<1>}	H(C[6]C[6]2)	118.3875	1.817	2	118.3875	3.300	2	120.0840	0.540	294	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H)	C[6](C[5a]N[5a]O[5a])(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H){1|N<2>,1|N<3>,1|O<2>,2|H<1>}	C[6](C[5a]N[5a]O[5a])(C[6]C[6]H)(C[6]N[6]H){1|Fe<6>,1|H<1>,1|N<2>,2|C<3>}	H(C[6]C[6]2)	121.0660	0.000	1	120.6363	0.492	3	120.0840	0.540	294	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H)	C[6](C[5a]N[5a]O[5a])(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H){1|N<2>,1|N<3>,1|O<2>,2|H<1>}	C[6](C[5a]N[5a]O[5a])(C[6]C[6]H)(C[6]N[6]H){1|Mn<6>,1|H<1>,1|N<2>,2|C<3>}	H(C[6]C[6]2)	121.0160	0.000	1	120.6363	0.492	3	120.0840	0.540	294	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H)	C[6](C[5a]N[5a]O[5a])(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H){1|N<2>,1|N<3>,1|O<2>,2|H<1>}	C[6](C[5a]N[5a]O[5a])(C[6]C[6]H)(C[6]N[6]H){1|N<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8270	0.000	1	120.6363	0.492	3	120.0840	0.540	294	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H)	C[6](C[5a]N[5a]O[5a])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H){1|C<2>,1|N<2>,1|O<2>,2|H<1>}	C[6](C[5a]N[5a]O[5a])(C[6]C[6]H)2{1|H<1>,3|C<3>}	H(C[6]C[6]2)	121.7730	0.000	1	121.7730	0.000	1	120.0840	0.540	294	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H)	C[6](C[5a]N[5a]S[5a])(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H){1|N<2>,1|N<3>,1|S<2>,2|H<1>}	C[6](C[5a]N[5a]S[5a])(C[6]C[6]H)(C[6]N[6]H){1|Ni<6>,1|H<1>,1|N<2>,2|C<3>}	H(C[6]C[6]2)	120.7940	0.000	1	120.7940	0.000	1	120.0840	0.540	294	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]N)(H)	C[6](C[5a]C[5a]N[5a])(C[6]C[6]H)(C[6]C[6]O)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]N)(H){1|H<1>,1|N<3>,1|O<1>,2|C<3>}	C[6](C[5a]C[5a]N[5a])(C[6]C[6]H)(C[6]C[6]O){1|N<3>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.8663	0.193	4	119.8663	0.037	4	120.0840	0.540	294	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]N[6])(H)	C[6](C[5a]C[5a]N[5a])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]N[6])(H){1|Re<6>,1|H<1>,1|N<2>,1|N<3>,3|C<3>}	C[6](C[5a]C[5a]N[5a])(C[6]C[6]H)2{1|C<3>,1|N<2>,2|H<1>,2|N<3>}	H(C[6]C[6]2)	120.0435	0.196	2	120.0435	0.038	2	120.0840	0.540	294	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]N[6])(H)	C[6](C[5a]C[5a]O[5a])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]N[6])(H){1|Re<6>,1|H<1>,1|N<3>,1|O<2>,3|C<3>}	C[6](C[5a]C[5a]O[5a])(C[6]C[6]H)2{1|H<1>,1|N<3>,4|C<3>}	H(C[6]C[6]2)	119.9760	0.000	1	119.9760	0.000	1	120.0840	0.540	294	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]N[6])(H)	C[6](C[5a]C[5a]S[5a])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]N[6])(H){1|Fe<6>,1|H<1>,1|N<3>,1|S<2>,3|C<3>}	C[6](C[5a]C[5a]S[5a])(C[6]C[6]H)2{1|H<1>,1|N<3>,4|C<3>}	H(C[6]C[6]2)	119.8705	0.127	4	119.9911	0.108	27	120.0840	0.540	294	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]N[6])(H)	C[6](C[5a]C[5a]S[5a])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]N[6])(H){1|Pt<4>,1|H<1>,1|N<3>,1|S<2>,3|C<3>}	C[6](C[5a]C[5a]S[5a])(C[6]C[6]H)2{1|H<1>,1|N<3>,4|C<3>}	H(C[6]C[6]2)	120.2320	0.393	2	119.9911	0.108	27	120.0840	0.540	294	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]N[6])(H)	C[6](C[5a]C[5a]S[5a])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]N[6])(H){1|Re<6>,1|H<1>,1|N<3>,1|S<2>,3|C<3>}	C[6](C[5a]C[5a]S[5a])(C[6]C[6]H)2{1|H<1>,1|N<3>,4|C<3>}	H(C[6]C[6]2)	119.4410	0.000	1	119.9911	0.108	27	120.0840	0.540	294	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]N[6])(H)	C[6](C[5a]C[5a]S[5a])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]N[6])(H){1|Ru<6>,1|H<1>,1|N<3>,1|S<2>,3|C<3>}	C[6](C[5a]C[5a]S[5a])(C[6]C[6]H)2{1|H<1>,1|N<3>,4|C<3>}	H(C[6]C[6]2)	120.0831	0.342	8	119.9911	0.108	27	120.0840	0.540	294	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]N[6])(H)	C[6](C[5a]C[5a]S[5a])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]N[6])(H){1|Zn<5>,1|H<1>,1|N<3>,1|S<2>,3|C<3>}	C[6](C[5a]C[5a]S[5a])(C[6]C[6]H)2{1|H<1>,1|N<3>,4|C<3>}	H(C[6]C[6]2)	119.9659	0.368	8	119.9911	0.108	27	120.0840	0.540	294	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]N[6])(H)	C[6](C[5a]C[5a]S[5a])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]N[6])(H){1|Zn<6>,1|H<1>,1|N<3>,1|S<2>,3|C<3>}	C[6](C[5a]C[5a]S[5a])(C[6]C[6]H)2{1|H<1>,1|N<3>,4|C<3>}	H(C[6]C[6]2)	119.9955	0.310	4	119.9911	0.108	27	120.0840	0.540	294	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]O)(H)	C[6](C[5a]C[5a,6a]C[5a])(C[6]C[6]H)(C[6]C[6]O)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]O)(H){1|H<1>,1|O<1>,3|C<3>}	C[6](C[5a]C[5a,6a]C[5a])(C[6]C[6]H)(C[6]C[6]O){1|C<4>,1|H<1>,1|N<3>,1|O<1>,3|C<3>}	H(C[6]C[6]2)	118.4110	0.000	1	118.4110	0.000	1	120.0840	0.540	294	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]O)(H)	C[6](C[5a]C[5a]N[5a])(C[6]C[6]H)(C[6]C[6]O)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]O)(H){1|H<1>,1|N<3>,1|O<1>,2|C<3>}	C[6](C[5a]C[5a]N[5a])(C[6]C[6]H)(C[6]C[6]O){1|C<4>,1|O<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.3160	0.000	1	120.3160	0.000	1	120.0840	0.540	294	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6a]N[6])(H)	C[6](C[5a]C[5a]O[5a])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6a]N[6])(H){1|Re<6>,1|H<1>,1|N<2>,1|O<2>,3|C<3>}	C[6](C[5a]C[5a]O[5a])(C[6]C[6]H)2{1|H<1>,1|N<3>,4|C<3>}	H(C[6]C[6]2)	119.5640	0.000	1	119.5640	0.000	1	120.0840	0.540	294	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6a]N[6])(H)	C[6](C[5a]C[5a]S[5a])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6a]N[6])(H){1|Re<6>,1|H<1>,1|N<2>,1|S<2>,3|C<3>}	C[6](C[5a]C[5a]S[5a])(C[6]C[6]H)2{1|H<1>,1|N<3>,4|C<3>}	H(C[6]C[6]2)	119.4700	0.000	1	119.4700	0.000	1	120.0840	0.540	294	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H)	C[6](C[5a]C[5a,6]N[5a])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H){1|N<2>,2|C<3>,2|H<1>}	C[6](C[5a]C[5a,6]N[5a])(C[6]C[6]H)2{1|C<3>,1|C<4>,2|H<1>,2|N<3>}	H(C[6]C[6]2)	119.7795	0.572	2	119.7795	0.327	2	120.0840	0.540	294	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H)	C[6](C[5a]C[5a]N[5a])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H){1|Co<6>,1|H<1>,1|N<2>,2|C<3>}	C[6](C[5a]C[5a]N[5a])(C[6]C[6]H)2{1|C<3>,2|N<3>,3|H<1>}	H(C[6]C[6]2)	120.2980	0.018	2	120.0892	0.232	33	120.0840	0.540	294	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H)	C[6](C[5a]C[5a]N[5a])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H){1|H<1>,1|N<3>,1|O<1>,2|C<3>}	C[6](C[5a]C[5a]N[5a])(C[6]C[6]H)2{1|C<4>,1|N<3>,1|O<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.2230	0.000	1	120.0892	0.232	33	120.0840	0.540	294	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H)	C[6](C[5a]C[5a]N[5a])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H){1|N<2>,2|C<3>,2|H<1>}	C[6](C[5a]C[5a]N[5a])(C[6]C[6]H)2{1|C<3>,2|N<3>,3|H<1>}	H(C[6]C[6]2)	120.1385	0.125	2	120.0892	0.232	33	120.0840	0.540	294	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H)	C[6](C[5a]C[5a]N[5a])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H){1|N<2>,2|C<3>,2|H<1>}	C[6](C[5a]C[5a]N[5a])(C[6]C[6]H)2{2|C<3>,2|H<1>,2|N<3>}	H(C[6]C[6]2)	120.2237	0.077	6	120.0892	0.232	33	120.0840	0.540	294	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H)	C[6](C[5a]C[5a]N[5a])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[5a]C[5a]N[5a])(C[6]C[6]H)2{1|C<3>,1|N<2>,1|N<3>,4|H<1>}	H(C[6]C[6]2)	120.0250	0.057	2	120.0892	0.232	33	120.0840	0.540	294	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H)	C[6](C[5a]C[5a]N[5a])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[5a]C[5a]N[5a])(C[6]C[6]H)2{1|N<2>,1|N<3>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	120.1617	0.308	10	120.0892	0.232	33	120.0840	0.540	294	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H)	C[6](C[5a]C[5a]N[5a])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H){1|Pd<4>,1|H<1>,1|N<2>,2|C<3>}	C[6](C[5a]C[5a]N[5a])(C[6]C[6]H)2{1|C<3>,2|N<3>,3|H<1>}	H(C[6]C[6]2)	119.9447	1.180	4	120.0892	0.232	33	120.0840	0.540	294	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H)	C[6](C[5a]C[5a]N[5a])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H){1|Re<6>,1|H<1>,1|N<2>,2|C<3>}	C[6](C[5a]C[5a]N[5a])(C[6]C[6]H)2{1|C<3>,1|N<2>,2|H<1>,2|N<3>}	H(C[6]C[6]2)	120.2515	0.381	2	120.0892	0.232	33	120.0840	0.540	294	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H)	C[6](C[5a]C[5a]N[5a])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H){1|Zn<4>,1|H<1>,1|N<2>,2|C<3>}	C[6](C[5a]C[5a]N[5a])(C[6]C[6]H)2{1|C<3>,2|N<3>,3|H<1>}	H(C[6]C[6]2)	119.8895	0.542	4	120.0892	0.232	33	120.0840	0.540	294	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H)	C[6](C[5a]C[5a]S[5a])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H){1|H<1>,1|S<2>,3|C<3>}	C[6](C[5a]C[5a]S[5a])(C[6]C[6]H)2{1|N<3>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	119.2685	0.100	2	119.6068	0.166	5	120.0840	0.540	294	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H)	C[6](C[5a]C[5a]S[5a])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H){1|S<2>,2|C<3>,2|H<1>}	C[6](C[5a]C[5a]S[5a])(C[6]C[6]H)2{1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.8323	0.370	3	119.6068	0.166	5	120.0840	0.540	294	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H)	C[6](C[5a]N[5a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[5a]N[5a]2)(C[6]C[6]H)2{1|C<4>,1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1765	0.107	2	120.2202	0.080	60	120.0840	0.540	294	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H)	C[6](C[5a]N[5a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[5a]N[5a]2)(C[6]C[6]H)2{1|N<3>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	119.9130	0.434	2	120.2202	0.080	60	120.0840	0.540	294	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H)	C[6](C[5a]N[5a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<1>,2|N<2>}	C[6](C[5a]N[5a]2)(C[6]C[6]H)2{1|N<2>,2|H<1>,2|N<3>}	H(C[6]C[6]2)	119.8625	0.095	8	120.2202	0.080	60	120.0840	0.540	294	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H)	C[6](C[5a]N[5a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H){1|C<3>,1|N<2>,1|N<3>,2|H<1>}	C[6](C[5a]N[5a]2)(C[6]C[6]H)2{1|C<3>,1|N<2>,1|N<3>,3|H<1>}	H(C[6]C[6]2)	120.4095	0.265	4	120.2202	0.080	60	120.0840	0.540	294	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H)	C[6](C[5a]N[5a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H){1|C<3>,1|N<2>,1|N<3>,2|H<1>}	C[6](C[5a]N[5a]2)(C[6]C[6]H)2{1|C<3>,1|N<2>,2|H<1>,2|N<3>}	H(C[6]C[6]2)	120.1420	0.298	6	120.2202	0.080	60	120.0840	0.540	294	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H)	C[6](C[5a]N[5a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H){1|C<3>,1|N<2>,1|N<3>,2|H<1>}	C[6](C[5a]N[5a]2)(C[6]C[6]H)2{1|Co<6>,1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1465	0.370	2	120.2202	0.080	60	120.0840	0.540	294	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H)	C[6](C[5a]N[5a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H){1|C<3>,1|N<2>,1|N<3>,2|H<1>}	C[6](C[5a]N[5a]2)(C[6]C[6]H)2{1|Fe<6>,1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0870	0.151	2	120.2202	0.080	60	120.0840	0.540	294	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H)	C[6](C[5a]N[5a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H){1|C<3>,1|N<2>,1|N<3>,2|H<1>}	C[6](C[5a]N[5a]2)(C[6]C[6]H)2{1|N<3>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	120.2182	0.288	10	120.2202	0.080	60	120.0840	0.540	294	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H)	C[6](C[5a]N[5a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H){1|C<3>,1|N<2>,1|N<3>,2|H<1>}	C[6](C[5a]N[5a]2)(C[6]C[6]H)2{1|N<3>,2|N<2>,3|H<1>}	H(C[6]C[6]2)	120.3520	0.230	4	120.2202	0.080	60	120.0840	0.540	294	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H)	C[6](C[5a]N[5a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H){1|C<3>,2|H<1>,2|N<2>}	C[6](C[5a]N[5a]2)(C[6]C[6]H)2{1|C<3>,2|H<1>,2|N<3>}	H(C[6]C[6]2)	120.4118	0.247	6	120.2202	0.080	60	120.0840	0.540	294	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H)	C[6](C[5a]N[5a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H){1|C<3>,2|H<1>,2|N<2>}	C[6](C[5a]N[5a]2)(C[6]C[6]H)2{1|N<2>,2|H<1>,2|N<3>}	H(C[6]C[6]2)	120.4045	0.189	6	120.2202	0.080	60	120.0840	0.540	294	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H)	C[6](C[5a]N[5a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H){1|Cd<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[5a]N[5a]2)(C[6]C[6]H)2{1|N<2>,1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4200	0.140	4	120.2202	0.080	60	120.0840	0.540	294	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H)	C[6](C[5a]N[5a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>,2|N<2>}	C[6](C[5a]N[5a]2)(C[6]C[6]H)2{1|C<3>,2|H<1>,2|N<3>}	H(C[6]C[6]2)	120.1575	0.155	2	120.2202	0.080	60	120.0840	0.540	294	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H)	C[6](C[5a]N[5a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|H<1>,2|N<2>}	C[6](C[5a]N[5a]2)(C[6]C[6]H)2{1|N<2>,2|H<1>,2|N<3>}	H(C[6]C[6]2)	120.3475	0.110	2	120.2202	0.080	60	120.0840	0.540	294	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H)	C[6](C[5a]N[5a]O[5a])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|N<2>,1|O<1>,1|O<2>}	C[6](C[5a]N[5a]O[5a])(C[6]C[6]H)2{1|C<3>,1|N<2>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.8883	0.304	33	120.2708	0.237	80	120.0840	0.540	294	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H)	C[6](C[5a]N[5a]O[5a])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H){1|C<3>,1|N<2>,1|O<2>,2|H<1>}	C[6](C[5a]N[5a]O[5a])(C[6]C[6]H)2{1|C<3>,1|N<2>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.6039	0.462	23	120.2708	0.237	80	120.0840	0.540	294	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H)	C[6](C[5a]N[5a]O[5a])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>,1|N<2>,1|O<2>}	C[6](C[5a]N[5a]O[5a])(C[6]C[6]H)2{1|C<3>,1|N<2>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.5867	0.229	12	120.2708	0.237	80	120.0840	0.540	294	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H)	C[6](C[5a]N[5a]O[5a])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>,1|N<2>,1|O<2>}	C[6](C[5a]N[5a]O[5a])(C[6]C[6]H)2{1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6070	0.225	2	120.2708	0.237	80	120.0840	0.540	294	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H)	C[6](C[5a]N[5a]O[5a])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>,1|N<2>,1|O<2>}	C[6](C[5a]N[5a]O[5a])(C[6]C[6]H)2{1|C<3>,1|N<2>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.7235	0.011	2	120.2708	0.237	80	120.0840	0.540	294	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H)	C[6](C[5a]N[5a]O[5a])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|H<1>,1|N<2>,1|O<2>}	C[6](C[5a]N[5a]O[5a])(C[6]C[6]H)2{1|C<3>,1|N<2>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.9123	0.281	4	120.2708	0.237	80	120.0840	0.540	294	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H)	C[6](C[5a]N[5a]O[5a])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>,1|N<2>,1|O<2>}	C[6](C[5a]N[5a]O[5a])(C[6]C[6]H)2{1|C<3>,1|N<2>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.3015	0.107	2	120.2708	0.237	80	120.0840	0.540	294	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H)	C[6](C[5a]N[5a]O[5a])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>,1|N<2>,1|O<2>}	C[6](C[5a]N[5a]O[5a])(C[6]C[6]H)2{1|C<3>,1|N<2>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.7545	0.060	2	120.2708	0.237	80	120.0840	0.540	294	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H)	C[6](C[5a]N[5a]S[5a])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|N<2>,1|S<2>}	C[6](C[5a]N[5a]S[5a])(C[6]C[6]H)2{1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	118.9135	0.329	2	120.2109	0.362	14	120.0840	0.540	294	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H)	C[6](C[5a]N[5a]S[5a])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H){1|C<3>,1|N<2>,1|S<2>,2|H<1>}	C[6](C[5a]N[5a]S[5a])(C[6]C[6]H)2{1|C<3>,1|N<2>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.3450	0.274	4	120.2109	0.362	14	120.0840	0.540	294	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H)	C[6](C[5a]N[5a]S[5a])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H){1|C<3>,1|N<2>,1|S<2>,2|H<1>}	C[6](C[5a]N[5a]S[5a])(C[6]C[6]H)2{1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2165	0.105	2	120.2109	0.362	14	120.0840	0.540	294	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H)	C[6](C[5a]N[5a]S[5a])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>,1|N<2>,1|S<2>}	C[6](C[5a]N[5a]S[5a])(C[6]C[6]H)2{1|C<3>,1|N<2>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.3870	0.195	2	120.2109	0.362	14	120.0840	0.540	294	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H)	C[6](C[5a]N[5a]S[5a])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H){1|Cu<6>,1|C<3>,1|H<1>,1|N<2>,1|S<2>}	C[6](C[5a]N[5a]S[5a])(C[6]C[6]H)2{1|C<3>,1|N<2>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.7105	0.176	2	120.2109	0.362	14	120.0840	0.540	294	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H)	C[6](C[5a]N[5a]S[5a])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>,1|N<2>,1|S<2>}	C[6](C[5a]N[5a]S[5a])(C[6]C[6]H)2{1|C<3>,1|N<2>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.5585	0.221	2	120.2109	0.362	14	120.0840	0.540	294	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])2(H)	C[6](C[5a]C[5a]N[5a])(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])2(H){1|N<3>,2|C<3>,2|H<1>,2|N<2>}	C[6](C[5a]C[5a]N[5a])(C[6]C[6]H)(C[6]N[6]H){1|C<4>,1|H<1>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.5530	1.864	2	119.6099	0.486	12	120.0840	0.540	294	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])2(H)	C[6](C[5a]C[5a]N[5a])(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])2(H){1|N<3>,2|C<3>,2|H<1>,2|N<2>}	C[6](C[5a]C[5a]N[5a])(C[6]C[6]H)(C[6]N[6]H){1|C<4>,1|I<1>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.6213	0.455	10	119.6099	0.486	12	120.0840	0.540	294	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]C[5a,6]C[5a])(C[6]C[6]H)(N[6]C[6]B)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|B<4>,1|H<1>,3|C<3>}	C[6](C[5a]C[5a,6]C[5a])(C[6]C[6]H)(N[6]C[6]B){1|N<3>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.2475	0.139	2	119.2475	0.019	2	119.9042	0.365	33	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]C[5a]N[5a])(C[6]C[6]H)(N[6]C[6]C)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<2>,2|C<3>}	C[6](C[5a]C[5a]N[5a])(C[6]C[6]H)(N[6]C[6]C){1|C<3>,1|N<2>,1|N<3>,3|H<1>}	H(C[6]C[6]2)	119.4110	0.000	1	119.4110	0.000	1	119.9042	0.365	33	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]C[5a]N[5a])(C[6]C[6]H)(N[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|N<2>,2|C<3>,2|H<1>}	C[6](C[5a]C[5a]N[5a])(C[6]C[6]H)(N[6]C[6]H){1|N<3>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	120.0160	0.717	6	120.0574	0.373	8	119.9042	0.365	33	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]C[5a]N[5a])(C[6]C[6]H)(N[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|N<2>,2|C<3>,2|H<1>}	C[6](C[5a]C[5a]N[5a])(C[6]C[6]H)(N[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.2120	0.000	1	120.0574	0.373	8	119.9042	0.365	33	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]C[5a]N[5a])(C[6]C[6]H)(N[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[5a]C[5a]N[5a])(C[6]C[6]H)(N[6]C[6]H){1|C<4>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.1510	0.000	1	120.0574	0.373	8	119.9042	0.365	33	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]C[5a]N[5a])(C[6]C[6]H)(N[6]C[6]O)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>,2|C<3>}	C[6](C[5a]C[5a]N[5a])(C[6]C[6]H)(N[6]C[6]O){3|C<3>,4|H<1>}	H(C[6]C[6]2)	119.0063	0.238	3	119.0063	0.057	3	119.9042	0.365	33	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]N[5a]2)(C[6]C[6]H)(N[6]C[6]C)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[5a]N[5a]2)(C[6]C[6]H)(N[6]C[6]C){2|C<3>,2|H<1>,2|N<2>}	H(C[6]C[6]2)	119.9597	0.240	4	119.9597	0.058	4	119.9042	0.365	33	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]N[5a]2)(C[6]C[6]H)(N[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|C<3>,1|N<2>,1|N<3>,2|H<1>}	C[6](C[5a]N[5a]2)(C[6]C[6]H)(N[6]C[6]H){1|C<3>,2|N<2>,3|H<1>}	H(C[6]C[6]2)	120.4570	0.000	1	120.2931	0.099	12	119.9042	0.365	33	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]N[5a]2)(C[6]C[6]H)(N[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|C<3>,1|N<2>,1|N<3>,2|H<1>}	C[6](C[5a]N[5a]2)(C[6]C[6]H)(N[6]C[6]H){1|N<2>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	120.1392	0.416	5	120.2931	0.099	12	119.9042	0.365	33	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]N[5a]2)(C[6]C[6]H)(N[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|C<3>,1|N<2>,1|N<3>,2|H<1>}	C[6](C[5a]N[5a]2)(C[6]C[6]H)(N[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.0650	0.000	1	120.2931	0.099	12	119.9042	0.365	33	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]N[5a]2)(C[6]C[6]H)(N[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|C<3>,2|H<1>,2|N<2>}	C[6](C[5a]N[5a]2)(C[6]C[6]H)(N[6]C[6]H){1|C<3>,1|N<2>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.4885	0.118	4	120.2931	0.099	12	119.9042	0.365	33	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]N[5a]2)(C[6]C[6]H)(N[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|C<3>,2|H<1>,2|N<2>}	C[6](C[5a]N[5a]2)(C[6]C[6]H)(N[6]C[6]H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3450	0.000	1	120.2931	0.099	12	119.9042	0.365	33	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]N[5a]2)(C[6]C[6]H)(N[6]C[6]O)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>,1|N<3>,1|O<1>}	C[6](C[5a]N[5a]2)(C[6]C[6]H)(N[6]C[6]O){3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.3030	0.000	1	118.9545	0.243	2	119.9042	0.365	33	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]N[5a]2)(C[6]C[6]H)(N[6]C[6]O)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>,1|N<3>,1|O<2>}	C[6](C[5a]N[5a]2)(C[6]C[6]H)(N[6]C[6]O){1|Mn<6>,1|C<3>,2|H<1>,2|N<2>}	H(C[6]C[6]2)	118.6060	0.000	1	118.9545	0.243	2	119.9042	0.365	33	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]N[5a]S[5a])(C[6]C[6]H)(N[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|C<3>,1|N<2>,1|S<2>,2|H<1>}	C[6](C[5a]N[5a]S[5a])(C[6]C[6]H)(N[6]C[6]H){1|N<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1910	0.000	1	120.1910	0.000	1	119.9042	0.365	33	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[3x3,4,3x5,14x6]C[6])(C[6]C[5a]N[6])(H)	C[6](C[5a]C[5a]S[5a])(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[3x3,4,3x5,14x6]C[6])(C[6]C[5a]N[6])(H){1|Ir<6>,1|H<1>,1|S<2>,2|C<3>,4|B<6>}	C[6](C[5a]C[5a]S[5a])(N[6]C[6]Ir)(C[6]C[6]H){1|C<5>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.5025	0.124	2	119.5025	0.015	2	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[5a]N[6])(H)	C[6](C[5a]N[5a]S[5a])(N[6]C[6]Re)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[5a]N[6])(H){1|Re<6>,1|H<1>,1|N<2>,1|N<3>,1|S<2>,2|C<3>}	C[6](C[5a]N[5a]S[5a])(N[6]C[6]Re)(C[6]C[6]H){5|C<3>}	H(C[6]C[6]2)	119.3920	0.000	1	119.2190	0.060	2	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[5a]N[6])(H)	C[6](C[5a]N[5a]S[5a])(N[6]C[6]Re)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[5a]N[6])(H){1|Re<6>,1|H<1>,1|N<2>,2|C<3>,2|S<2>}	C[6](C[5a]N[5a]S[5a])(N[6]C[6]Re)(C[6]C[6]H){5|C<3>}	H(C[6]C[6]2)	119.0460	0.000	1	119.2190	0.060	2	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6,6]H)(H)	C[6](C[5a]C[5a]N[5a])(N[6]C[6,6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6,6]H)(H){1|Pd<4>,1|N<3>,3|C<3>}	C[6](C[5a]C[5a]N[5a])(N[6]C[6,6]Pd)(C[6]C[6]H){1|C<4>,1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	119.8950	0.000	1	119.8950	0.000	1	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6,6]H)(H)	C[6](C[5a]C[5a]N[5a])(N[6]C[6,6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6,6]H)(H){1|Ru<5>,1|N<3>,3|C<3>}	C[6](C[5a]C[5a]N[5a])(N[6]C[6,6]Ru)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.0605	0.254	4	120.0605	0.064	4	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6,6]H)(H)	C[6](C[5a]C[5a]S[5a])(N[6]C[6,6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6,6]H)(H){1|Ru<5>,1|S<2>,3|C<3>}	C[6](C[5a]C[5a]S[5a])(N[6]C[6,6]Ru)(C[6]C[6]H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	119.6720	0.000	1	119.6720	0.000	1	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6,6a]C)(H)	C[6](C[5a]C[5a]S[5a])(N[6]C[6,6a]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6,6a]C)(H){1|Ir<6>,1|S<2>,3|C<3>}	C[6](C[5a]C[5a]S[5a])(N[6]C[6,6a]Ir)(C[6]C[6]H){1|C<4>,4|C<3>}	H(C[6]C[6]2)	119.4273	0.302	4	119.4273	0.091	4	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6,6a]H)(H)	C[6](C[5a]C[5a]N[5a])(N[6]C[6,6a]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6,6a]H)(H){1|Cu<4>,1|N<3>,3|C<3>}	C[6](C[5a]C[5a]N[5a])(N[6]C[6,6a]Cu)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.6670	0.000	1	119.6670	0.000	1	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6,6a]H)(H)	C[6](C[5a]C[5a]N[5a])(N[6]C[6,6a]H)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6,6a]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[5a]C[5a]N[5a])(N[6]C[6,6a]H)(C[6]C[6]H){1|C<4>,1|N<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.6290	0.000	1	119.6290	0.000	1	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6,6a]H)(H)	C[6](C[5a]N[5a]O[5a])(N[6]C[6,6a]O)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6,6a]H)(H){1|N<2>,1|O<1>,1|O<2>,2|C<3>}	C[6](C[5a]N[5a]O[5a])(N[6]C[6,6a]O)(C[6]C[6]H){1|H<1>,4|C<3>}	H(C[6]C[6]2)	119.6715	0.439	2	119.6715	0.193	2	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]C)(H)	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]C)(H){1|Ir<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Ir)(C[6]C[6]H){1|C<4>,1|N<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.2620	0.000	1	119.2620	0.000	1	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]C)(H)	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]C)(H){1|Pt<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Pt)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.2620	0.208	2	119.2620	0.043	2	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]C)(H)	C[6](C[5a]N[5a]2)(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]C)(H){1|Cu<4>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[5a]N[5a]2)(N[6]C[6]Cu)(C[6]C[6]H){1|C<4>,1|H<1>,1|N<2>,2|C<3>}	H(C[6]C[6]2)	119.7720	0.000	1	119.7720	0.000	1	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]C)(H)	C[6](C[5a]N[5a]2)(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[5a]N[5a]2)(N[6]C[6]Fe)(C[6]C[6]H){1|N<3>,2|C<3>,2|N<2>}	H(C[6]C[6]2)	120.9900	0.000	1	120.9900	0.000	1	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]C)(H)	C[6](C[5a]N[5a]2)(N[6]C[6]Zn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]C)(H){1|Zn<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[5a]N[5a]2)(N[6]C[6]Zn)(C[6]C[6]H){1|N<3>,2|C<3>,2|N<2>}	H(C[6]C[6]2)	120.9390	0.103	2	120.9390	0.011	2	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]C)(H)	C[6](C[5a]N[5a]S[5a])(N[6]C[6]Re)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]C)(H){1|Re<6>,1|C<3>,1|H<1>,1|N<2>,1|S<2>}	C[6](C[5a]N[5a]S[5a])(N[6]C[6]Re)(C[6]C[6]H){5|C<3>}	H(C[6]C[6]2)	119.5460	0.000	1	119.5460	0.000	1	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]C[5a]2)(N[6]C[6]Co)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Co<4>,1|H<1>,3|C<3>}	C[6](C[5a]C[5a]2)(N[6]C[6]Co)(C[6]C[6]H){1|N<3>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.5315	0.781	2	120.5315	0.611	2	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]C[5a]2)(N[6]C[6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,3|C<3>}	C[6](C[5a]C[5a]2)(N[6]C[6]Pd)(C[6]C[6]H){1|N<3>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.7270	0.248	3	119.7270	0.061	3	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]C[5a]2)(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,3|C<3>}	C[6](C[5a]C[5a]2)(N[6]C[6]Pt)(C[6]C[6]H){1|N<3>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.5107	0.514	3	119.5107	0.264	3	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Ag)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Ag<3>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Ag)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.9890	0.000	1	119.9890	0.000	1	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Al)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Al<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Al)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.6890	0.000	1	120.6890	0.000	1	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Co)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Co<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Co)(C[6]C[6]H){1|C<4>,1|H<1>,4|C<3>}	H(C[6]C[6]2)	120.5015	0.100	2	120.5015	0.010	2	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Cu<3>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Cu)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.3870	0.000	1	120.5351	1.031	18	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Cu<3>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Cu)(C[6]C[6]H){1|N<2>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	120.2640	0.000	1	120.5351	1.031	18	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Cu)(C[6]C[6]H){1|C<4>,1|H<1>,4|C<3>}	H(C[6]C[6]2)	120.4600	0.000	1	120.5351	1.031	18	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Cu)(C[6]C[6]H){1|C<4>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.9160	0.000	1	120.5351	1.031	18	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Cu)(C[6]C[6]H){1|N<2>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	120.1265	0.185	2	120.5351	1.031	18	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Cu)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.2860	0.361	2	120.5351	1.031	18	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Cu<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Cu)(C[6]C[6]H){1|Cu<5>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.8355	0.725	2	120.5351	1.031	18	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Cu<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Cu)(C[6]C[6]H){1|N<2>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	120.4647	0.187	4	120.5351	1.031	18	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Cu<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Cu)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	121.4340	3.724	2	120.5351	1.031	18	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Cu<5>,1|H<1>,1|N<4>,2|C<3>}	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Cu)(C[6]C[6]H){1|Cu<5>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.6910	0.247	2	120.5351	1.031	18	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Fe<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Fe)(C[6]C[6]H){1|C<4>,1|H<1>,4|C<3>}	H(C[6]C[6]2)	119.6990	0.096	2	120.2712	0.303	6	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Fe<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Fe)(C[6]C[6]H){1|C<4>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.0920	0.000	1	120.2712	0.303	6	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Fe<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Fe)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.3390	0.000	1	120.2712	0.303	6	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Fe<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Fe)(C[6]C[6]H){1|N<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	121.0080	0.000	1	120.2712	0.303	6	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Fe)(C[6]C[6]H){1|N<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.7900	0.000	1	120.2712	0.303	6	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Ir)(C[6]C[6]H){1|N<2>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	120.1346	0.244	9	120.0941	0.055	15	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Ir)(C[6]C[6]H){1|N<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.0760	0.000	1	120.0941	0.055	15	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Ir)(C[6]C[6]H){2|C<3>,2|H<1>,2|N<2>}	H(C[6]C[6]2)	120.0550	0.000	1	120.0941	0.055	15	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Ir)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.9590	0.478	2	120.0941	0.055	15	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Ir)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.0760	0.098	2	120.0941	0.055	15	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Mn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Mn<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Mn)(C[6]C[6]H){1|N<2>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	120.3620	0.000	1	120.3620	0.000	1	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Ni)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Ni<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Ni)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.1503	0.154	3	120.2042	0.351	13	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Ni)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Ni<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Ni)(C[6]C[6]H){1|H<1>,5|C<3>}	H(C[6]C[6]2)	120.7377	0.138	3	120.2042	0.351	13	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Ni)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Ni<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Ni)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.2460	0.192	3	120.2042	0.351	13	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Ni)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Ni)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.8130	0.927	4	120.2042	0.351	13	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Os)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Os<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Os)(C[6]C[6]H){1|N<2>,1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4510	0.264	2	120.3014	0.131	14	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Os)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Os<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Os)(C[6]C[6]H){1|N<2>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	119.9570	0.145	3	120.3014	0.131	14	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Os)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Os<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Os)(C[6]C[6]H){1|N<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.5755	0.221	4	120.3014	0.131	14	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Os)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Os<7>,1|H<1>,1|N<2>,2|C<3>}	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Os)(C[6]C[6]H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.7960	0.000	1	120.3014	0.131	14	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Os)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Os<7>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Os)(C[6]C[6]H){1|N<2>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	120.0870	0.324	4	120.3014	0.131	14	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Pd)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.9646	0.234	15	120.1202	0.123	26	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Pd)(C[6]C[6]H){1|C<4>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.6180	0.000	1	120.1202	0.123	26	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Pd)(C[6]C[6]H){1|N<2>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	120.5097	0.218	4	120.1202	0.123	26	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Pd)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.5650	0.394	3	120.1202	0.123	26	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Pd)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.0610	0.000	1	120.1202	0.123	26	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Pd<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Pd)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.1210	0.216	2	120.1202	0.123	26	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Pt)(C[6]C[6]H){1|C<4>,1|N<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.7970	0.296	2	120.5232	0.244	26	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Pt)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.1180	0.296	2	120.5232	0.244	26	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Pt)(C[6]C[6]H){1|N<2>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	120.5352	0.184	6	120.5232	0.244	26	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Pt)(C[6]C[6]H){1|N<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.6530	0.281	5	120.5232	0.244	26	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Pt)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.9600	0.827	3	120.5232	0.244	26	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Pt)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.3717	0.466	3	120.5232	0.244	26	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Pt<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Pt)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.1775	0.807	4	120.5232	0.244	26	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Pt<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Pt)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.5930	0.000	1	120.5232	0.244	26	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Re)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Re<6>,1|H<1>,1|N<2>,2|C<3>}	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Re)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.8580	0.000	1	119.8580	0.000	1	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Rh)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Rh<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Rh)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.7690	0.000	1	119.7690	0.000	1	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Ru)(C[6]C[6]H){1|N<2>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	120.2110	0.000	1	120.1638	0.061	13	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Ru<8>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Ru)(C[6]C[6]H){1|Cl<1>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.9975	0.033	2	120.1638	0.061	13	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Ru<8>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Ru)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.1924	0.271	10	120.1638	0.061	13	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Sn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Sn<3>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Sn)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.4441	0.638	14	120.4335	0.318	18	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Sn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Sn<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Sn)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.3963	0.199	4	120.4335	0.318	18	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Zn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Zn<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Zn)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.8925	0.265	2	120.1325	0.120	4	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Zn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Zn<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Zn)(C[6]C[6]H){2|H<1>,5|C<3>}	H(C[6]C[6]2)	120.5450	0.000	1	120.1325	0.120	4	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Zn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Zn<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Zn)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.2000	0.000	1	120.1325	0.120	4	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]C[5a]O[5a])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|H<1>,1|O<2>,2|C<3>}	C[6](C[5a]C[5a]O[5a])(N[6]C[6]Cu)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.9160	0.000	1	119.5545	0.261	2	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]C[5a]O[5a])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|H<1>,1|O<2>,2|C<3>}	C[6](C[5a]C[5a]O[5a])(N[6]C[6]Cu)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.1930	0.000	1	119.5545	0.261	2	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]C[5a]S[5a])(N[6]C[6]Au)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Au<4>,1|H<1>,1|S<2>,2|C<3>}	C[6](C[5a]C[5a]S[5a])(N[6]C[6]Au)(C[6]C[6]H){2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.8860	0.000	1	119.8860	0.000	1	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]C[5a]S[5a])(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|H<1>,1|S<2>,2|C<3>}	C[6](C[5a]C[5a]S[5a])(N[6]C[6]Ir)(C[6]C[6]H){2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.0412	0.327	17	120.0454	0.092	20	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]C[5a]S[5a])(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Ir<7>,1|H<1>,1|S<2>,2|C<3>}	C[6](C[5a]C[5a]S[5a])(N[6]C[6]Ir)(C[6]C[6]H){2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.0690	0.114	3	120.0454	0.092	20	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]C[5a]S[5a])(N[6]C[6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,1|S<2>,2|C<3>}	C[6](C[5a]C[5a]S[5a])(N[6]C[6]Pd)(C[6]C[6]H){2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.5914	1.654	8	119.5914	2.735	8	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]C[5a]S[5a])(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|C<4>,1|S<2>,2|C<3>}	C[6](C[5a]C[5a]S[5a])(N[6]C[6]Pt)(C[6]C[6]H){2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.1810	0.057	2	120.3140	0.121	22	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]C[5a]S[5a])(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,1|S<2>,2|C<3>}	C[6](C[5a]C[5a]S[5a])(N[6]C[6]Pt)(C[6]C[6]H){1|C<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.6571	0.247	7	120.3140	0.121	22	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]C[5a]S[5a])(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,1|S<2>,2|C<3>}	C[6](C[5a]C[5a]S[5a])(N[6]C[6]Pt)(C[6]C[6]H){2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.1498	0.283	13	120.3140	0.121	22	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]C[5a]S[5a])(N[6]C[6]Re)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Re<6>,1|H<1>,1|S<2>,2|C<3>}	C[6](C[5a]C[5a]S[5a])(N[6]C[6]Re)(C[6]C[6]H){2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.9520	0.000	1	119.9520	0.000	1	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]N[5a]2)(N[6]C[6]Al)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Al<4>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[5a]N[5a]2)(N[6]C[6]Al)(C[6]C[6]H){1|C<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.7970	0.181	2	120.7967	0.016	3	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]N[5a]2)(N[6]C[6]Al)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Al<5>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[5a]N[5a]2)(N[6]C[6]Al)(C[6]C[6]H){1|C<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.7960	0.000	1	120.7967	0.016	3	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]N[5a]2)(N[6]C[6]Cd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Cd<6>,1|N<2>,1|N<3>,2|C<3>}	C[6](C[5a]N[5a]2)(N[6]C[6]Cd)(C[6]C[6]H){1|C<3>,2|H<1>,2|N<2>}	H(C[6]C[6]2)	120.4840	0.000	1	120.4840	0.000	1	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]N[5a]2)(N[6]C[6]Co)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Co<5>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[5a]N[5a]2)(N[6]C[6]Co)(C[6]C[6]H){1|N<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5930	0.000	1	120.5644	0.084	16	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]N[5a]2)(N[6]C[6]Co)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Co<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[5a]N[5a]2)(N[6]C[6]Co)(C[6]C[6]H){1|C<3>,2|H<1>,2|N<2>}	H(C[6]C[6]2)	121.0990	0.000	1	120.5644	0.084	16	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]N[5a]2)(N[6]C[6]Co)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Co<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[5a]N[5a]2)(N[6]C[6]Co)(C[6]C[6]H){1|H<1>,4|C<3>}	H(C[6]C[6]2)	120.4570	0.000	1	120.5644	0.084	16	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]N[5a]2)(N[6]C[6]Co)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Co<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[5a]N[5a]2)(N[6]C[6]Co)(C[6]C[6]H){1|N<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.7963	0.111	6	120.5644	0.084	16	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]N[5a]2)(N[6]C[6]Co)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Co<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[5a]N[5a]2)(N[6]C[6]Co)(C[6]C[6]H){2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.3220	0.114	5	120.5644	0.084	16	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]N[5a]2)(N[6]C[6]Co)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Co<6>,1|N<2>,1|N<3>,2|C<3>}	C[6](C[5a]N[5a]2)(N[6]C[6]Co)(C[6]C[6]H){2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.2470	0.167	2	120.5644	0.084	16	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]N[5a]2)(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Cu<3>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[5a]N[5a]2)(N[6]C[6]Cu)(C[6]C[6]H){2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.3180	0.000	1	120.6974	0.045	12	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]N[5a]2)(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[5a]N[5a]2)(N[6]C[6]Cu)(C[6]C[6]H){1|C<3>,2|H<1>,2|N<2>}	H(C[6]C[6]2)	120.7390	0.134	5	120.6974	0.045	12	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]N[5a]2)(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[5a]N[5a]2)(N[6]C[6]Cu)(C[6]C[6]H){1|C<4>,1|H<1>,1|N<2>,2|C<3>}	H(C[6]C[6]2)	120.6830	0.000	1	120.6974	0.045	12	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]N[5a]2)(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[5a]N[5a]2)(N[6]C[6]Cu)(C[6]C[6]H){1|N<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5727	0.167	3	120.6974	0.045	12	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]N[5a]2)(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[5a]N[5a]2)(N[6]C[6]Cu)(C[6]C[6]H){1|H<1>,4|C<3>}	H(C[6]C[6]2)	120.9230	0.000	1	120.6974	0.045	12	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]N[5a]2)(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Cu<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[5a]N[5a]2)(N[6]C[6]Cu)(C[6]C[6]H){1|N<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	121.0320	0.000	1	120.6974	0.045	12	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]N[5a]2)(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Fe<5>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[5a]N[5a]2)(N[6]C[6]Fe)(C[6]C[6]H){1|H<1>,4|C<3>}	H(C[6]C[6]2)	120.7985	0.122	2	120.7616	0.507	28	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]N[5a]2)(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[5a]N[5a]2)(N[6]C[6]Fe)(C[6]C[6]H){1|C<3>,1|H<1>,1|N<3>,2|N<2>}	H(C[6]C[6]2)	121.1442	1.887	4	120.7616	0.507	28	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]N[5a]2)(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[5a]N[5a]2)(N[6]C[6]Fe)(C[6]C[6]H){1|C<3>,2|H<1>,2|N<2>}	H(C[6]C[6]2)	120.7447	0.166	3	120.7616	0.507	28	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]N[5a]2)(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[5a]N[5a]2)(N[6]C[6]Fe)(C[6]C[6]H){1|H<1>,4|C<3>}	H(C[6]C[6]2)	120.6780	0.000	1	120.7616	0.507	28	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]N[5a]2)(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[5a]N[5a]2)(N[6]C[6]Fe)(C[6]C[6]H){1|N<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.7470	0.000	1	120.7616	0.507	28	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]N[5a]2)(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[5a]N[5a]2)(N[6]C[6]Fe)(C[6]C[6]H){2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.2694	0.038	5	120.7616	0.507	28	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]N[5a]2)(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Fe<8>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[5a]N[5a]2)(N[6]C[6]Fe)(C[6]C[6]H){1|H<1>,2|C<3>,2|N<2>}	H(C[6]C[6]2)	120.8453	0.306	12	120.7616	0.507	28	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]N[5a]2)(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Br<1>,1|Ir<6>,1|C<3>,1|N<2>,1|N<3>}	C[6](C[5a]N[5a]2)(N[6]C[6]Ir)(C[6]C[6]H){1|C<3>,2|H<1>,2|N<2>}	H(C[6]C[6]2)	120.6980	0.000	1	120.4057	0.178	23	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]N[5a]2)(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[5a]N[5a]2)(N[6]C[6]Ir)(C[6]C[6]H){1|C<3>,2|H<1>,2|N<2>}	H(C[6]C[6]2)	120.0850	0.838	3	120.4057	0.178	23	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]N[5a]2)(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[5a]N[5a]2)(N[6]C[6]Ir)(C[6]C[6]H){1|N<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5021	0.337	16	120.4057	0.178	23	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]N[5a]2)(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[5a]N[5a]2)(N[6]C[6]Ir)(C[6]C[6]H){2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.1143	0.088	3	120.4057	0.178	23	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]N[5a]2)(N[6]C[6]Mn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[5a]N[5a]2)(N[6]C[6]Mn)(C[6]C[6]H){1|C<3>,2|H<1>,2|N<2>}	H(C[6]C[6]2)	120.6165	0.135	2	120.6129	0.350	7	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]N[5a]2)(N[6]C[6]Mn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[5a]N[5a]2)(N[6]C[6]Mn)(C[6]C[6]H){1|H<1>,4|C<3>}	H(C[6]C[6]2)	120.8380	1.273	2	120.6129	0.350	7	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]N[5a]2)(N[6]C[6]Mn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[5a]N[5a]2)(N[6]C[6]Mn)(C[6]C[6]H){1|N<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6585	0.228	2	120.6129	0.350	7	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]N[5a]2)(N[6]C[6]Mn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[5a]N[5a]2)(N[6]C[6]Mn)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.0640	0.000	1	120.6129	0.350	7	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]N[5a]2)(N[6]C[6]Ni)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[5a]N[5a]2)(N[6]C[6]Ni)(C[6]C[6]H){1|N<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6740	0.000	1	120.6740	0.000	1	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]N[5a]2)(N[6]C[6]Os)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Os<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[5a]N[5a]2)(N[6]C[6]Os)(C[6]C[6]H){1|N<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3020	0.258	4	120.4265	0.119	6	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]N[5a]2)(N[6]C[6]Os)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Os<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[5a]N[5a]2)(N[6]C[6]Os)(C[6]C[6]H){2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.6755	0.459	2	120.4265	0.119	6	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]N[5a]2)(N[6]C[6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[5a]N[5a]2)(N[6]C[6]Pd)(C[6]C[6]H){1|N<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4655	0.129	2	120.4655	0.017	2	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]N[5a]2)(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Pt<3>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[5a]N[5a]2)(N[6]C[6]Pt)(C[6]C[6]H){1|H<1>,1|N<2>,3|C<3>}	H(C[6]C[6]2)	120.9940	0.042	2	121.0046	0.008	7	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]N[5a]2)(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[5a]N[5a]2)(N[6]C[6]Pt)(C[6]C[6]H){1|H<1>,1|N<2>,3|C<3>}	H(C[6]C[6]2)	121.0088	0.109	5	121.0046	0.008	7	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]N[5a]2)(N[6]C[6]Re)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Re<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[5a]N[5a]2)(N[6]C[6]Re)(C[6]C[6]H){2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.5700	0.000	1	120.5700	0.000	1	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]N[5a]2)(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[5a]N[5a]2)(N[6]C[6]Ru)(C[6]C[6]H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.9524	0.250	5	120.8377	0.085	7	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]N[5a]2)(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[5a]N[5a]2)(N[6]C[6]Ru)(C[6]C[6]H){1|N<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4280	0.000	1	120.8377	0.085	7	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]N[5a]2)(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[5a]N[5a]2)(N[6]C[6]Ru)(C[6]C[6]H){2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.6740	0.000	1	120.8377	0.085	7	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]N[5a]2)(N[6]C[6]Zn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Zn<5>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[5a]N[5a]2)(N[6]C[6]Zn)(C[6]C[6]H){1|H<1>,4|C<3>}	H(C[6]C[6]2)	117.7780	0.000	1	120.3378	0.949	9	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]N[5a]2)(N[6]C[6]Zn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Zn<5>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[5a]N[5a]2)(N[6]C[6]Zn)(C[6]C[6]H){1|N<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.7447	0.144	3	120.3378	0.949	9	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]N[5a]2)(N[6]C[6]Zn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Zn<5>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[5a]N[5a]2)(N[6]C[6]Zn)(C[6]C[6]H){2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.6150	0.187	2	120.3378	0.949	9	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]N[5a]2)(N[6]C[6]Zn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Zn<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[5a]N[5a]2)(N[6]C[6]Zn)(C[6]C[6]H){1|H<1>,4|C<3>}	H(C[6]C[6]2)	120.7130	0.000	1	120.3378	0.949	9	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]N[5a]2)(N[6]C[6]Zn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Zn<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[5a]N[5a]2)(N[6]C[6]Zn)(C[6]C[6]H){1|N<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5425	0.298	2	120.3378	0.949	9	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]N[5a]O[5a])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Cu<6>,1|C<3>,1|H<1>,1|N<2>,1|O<2>}	C[6](C[5a]N[5a]O[5a])(N[6]C[6]Cu)(C[6]C[6]H){1|C<4>,1|H<1>,1|N<2>,2|C<3>}	H(C[6]C[6]2)	114.3440	0.000	1	114.3440	0.000	1	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H)	C[6](C[5a]N[5a]O[5a])(N[6]C[6]Zn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(H){1|Zn<6>,1|C<3>,1|H<1>,1|N<2>,1|O<2>}	C[6](C[5a]N[5a]O[5a])(N[6]C[6]Zn)(C[6]C[6]H){1|C<4>,1|H<1>,1|N<2>,2|C<3>}	H(C[6]C[6]2)	117.4460	0.000	1	117.4460	0.000	1	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6a]C[6])(H)	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6a]C[6])(H){1|Pt<4>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[5a]C[5a]N[5a])(N[6]C[6]Pt)(C[6]C[6]H){1|N<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.1390	0.000	1	120.1390	0.000	1	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6a]C[6])(H)	C[6](C[5a]N[5a]S[5a])(N[6]C[6]Re)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6a]C[6])(H){1|Re<6>,1|H<1>,1|N<2>,1|S<2>,3|C<3>}	C[6](C[5a]N[5a]S[5a])(N[6]C[6]Re)(C[6]C[6]H){5|C<3>}	H(C[6]C[6]2)	119.2885	0.377	2	119.2503	0.075	3	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6a]C[6])(H)	C[6](C[5a]N[5a]S[5a])(N[6]C[6]Re)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6a]C[6])(H){1|Re<6>,1|H<1>,1|S<2>,2|C<3>,2|N<2>}	C[6](C[5a]N[5a]S[5a])(N[6]C[6]Re)(C[6]C[6]H){5|C<3>}	H(C[6]C[6]2)	119.1740	0.000	1	119.2503	0.075	3	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])2(H)	C[6](C[5a]C[5a]S[5a])(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])2(H){2|Pt<4>,2|S<2>,3|C<3>}	C[6](C[5a]C[5a]S[5a])(N[6]C[6]Pt)(C[6]C[6]H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.2710	0.144	2	120.2710	0.021	2	120.2912	0.504	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[5]O[6])(C[6]C[6,6]C)(H)	C[6](C[6,6]C[5,6,6]C[6])(C[6]C[6]H)(CCO)	H(C[6]C[6]2)	C[6](C[6]C[5]O[6])(C[6]C[6,6]C)(H){1|C<4>,3|C<3>}	C[6](C[6,6]C[5,6,6]C[6])(C[6]C[6]H)(CCO){1|C<3>,1|O<1>,1|O<2>,3|C<4>}	H(C[6]C[6]2)	122.4870	0.000	1	122.4870	0.000	1	122.4870	0.000	1	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6]C[6])(C[6]C[6a]N[6])(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6a]C[6])(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]C[6])(C[6]C[6a]N[6])(H){1|C<4>,6|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6a]C[6])(C[6]C[6]H){1|N<3>,2|C<2>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	123.3550	0.000	1	123.3550	0.000	1	123.3550	0.000	1	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6,6]N)(C[6]C[6]H)(H)	C[6](C[6,6]C[6,6a]N[6,6])(C[6]C[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6,6]N)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6,6]C[6,6a]N[6,6])(C[6]C[6]H)(NHH){1|C<4>,1|H<1>,1|N<2>,2|C<3>}	H(C[6]C[6]2)	119.5150	0.000	1	119.5150	0.000	1	119.9920	0.455	2	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6,6]N)(C[6]C[6]H)(H)	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(NFeC)	H(C[6]C[6]2)	C[6](C[6]C[6,6]N)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(NFeC){1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.4690	0.000	1	120.4690	0.000	1	119.9920	0.455	2	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:O-3:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H)	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(OCu2)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]H)(OCu2){1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.2930	0.000	1	120.2930	0.000	1	120.2930	0.000	1	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6]C[6a])(C[6]C[6]N[6])(H)	C[6](C[6,6]C[6,6]C[6])(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]C[6a])(C[6]C[6]N[6])(H){1|Cd<5>,1|C<4>,1|N<3>,4|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6a]C[6a]2)(C[6]C[6]H){1|N<3>,2|C<4>,3|H<1>,4|C<3>}	H(C[6]C[6]2)	120.0340	0.000	1	120.0340	0.000	1	118.8210	2.943	2	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6]C[6a])(C[6]O[6]W)(H)	C[6](C[6,6]C[6,6a]C[6,6])(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]C[6a])(C[6]O[6]W)(H){4|C<3>}	C[6](C[6,6]C[6,6a]C[6,6])(C[6a]C[6a]2)(C[6]C[6]H){1|C<4>,1|O<2>,1|W<6>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	117.6080	0.000	1	117.6080	0.000	1	118.8210	2.943	2	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6,6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]C[6,6])(C[6]C[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[3x6]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C[6,6])(C[6]C[6]H)(H){1|O<1>,2|C<3>,2|C<4>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6,6]C[3x6]2)(C[6]C[6]H){3|C<3>,4|C<4>,4|H<1>}	H(C[6]C[6]2)	118.4940	0.000	1	118.4940	0.000	1	118.4940	0.000	1	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]C[5,6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]C[5,6]H)(H){4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CCH){1|C<4>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	118.5080	0.000	1	118.5080	0.000	1	119.5958	0.618	55	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]C[6]C)(H)	C[6](C[6,6a]N[6,6a]C[6a])(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6,6a]N[6,6a]C[6a])(C[6]C[6]H)(COO){1|H<1>,4|C<3>}	H(C[6]C[6]2)	119.5390	0.000	1	119.5390	0.000	1	119.5958	0.618	55	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]C[6]N[6])(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]C[6]N[6])(H){1|Cu<4>,1|N<3>,3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(COO){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.2710	0.000	1	120.0474	0.020	5	119.5958	0.618	55	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]C[6]N[6])(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]C[6]N[6])(H){1|Mn<6>,1|N<3>,3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(COO){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	119.9450	0.103	2	120.0474	0.020	5	119.5958	0.618	55	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]C[6]N[6])(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]C[6]N[6])(H){1|Os<6>,1|N<3>,3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(COO){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.0380	0.007	2	120.0474	0.020	5	119.5958	0.618	55	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CCC)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]N[6]C)(H){1|C<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CCC){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	117.8595	0.226	2	117.8595	0.051	2	119.5958	0.618	55	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]N[6]C)(H){1|Re<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(COO){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.0457	0.101	3	120.0457	0.010	3	119.5958	0.618	55	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H){1|C<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CCH){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.6643	0.726	7	119.6643	0.527	7	119.5958	0.618	55	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CC[5]C)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H){1|C<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CC[5]C){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.4150	0.000	1	119.4150	0.000	1	119.5958	0.618	55	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CC[5a]2)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H){1|Cu<5>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CC[5a]2){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2010	0.112	2	120.2010	0.012	2	119.5958	0.618	55	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CHN){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7090	0.318	10	119.7090	0.101	10	119.5958	0.618	55	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CHO)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H){1|Ir<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CHO){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1960	0.000	1	120.1960	0.000	1	119.5958	0.618	55	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(COO){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0330	0.186	7	119.8939	0.184	8	119.5958	0.618	55	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H){1|O<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(COO){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	118.9200	0.000	1	119.8939	0.184	8	119.5958	0.618	55	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]O[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CCC)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]O[6]C)(H){2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CCC){1|H<1>,1|O<2>,3|C<3>}	H(C[6]C[6]2)	118.7280	0.000	1	118.7280	0.000	1	119.5958	0.618	55	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]O[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]O[6]C)(H){2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CCH){1|C<3>,1|C<4>,1|O<1>,2|O<2>}	H(C[6]C[6]2)	118.0500	0.000	1	118.0500	0.000	1	119.5958	0.618	55	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]O[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CC[6a]O)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]O[6]C)(H){2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CC[6a]O){2|O<2>,3|C<3>}	H(C[6]C[6]2)	118.1710	0.000	1	118.1710	0.000	1	119.5958	0.618	55	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]O[6]O)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CHH)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]O[6]O)(H){2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CHH){1|H<1>,1|O<1>,1|O<2>,2|C<3>}	H(C[6]C[6]2)	122.4450	0.000	1	122.4450	0.000	1	119.5958	0.618	55	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]C)(H){1|Pt<4>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CNO){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	119.3410	0.000	1	119.3410	0.000	1	119.5958	0.618	55	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]C)(H){1|Ir<6>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(COO){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	119.4635	0.465	2	119.5027	0.110	6	119.5958	0.618	55	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]C)(H){1|Pd<4>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(COO){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	119.4970	0.000	1	119.5027	0.110	6	119.5958	0.618	55	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]C)(H){1|Pt<4>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(COO){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	119.5307	0.405	3	119.5027	0.110	6	119.5958	0.618	55	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6a]O[6])(C[6]C[6,6a]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CCC)	H(C[6]C[6]2)	C[6](C[6]C[6a]O[6])(C[6]C[6,6a]C)(H){4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CCC){1|H<1>,1|O<2>,3|C<3>}	H(C[6]C[6]2)	118.3965	0.035	2	118.3965	0.001	2	119.5958	0.618	55	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6a]O[6])(C[6]C[6,6a]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6a]O[6])(C[6]C[6,6a]C)(H){4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CCH){1|H<1>,1|O<2>,3|C<3>}	H(C[6]C[6]2)	119.1800	0.000	1	119.1800	0.000	1	119.5958	0.618	55	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]C[6])(C[6]C[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6a]C[6])(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C[6])(C[6]C[6]C)(H){1|O<1>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6a]C[6])(C[6]C[6]H){1|C<4>,2|H<1>,6|C<3>}	H(C[6]C[6]2)	118.0210	0.083	2	118.0210	0.007	2	118.5877	0.967	3	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]C[6])(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5a,6]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C[6])(C[6]N[6]H)(H){1|Pd<4>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5a,6]2)(C[6]C[6]H){2|H<1>,3|N<3>,4|C<3>}	H(C[6]C[6]2)	119.7210	0.000	1	119.7210	0.000	1	118.5877	0.967	3	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6,6a]N)(C[6]C[6]O)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(NC[3x6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]N)(C[6]C[6]O)(H){1|O<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(NC[3x6]H){1|H<1>,1|O<1>,3|C<3>}	H(C[6]C[6]2)	118.2480	0.000	1	118.2480	0.000	1	119.8464	0.872	25	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6,6a]N)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(NC[6a]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]N)(C[6]N[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(NC[6a]H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.4480	0.000	1	119.4480	0.000	1	119.8464	0.872	25	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6,6a]N)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]N)(C[6]N[6]C)(H){1|C<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(NHH){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	119.4945	1.401	2	119.8618	3.111	6	119.8464	0.872	25	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6,6a]N)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]N)(C[6]N[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(NHH){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.5115	0.021	2	119.8618	3.111	6	119.8464	0.872	25	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6,6a]N)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]N)(C[6]N[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(NHH){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.5795	3.471	2	119.8618	3.111	6	119.8464	0.872	25	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6,6a]N)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]N)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(NCH){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8357	0.084	4	119.8357	0.007	4	119.8464	0.872	25	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6,6a]N)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(NC[6a]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]N)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(NC[6a]H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.6075	0.006	2	119.6075	0.000	2	119.8464	0.872	25	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6,6a]N)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(NHN)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]N)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(NHN){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2174	0.122	7	120.2174	0.015	7	119.8464	0.872	25	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6,6a]N)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(NOO)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]N)(C[6]N[6]H)(H){1|O<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(NOO){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7720	0.223	2	120.0727	0.296	3	119.8464	0.872	25	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6,6a]N)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(NOO)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]N)(C[6]N[6]H)(H){1|O<2>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(NOO){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6740	0.000	1	120.0727	0.296	3	119.8464	0.872	25	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6,6a]N)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]N[6a])(C[6]C[6]H)(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]N)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|N<2>}	C[6](C[6,6a]C[6,6a]N[6a])(C[6]C[6]H)(NCC){1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	118.9960	0.000	1	118.9960	0.000	1	119.8464	0.872	25	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:O-3:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]O[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(OLi2)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]O[6]C)(H){2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(OLi2){1|C<3>,1|C<4>,3|O<2>}	H(C[6]C[6]2)	122.0595	1.972	4	122.0595	3.888	4	122.0595	3.888	4	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]C[6a])(C[6]C[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C[6a])(C[6]C[6]C)(H){1|H<1>,5|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2)(C[6]C[6]H){1|C<4>,3|H<1>,5|C<3>}	H(C[6]C[6]2)	117.5470	0.000	1	117.5470	0.000	1	119.1763	1.079	88	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6,6a]C[6a,6a]N[6,6a])(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6,6a]C[6a,6a]N[6,6a])(C[6a]C[6a]2)(C[6]C[6]H){3|H<1>,6|C<3>}	H(C[6]C[6]2)	119.6990	0.041	2	119.6990	0.002	2	119.1763	1.079	88	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]C[6a])(C[6]C[6a]N[6])(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C[6a])(C[6]C[6a]N[6])(H){1|Ir<6>,6|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2)(C[6]C[6]H){1|N<3>,3|H<1>,5|C<3>}	H(C[6]C[6]2)	118.7280	0.167	2	120.4495	7.614	4	119.1763	1.079	88	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]C[6a])(C[6]C[6a]N[6])(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C[6a])(C[6]C[6a]N[6])(H){1|Pt<4>,6|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2)(C[6]C[6]H){1|N<3>,3|H<1>,5|C<3>}	H(C[6]C[6]2)	122.1710	3.311	2	120.4495	7.614	4	119.1763	1.079	88	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]C[6a])(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C[6a])(C[6]N[6]C)(H){1|Ag<4>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2)(C[6]C[6]H){1|C<4>,1|N<3>,3|H<1>,4|C<3>}	H(C[6]C[6]2)	119.4164	0.223	7	119.1199	0.255	37	119.1763	1.079	88	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]C[6a])(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C[6a])(C[6]N[6]C)(H){1|Co<4>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2)(C[6]C[6]H){1|C<4>,1|N<3>,3|H<1>,4|C<3>}	H(C[6]C[6]2)	119.0015	0.180	6	119.1199	0.255	37	119.1763	1.079	88	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]C[6a])(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C[6a])(C[6]N[6]C)(H){1|Cu<4>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2)(C[6]C[6]H){1|C<4>,1|N<3>,3|H<1>,4|C<3>}	H(C[6]C[6]2)	119.1506	0.598	10	119.1199	0.255	37	119.1763	1.079	88	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]C[6a])(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C[6a])(C[6]N[6]C)(H){1|Hg<4>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2)(C[6]C[6]H){1|C<4>,1|N<3>,3|H<1>,4|C<3>}	H(C[6]C[6]2)	119.3328	0.159	4	119.1199	0.255	37	119.1763	1.079	88	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]C[6a])(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C[6a])(C[6]N[6]C)(H){1|Ni<3>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2)(C[6]C[6]H){1|C<4>,1|N<3>,3|H<1>,4|C<3>}	H(C[6]C[6]2)	118.8220	0.081	2	119.1199	0.255	37	119.1763	1.079	88	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]C[6a])(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C[6a])(C[6]N[6]C)(H){1|O<1>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2)(C[6]C[6]H){1|C<4>,2|H<1>,2|N<3>,4|C<3>}	H(C[6]C[6]2)	118.1620	0.000	1	119.1199	0.255	37	119.1763	1.079	88	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]C[6a])(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C[6a])(C[6]N[6]C)(H){1|Pt<4>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2)(C[6]C[6]H){1|C<4>,1|N<3>,3|H<1>,4|C<3>}	H(C[6]C[6]2)	119.1722	0.976	4	119.1199	0.255	37	119.1763	1.079	88	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]C[6a])(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C[6a])(C[6]N[6]C)(H){1|Re<6>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2)(C[6]C[6]H){1|C<4>,1|N<3>,3|H<1>,4|C<3>}	H(C[6]C[6]2)	118.7270	0.220	3	119.1199	0.255	37	119.1763	1.079	88	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]C[6a])(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C[6a])(C[6]N[6]H)(H){1|Cu<4>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2)(C[6]C[6]H){1|N<3>,4|C<3>,4|H<1>}	H(C[6]C[6]2)	119.7529	0.132	8	119.3256	0.664	40	119.1763	1.079	88	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]C[6a])(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C[6a])(C[6]N[6]H)(H){1|H<1>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2)(C[6]C[6]H){1|N<3>,4|C<3>,4|H<1>}	H(C[6]C[6]2)	119.8610	0.030	2	119.3256	0.664	40	119.1763	1.079	88	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]C[6a])(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C[6a])(C[6]N[6]H)(H){1|Hg<4>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2)(C[6]C[6]H){1|N<3>,4|C<3>,4|H<1>}	H(C[6]C[6]2)	119.6670	0.629	2	119.3256	0.664	40	119.1763	1.079	88	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]C[6a])(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C[6a])(C[6]N[6]H)(H){1|Ir<6>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2)(C[6]C[6]H){1|N<3>,4|C<3>,4|H<1>}	H(C[6]C[6]2)	119.1405	0.397	2	119.3256	0.664	40	119.1763	1.079	88	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]C[6a])(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C[6a])(C[6]N[6]H)(H){1|Mo<6>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2)(C[6]C[6]H){1|N<3>,4|C<3>,4|H<1>}	H(C[6]C[6]2)	119.5885	0.011	2	119.3256	0.664	40	119.1763	1.079	88	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]C[6a])(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C[6a])(C[6]N[6]H)(H){1|Os<6>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2)(C[6]C[6]H){1|N<3>,4|C<3>,4|H<1>}	H(C[6]C[6]2)	119.5265	0.192	4	119.3256	0.664	40	119.1763	1.079	88	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]C[6a])(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C[6a])(C[6]N[6]H)(H){1|Pt<4>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2)(C[6]C[6]H){1|N<3>,4|C<3>,4|H<1>}	H(C[6]C[6]2)	118.7417	1.134	14	119.3256	0.664	40	119.1763	1.079	88	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]C[6a])(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C[6a])(C[6]N[6]H)(H){1|Ru<6>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2)(C[6]C[6]H){1|N<3>,4|C<3>,4|H<1>}	H(C[6]C[6]2)	119.6925	0.264	2	119.3256	0.664	40	119.1763	1.079	88	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]C[6a])(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C[6a])(C[6]N[6]H)(H){1|Ru<8>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2)(C[6]C[6]H){1|N<3>,4|C<3>,4|H<1>}	H(C[6]C[6]2)	119.4195	0.015	2	119.3256	0.664	40	119.1763	1.079	88	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]C[6a])(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C[6a])(C[6]N[6]H)(H){1|Sn<6>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2)(C[6]C[6]H){1|N<3>,4|C<3>,4|H<1>}	H(C[6]C[6]2)	119.8870	0.059	2	119.3256	0.664	40	119.1763	1.079	88	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]C[6a])(C[6]N[6]S)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C[6a])(C[6]N[6]S)(H){1|H<1>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2)(C[6]C[6]H){1|N<3>,1|S<1>,3|H<1>,4|C<3>}	H(C[6]C[6]2)	118.4555	0.124	2	118.4555	0.015	2	119.1763	1.079	88	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]C[6a])(C[6]P[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C[6a])(C[6]P[6]C)(H){6|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2)(C[6]C[6]H){1|C<2>,1|P<4>,3|H<1>,4|C<3>}	H(C[6]C[6]2)	115.6120	0.000	1	115.6995	0.015	2	119.1763	1.079	88	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]C[6a])(C[6]P[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C[6a])(C[6]P[6]C)(H){6|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2)(C[6]C[6]H){1|P<4>,3|H<1>,5|C<3>}	H(C[6]C[6]2)	115.7870	0.000	1	115.6995	0.015	2	119.1763	1.079	88	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:N[5a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]N[5a])(C[6]C[6]O)(H)	C[6](C[6,6a]C[6,6a]C[6a])(N[5a]C[5a,6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]N[5a])(C[6]C[6]O)(H){1|O<1>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(N[5a]C[5a,6a]2)(C[6]C[6]H){1|H<1>,1|O<1>,7|C<3>}	H(C[6]C[6]2)	119.1430	0.000	1	119.1430	0.000	1	119.7150	0.267	4	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:N[5a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]N[5a])(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(N[5a]C[5a]N[5a])(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]N[5a])(C[6]N[6]H)(H){1|Ir<8>,1|N<2>,3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(N[5a]C[5a]N[5a])(C[6]C[6]H){1|N<2>,1|N<3>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.3790	0.000	1	120.3790	0.000	1	119.7150	0.267	4	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:N[5a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]N[5a])(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]N[6a])(N[5a]C[5a,6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]N[5a])(C[6]N[6]H)(H){1|Pt<4>,1|N<2>,3|C<3>}	C[6](C[6,6a]C[6,6a]N[6a])(N[5a]C[5a,6a]2)(C[6]C[6]H){1|H<1>,1|N<3>,6|C<3>}	H(C[6]C[6]2)	119.6690	0.167	2	119.6690	0.028	2	119.7150	0.267	4	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]N[6])(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]N[6a])(N[6]C[6,6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]N[6])(C[6]N[6]H)(H){1|Pt<4>,1|N<2>,3|C<3>}	C[6](C[6,6a]C[6,6a]N[6a])(N[6]C[6,6a]2)(C[6]C[6]H){1|H<1>,1|N<3>,6|C<3>}	H(C[6]C[6]2)	119.6660	0.000	1	119.6660	0.000	1	119.6660	0.000	1	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6,6a]H)(H)	C[6](C[6]C[6,6a]O)(C[5]S[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6,6a]H)(H){1|O<1>,2|C<3>,2|S<2>}	C[6](C[6]C[6,6a]O)(C[5]S[5]2)(C[6]C[6]H){1|H<1>,1|N<2>,1|S<2>,2|C<3>}	H(C[6]C[6]2)	119.6290	0.000	1	119.6290	0.000	1	119.9787	0.095	3	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]Ir)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H){1|Ir<6>,1|C<2>,1|C<4>,2|N<3>}	C[6](C[6]C[6]Ir)(C[5]N[5]2)(C[6]C[6]H){1|H<1>,4|C<3>}	H(C[6]C[6]2)	120.0940	0.000	1	120.0940	0.000	1	119.9787	0.095	3	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H)	C[6](C[6]C[6]Ir)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|C<4>,2|N<3>}	C[6](C[6]C[6]Ir)(C[5]N[5]2)(C[6]C[6]H){1|N<3>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	120.2130	0.000	1	120.2130	0.000	1	119.9787	0.095	3	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[5a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6a]N[6])(C[5a]N[5a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>,2|N<3>}	C[6](C[6]C[6a]N[6])(C[5a]N[5a]2)(C[6]C[6]H){1|Pt<4>,1|N<2>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.2320	0.000	1	120.2320	0.000	1	120.2320	0.000	1	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:As-3:	C[6]-3:	C[6](C[6]C[6]As)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(AsCl2)	H(C[6]C[6]2)	C[6](C[6]C[6]As)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(AsCl2){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.5090	0.000	1	119.5090	0.000	1	119.5090	0.000	1	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:B-3:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]B)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(BC[6a]2)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]B)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(BC[6a]2){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.3285	0.359	2	119.3285	0.129	2	119.5245	0.193	64	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:B-3:	C[6]-3:	C[6](C[6]C[6]B)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(BC[6a]2)	H(C[6]C[6]2)	C[6](C[6]C[6]B)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(BC[6a]2){1|Ir<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0600	0.000	1	119.8230	0.112	2	119.5245	0.193	64	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:B-3:	C[6]-3:	C[6](C[6]C[6]B)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(BC[6a]2)	H(C[6]C[6]2)	C[6](C[6]C[6]B)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(BC[6a]2){1|Pt<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.5860	0.000	1	119.8230	0.112	2	119.5245	0.193	64	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:B-3:	C[6]-3:	C[6](C[6]C[6]B)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(BOO)	H(C[6]C[6]2)	C[6](C[6]C[6]B)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(BOO){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.8430	0.000	1	119.3634	0.054	14	119.5245	0.193	64	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:B-3:	C[6]-3:	C[6](C[6]C[6]B)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(BOO)	H(C[6]C[6]2)	C[6](C[6]C[6]B)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(BOO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.3265	0.194	13	119.3634	0.054	14	119.5245	0.193	64	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:B-3:	C[6]-3:	C[6](C[6]C[6]B)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(BC[6a]2)	H(C[6]C[6]2)	C[6](C[6]C[6]B)(C[6]N[6]H)(H){1|B<3>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(BC[6a]2){1|N<3>,2|H<1>}	H(C[6]C[6]2)	118.5640	0.105	2	118.5640	0.011	2	119.5245	0.193	64	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:B-3:	C[6]-3:	C[6](C[6]C[6]B)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(BOO)	H(C[6]C[6]2)	C[6](C[6]C[6]B)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(BOO){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.6126	0.476	34	119.6148	0.196	44	119.5245	0.193	64	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:B-3:	C[6]-3:	C[6](C[6]C[6]B)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(BOO)	H(C[6]C[6]2)	C[6](C[6]C[6]B)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(BOO){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.6275	0.080	2	119.6148	0.196	44	119.5245	0.193	64	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:B-3:	C[6]-3:	C[6](C[6]C[6]B)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(BOO)	H(C[6]C[6]2)	C[6](C[6]C[6]B)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(BOO){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.6209	0.362	8	119.6148	0.196	44	119.5245	0.193	64	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[6]C)(H)	C[6](C[6]C[5,6]C[6])(C[6]C[6]H)(CCO)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[6]C)(H){1|C<3>,3|C<4>}	C[6](C[6]C[5,6]C[6])(C[6]C[6]H)(CCO){2|C<3>,2|H<1>,3|C<4>}	H(C[6]C[6]2)	117.8460	0.000	1	117.4390	0.125	3	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[6]C)(H)	C[6](C[6]C[5,6]C[6])(C[6]C[6]H)(CCO)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[6]C)(H){2|C<3>,2|C<4>}	C[6](C[6]C[5,6]C[6])(C[6]C[6]H)(CCO){1|H<1>,2|C<4>,3|C<3>}	H(C[6]C[6]2)	117.2355	0.045	2	117.4390	0.125	3	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]C)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(CHH)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(CHH){1|C<3>,1|H<1>,1|P<4>}	H(C[6]C[6]2)	120.5910	0.000	1	120.5910	0.000	1	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]C)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(CCH)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(CCH){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.4460	0.000	1	119.4460	0.000	1	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]C)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(COO){1|In<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1810	0.000	1	120.1810	0.000	1	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[5,6]N)(C[6]C[6]C)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(CC[6a]O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]N)(C[6]C[6]C)(H){1|H<1>,2|N<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(CC[6a]O){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	119.8610	0.000	1	119.8610	0.000	1	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CCH)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]C)(H){1|Re<6>,1|C<3>,1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]C[6]H)2(CCH){1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.4200	0.000	1	119.4200	0.000	1	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(COO)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]C)(H){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(COO){1|C<3>,2|N<3>}	H(C[6]C[6]2)	122.8773	2.036	3	122.8773	4.147	3	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CCH)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]C)(H){1|Re<6>,1|C<3>,1|H<1>,1|N<2>,1|S<2>}	C[6](C[6]C[6]H)2(CCH){1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.5510	0.000	1	119.5510	0.000	1	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(COO)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)2(COO){1|C<3>,2|N<3>}	H(C[6]C[6]2)	121.0330	0.000	1	121.0020	0.002	2	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(COO)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]C)(H){1|Zn<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)2(COO){1|C<3>,2|N<3>}	H(C[6]C[6]2)	120.9710	0.000	1	121.0020	0.002	2	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]C)(H){1|Cr<9>,1|H<1>,2|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(CCH){1|Cr<9>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.0027	0.214	3	119.0027	0.046	3	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(CC[6a]O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]C)(H){1|C<3>,1|O<1>,1|O<2>}	C[6](C[6]C[6,6]O)(C[6]C[6]H)(CC[6a]O){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.1940	0.000	1	119.1940	0.000	1	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]C[6]C)(H)	C[6](C[6]N[6,6a]H)(C[6]C[6]H)(CC[6a]O)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6,6a]H)(C[6]C[6]H)(CC[6a]O){3|C<3>}	H(C[6]C[6]2)	119.5350	0.000	1	119.5350	0.000	1	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]C)(H)	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(CCO)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]C)(H){1|O<1>,2|C<3>}	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(CCO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.3170	0.000	1	119.3170	0.000	1	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]C)(H)	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]C)(H){1|O<1>,2|C<3>}	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(CHN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.1137	0.023	4	119.1137	0.001	4	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]C)(H)	C[6](C[6]N[6,6a]O)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]C)(H){1|C<3>,1|N<3>,1|O<2>}	C[6](C[6]N[6,6a]O)(C[6]C[6]H)(COO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	118.7300	0.000	1	118.7300	0.000	1	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]C)(H)	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]C)(H){1|O<1>,2|C<3>}	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(CCH){1|O<2>,2|C<3>}	H(C[6]C[6]2)	118.9530	0.000	1	118.9530	0.000	1	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]C)(H)	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(CCO)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]C)(H){1|O<1>,2|C<3>}	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(CCO){1|O<2>,2|C<3>}	H(C[6]C[6]2)	119.1470	0.000	1	119.1470	0.000	1	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CCO)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CCO){1|Br<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.2520	0.000	1	121.7795	12.777	2	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CCO)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]C)(H){1|C<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CCO){1|Br<1>,1|C<2>,1|H<1>}	H(C[6]C[6]2)	124.3070	0.000	1	121.7795	12.777	2	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CHN){1|Br<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.3840	0.870	7	119.7603	0.531	15	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CHN){1|Br<1>,1|C<3>,1|O<2>}	H(C[6]C[6]2)	120.5280	0.331	2	119.7603	0.531	15	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CHN){2|Br<1>,1|C<3>}	H(C[6]C[6]2)	119.9433	0.290	6	119.7603	0.531	15	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CHO)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CHO){2|Br<1>,1|C<3>}	H(C[6]C[6]2)	119.9530	0.000	1	119.9530	0.000	1	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]C)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO){1|Br<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.9490	0.000	1	120.9490	0.000	1	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]C)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|Br<1>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	120.6525	0.252	2	120.7255	0.034	4	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]C)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|Br<1>,1|Zn<6>,1|C<3>}	H(C[6]C[6]2)	120.7985	0.125	2	120.7255	0.034	4	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CC[6a]2)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(CC[6a]2){2|Br<1>,1|C<3>}	H(C[6]C[6]2)	119.1705	0.026	2	119.1705	0.001	2	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]F)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]F)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|Co<6>,1|C<3>,1|F<1>}	H(C[6]C[6]2)	121.3470	0.000	1	121.3470	0.000	1	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(COO){1|Co<6>,1|C<3>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	119.5845	0.479	2	119.5053	0.133	3	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5]N[6])(C[6]C[6]H)(COO){1|Mn<6>,1|C<3>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	119.3470	0.000	1	119.5053	0.133	3	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]2)(C[6]C[6]H)(CHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]2)(C[6]C[6]H)(CHH){1|C<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	117.2940	0.000	1	117.2940	0.000	1	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(CCC)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(CCC){1|C<2>,2|H<1>}	H(C[6]C[6]2)	119.7810	0.000	1	119.7810	0.000	1	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(CCH){1|Ru<8>,1|C<3>,1|H<1>,1|H<2>}	H(C[6]C[6]2)	119.1870	0.331	2	119.1870	0.110	2	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(CC[5a]2)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(CC[5a]2){1|C<2>,2|H<1>}	H(C[6]C[6]2)	112.5380	0.000	1	112.5380	0.000	1	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(CHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]C[6]N)(CHH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	118.4005	0.630	2	117.9375	4.968	4	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(CHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(CHH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.0870	0.000	1	117.9375	4.968	4	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(CHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(CHH){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	114.8620	0.000	1	117.9375	4.968	4	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|O<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CCN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	118.6070	0.185	2	118.6070	0.034	2	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CC[6a]N)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|O<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CC[6a]N){1|C<3>,2|H<1>}	H(C[6]C[6]2)	118.9625	0.006	2	118.9625	0.000	2	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CHN){1|C<3>,1|F<1>,1|H<1>}	H(C[6]C[6]2)	119.4840	0.000	1	118.9713	1.492	77	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CHN){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.2670	0.041	2	118.9713	1.492	77	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CHN){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	118.9515	1.612	30	118.9713	1.492	77	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	118.9284	1.356	19	118.9713	1.492	77	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CHN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.5050	0.000	1	118.9713	1.492	77	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|N<2>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	118.6060	0.000	1	118.9713	1.492	77	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|N<3>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	118.6255	0.291	4	118.9713	1.492	77	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|O<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CHN){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	118.0110	0.000	1	118.9713	1.492	77	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|O<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.0525	0.256	17	118.9713	1.492	77	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CHN){1|C<3>,3|H<1>}	H(C[6]C[6]2)	120.0700	0.000	1	118.9713	1.492	77	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CNO){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	119.4560	0.000	1	119.2792	0.131	9	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CNO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.3027	0.387	7	119.2792	0.131	9	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CNO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	118.9380	0.000	1	119.2792	0.131	9	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(COO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.1300	0.000	1	119.1163	0.000	3	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(COO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.1095	0.026	2	119.1163	0.000	3	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]P)(CC[6a]Pd)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>,1|P<4>}	C[6](C[6]C[6]H)(C[6]C[6]P)(CC[6a]Pd){1|C<4>,2|H<1>}	H(C[6]C[6]2)	118.8530	0.000	1	118.8530	0.000	1	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(COO){1|Cd<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1250	0.000	1	119.9389	0.155	11	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(COO){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9933	0.236	3	119.9389	0.155	11	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(COO){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.7945	0.281	2	119.9389	0.155	11	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(COO){1|Cu<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.2220	0.000	1	119.9389	0.155	11	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(COO){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0260	0.024	2	119.9389	0.155	11	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(COO){1|Pt<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7410	0.000	1	119.9389	0.155	11	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(COO){1|Zn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.6190	0.000	1	119.9389	0.155	11	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CBrC)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CBrC){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.6670	0.000	2	119.6670	0.000	2	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CCH){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8090	0.522	2	120.0975	0.202	22	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CCH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.9030	0.083	2	120.0975	0.202	22	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CCH){1|Cd<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2950	0.000	1	120.0975	0.202	22	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CCH){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5070	0.170	4	120.0975	0.202	22	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CCH){1|Mn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2695	0.213	2	120.0975	0.202	22	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CCH){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5270	0.160	2	120.0975	0.202	22	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CCH){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.6956	0.386	7	120.0975	0.202	22	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CCH){1|Zn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4680	0.351	2	120.0975	0.202	22	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CCN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.5040	0.058	2	119.8310	0.152	4	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CCN){1|Zn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0480	0.000	1	119.8310	0.152	4	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CCN){1|Zn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2680	0.000	1	119.8310	0.152	4	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CCO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CCO){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6010	0.000	1	120.6129	0.305	7	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CCO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CCO){1|Cu<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2145	0.255	2	120.6129	0.305	7	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CCO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CCO){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7140	0.000	1	120.6129	0.305	7	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CCO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CCO){1|Pt<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.0250	0.000	1	120.6129	0.305	7	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CCO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CCO){1|Ru<9>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7605	1.107	2	120.6129	0.305	7	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CC[5a]2)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CC[5a]2){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5150	0.000	1	120.5150	0.000	1	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CC[6]O)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CC[6]O){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2260	0.000	1	120.2260	0.000	1	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CC[6a]O)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CC[6a]O){1|Cd<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4098	0.153	4	120.3244	0.156	8	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CC[6a]O)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CC[6a]O){1|Cu<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4100	0.000	1	120.3244	0.156	8	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CC[6a]O)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CC[6a]O){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.5520	0.000	1	120.3244	0.156	8	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CC[6a]O)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CC[6a]O){1|Mn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.9030	0.000	1	120.3244	0.156	8	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CC[6a]O)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CC[6a]O){1|Re<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0910	0.000	1	120.3244	0.156	8	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CClO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CClO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5100	0.000	1	120.5100	0.000	1	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8220	0.057	3	120.1938	0.548	18	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CHN){1|Cd<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5030	0.000	1	120.1938	0.548	18	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CHN){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4580	0.000	1	120.1938	0.548	18	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CHN){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2220	0.000	1	120.1938	0.548	18	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CHN){1|Hg<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1113	1.146	7	120.1938	0.548	18	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CHN){1|Mn<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2425	0.623	2	120.1938	0.548	18	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CHN){1|Mn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7310	0.000	1	120.1938	0.548	18	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CHN){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3650	0.000	1	120.1938	0.548	18	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CHN){1|Zn<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4800	0.000	1	120.1938	0.548	18	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CHO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CHO){1|Re<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0450	0.150	2	120.3800	0.106	5	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CHO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CHO){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7300	0.000	1	120.3800	0.106	5	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CHO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CHO){1|Zn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5400	0.072	2	120.3800	0.106	5	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CNN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CNN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0790	0.000	1	120.0790	0.000	1	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0392	0.234	4	120.2930	0.294	161	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0685	0.064	2	120.2930	0.294	161	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO){1|Ru<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8540	0.299	3	120.2930	0.294	161	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.1640	0.000	1	120.2930	0.294	161	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.1075	0.694	23	120.2930	0.294	161	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8635	0.585	28	120.2930	0.294	161	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO){1|Cd<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8340	0.932	2	120.2930	0.294	161	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO){1|Co<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3080	0.000	1	120.2930	0.294	161	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5499	0.402	28	120.2930	0.294	161	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3116	0.189	7	120.2930	0.294	161	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO){1|Cu<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2650	0.000	1	120.2930	0.294	161	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.1010	0.000	1	120.2930	0.294	161	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO){1|Hg<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0204	0.583	5	120.2930	0.294	161	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO){1|Mn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6400	0.193	6	120.2930	0.294	161	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO){1|Mn<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6050	0.000	1	120.2930	0.294	161	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6067	0.189	13	120.2930	0.294	161	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3454	0.525	5	120.2930	0.294	161	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO){1|Pt<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1605	0.254	4	120.2930	0.294	161	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO){1|Re<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4650	0.472	11	120.2930	0.294	161	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO){1|Ru<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.9168	0.230	5	120.2930	0.294	161	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO){1|Zn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6205	0.620	2	120.2930	0.294	161	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO){1|Zn<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4745	0.183	4	120.2930	0.294	161	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO){1|Zn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7368	0.179	4	120.2930	0.294	161	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CNS)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CNS){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8300	0.491	2	119.8300	0.241	2	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CN[5]O)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CN[5]O){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.6290	0.000	1	120.6290	0.000	1	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CN[6]O)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CN[6]O){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	123.7150	0.000	1	123.7150	0.000	1	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.7430	0.190	3	120.2829	0.281	197	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|Cd<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3680	0.148	5	120.2829	0.281	197	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4179	0.259	8	120.2829	0.281	197	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|Cr<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6220	0.000	1	120.2829	0.281	197	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|Cu<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1080	0.308	4	120.2829	0.281	197	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2215	0.214	4	120.2829	0.281	197	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4673	0.191	11	120.2829	0.281	197	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|Ir<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4080	0.218	2	120.2829	0.281	197	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|Mn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0750	0.243	2	120.2829	0.281	197	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|Mn<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6890	0.007	2	120.2829	0.281	197	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|Mo<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3535	0.142	2	120.2829	0.281	197	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5124	0.579	13	120.2829	0.281	197	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3550	0.275	4	120.2829	0.281	197	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|Pt<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5264	0.835	5	120.2829	0.281	197	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|Pt<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4204	1.915	7	120.2829	0.281	197	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|Re<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3450	0.000	1	120.2829	0.281	197	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|Rh<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.8900	0.323	4	120.2829	0.281	197	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|Ru<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4908	0.182	10	120.2829	0.281	197	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|Zn<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3575	0.036	2	120.2829	0.281	197	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|Zn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9840	0.132	3	120.2829	0.281	197	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3775	0.069	2	120.2829	0.281	197	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|Cu<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0000	0.000	1	120.2829	0.281	197	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7075	0.564	2	120.2829	0.281	197	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4175	0.235	4	120.2829	0.281	197	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|Re<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2380	0.093	2	120.2829	0.281	197	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.7950	0.018	2	120.2829	0.281	197	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|Re<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3080	0.000	1	120.2829	0.281	197	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8500	0.000	1	120.2829	0.281	197	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|Mn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9930	0.000	1	120.2829	0.281	197	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.2773	0.253	16	120.2829	0.281	197	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	120.3555	0.120	2	120.2829	0.281	197	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.4480	1.020	2	120.2829	0.281	197	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0264	0.393	34	120.2829	0.281	197	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4000	0.000	1	120.2829	0.281	197	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|Cu<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6700	0.000	1	120.2829	0.281	197	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0410	0.128	4	120.2829	0.281	197	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4210	0.000	1	120.2829	0.281	197	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|Hg<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2067	0.502	19	120.2829	0.281	197	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|Mn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1960	0.000	1	120.2829	0.281	197	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7680	0.061	2	120.2829	0.281	197	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3470	0.214	5	120.2829	0.281	197	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(COO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.2535	0.440	17	119.2535	0.193	17	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]O)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]O)(COO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	118.7706	0.247	5	119.2654	0.713	9	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]O)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]O)(COO){1|Re<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0920	1.570	2	119.2654	0.713	9	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]O)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]O)(COO){1|Rh<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.6760	0.263	2	119.2654	0.713	9	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]O)(CSS)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|O<1>}	C[6](C[6]C[6]H)(C[6]N[6]O)(CSS){1|H<1>,2|C<3>}	H(C[6]C[6]2)	118.9080	0.000	1	118.9080	0.000	1	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]P)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|P<4>}	C[6](C[6]C[6]H)(C[6]N[6]P)(COO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8815	0.124	2	119.8815	0.015	2	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]S)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|S<1>}	C[6](C[6]C[6]H)(C[6]N[6]S)(CNO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	116.8090	0.000	1	116.8090	0.000	1	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]S)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]S)(COO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	118.8163	0.476	3	119.2813	0.366	6	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]S)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]S)(COO){1|Mo<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9770	0.000	1	119.2813	0.366	6	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]S)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|S<4>}	C[6](C[6]C[6]H)(C[6]N[6]S)(COO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.6310	0.000	2	119.2813	0.366	6	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]P[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,1|O<2>,1|P<3>}	C[6](C[6]C[6]H)(C[6]P[6]H)(COO){1|Cu<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	117.9470	0.000	1	117.9470	0.000	1	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CCC)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<2>,2|H<1>}	C[6](C[6]C[6]H)2(CCC){1|C<3>,1|H<1>}	H(C[6]C[6]2)	115.1695	7.167	2	117.4147	14.208	15	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CCC)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(CCC){1|C<3>,2|H<1>}	H(C[6]C[6]2)	117.4362	3.583	11	117.4147	14.208	15	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CCC)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(CCC){1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.5415	0.193	2	117.4147	14.208	15	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Br<1>,1|C<2>,1|H<1>}	C[6](C[6]C[6]H)2(CCH){1|C<3>,1|H<1>}	H(C[6]C[6]2)	118.8620	0.000	1	119.0755	0.619	13	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<2>,2|H<1>}	C[6](C[6]C[6]H)2(CCH){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.4210	0.098	2	119.0755	0.619	13	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(CCH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	117.8545	0.329	2	119.0755	0.619	13	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CCH){1|C<2>,2|H<1>}	H(C[6]C[6]2)	119.3211	0.714	8	119.0755	0.619	13	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<2>,2|H<1>}	C[6](C[6]C[6]H)2(CCN){1|C<3>,1|H<1>}	H(C[6]C[6]2)	116.3040	0.185	2	118.7062	13.736	4	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CCN){1|C<2>,2|H<1>}	H(C[6]C[6]2)	121.1085	4.253	2	118.7062	13.736	4	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CCO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Br<1>,1|C<2>,1|H<1>}	C[6](C[6]C[6]H)2(CCO){1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2680	0.000	1	119.6437	0.293	3	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CCO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(CCO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.3315	0.033	2	119.6437	0.293	3	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CC[3]H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<2>,2|H<1>}	C[6](C[6]C[6]H)2(CC[3]H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.5190	0.000	1	119.5190	0.000	1	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CC[6]O)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CC[6]O){1|C<2>,2|H<1>}	H(C[6]C[6]2)	119.7040	0.126	2	119.7040	0.016	2	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CC[6a]2)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(CC[6a]2){1|C<4>,2|H<1>}	H(C[6]C[6]2)	118.5285	0.220	2	118.6122	0.080	10	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CC[6a]2)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(CC[6a]2){1|C<3>,2|H<1>}	H(C[6]C[6]2)	118.9005	0.164	4	118.6122	0.080	10	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CC[6a]2)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|P<4>,2|H<1>}	C[6](C[6]C[6]H)2(CC[6a]2){1|C<4>,2|H<1>}	H(C[6]C[6]2)	118.3660	0.014	2	118.6122	0.080	10	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CC[6a]2)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){2|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(CC[6a]2){1|C<4>,2|H<1>}	H(C[6]C[6]2)	118.3655	0.056	2	118.6122	0.080	10	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CC[6a]C)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<2>,2|H<1>}	C[6](C[6]C[6]H)2(CC[6a]C){1|C<3>,1|H<1>}	H(C[6]C[6]2)	115.8520	0.000	1	118.0237	3.592	3	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CC[6a]C)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(CC[6a]C){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.1095	0.330	2	118.0237	3.592	3	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CC[6a]N)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CC[6a]N){1|C<2>,2|H<1>}	H(C[6]C[6]2)	122.7410	4.316	2	121.8397	11.752	3	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CC[6a]N)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(CC[6a]N){1|C<3>,3|H<1>}	H(C[6]C[6]2)	120.0370	0.000	1	121.8397	11.752	3	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CC[6a]O)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(CC[6a]O){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.4555	0.039	2	119.4555	0.002	2	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(CHH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	121.5615	3.050	2	119.1105	21.939	51	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|C<6>,1|H<1>}	C[6](C[6]C[6]H)2(CHH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	115.2905	1.587	2	119.1105	21.939	51	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)2(CHH){1|C<3>,1|H<1>,1|P<3>}	H(C[6]C[6]2)	118.6885	4.826	2	119.1105	21.939	51	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(CHH){1|C<3>,1|H<1>,1|P<4>}	H(C[6]C[6]2)	120.4710	0.000	1	119.1105	21.939	51	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(CHH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.4600	0.438	2	119.1105	21.939	51	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<4>}	C[6](C[6]C[6]H)2(CHH){1|C<3>,1|H<1>,1|S<4>}	H(C[6]C[6]2)	119.1850	0.000	1	119.1105	21.939	51	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	C[6](C[6]C[6]H)2(CHH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	117.0235	4.659	2	119.1105	21.939	51	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<3>}	C[6](C[6]C[6]H)2(CHH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.6135	0.022	2	119.1105	21.939	51	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<4>}	C[6](C[6]C[6]H)2(CHH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.7499	4.390	16	119.1105	21.939	51	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(CHH){1|C<3>,1|H<1>,1|N<4>}	H(C[6]C[6]2)	120.4980	0.000	1	119.1105	21.939	51	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(CHH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	117.0755	6.690	14	119.1105	21.939	51	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(CHH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0255	1.278	6	119.1105	21.939	51	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<2>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(CHN){1|C<3>,1|H<1>}	H(C[6]C[6]2)	123.6210	0.000	1	120.3208	2.644	6	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(CHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.6550	0.222	4	120.3208	2.644	6	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Cl<1>,1|C<2>,1|H<1>}	C[6](C[6]C[6]H)2(CHN){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.6840	0.000	1	120.3208	2.644	6	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CHO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(CHO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	122.1655	1.153	2	122.1655	1.330	2	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CNN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(CNN){1|C<3>,1|H<1>,1|I<1>}	H(C[6]C[6]2)	120.2680	0.000	2	119.4701	4.865	8	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CNN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(CNN){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8615	0.105	4	119.4701	4.865	8	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CNN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(CNN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	117.8895	5.209	2	119.4701	4.865	8	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(CNO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.4143	0.050	6	119.4143	0.003	6	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(COO){1|Cu<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.9960	0.000	1	120.2290	0.057	5	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(COO){1|Pd<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.1175	0.052	2	120.2290	0.057	5	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(COO){1|Pt<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.4570	0.202	2	120.2290	0.057	5	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]N[6]Pd)(C[6]C[6]H)(CHO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,1|N<3>}	C[6](C[6]N[6]Pd)(C[6]C[6]H)(CHO){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.0070	0.000	1	120.0070	0.000	1	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]N[6]Se)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Se<1>,1|H<1>,1|N<3>}	C[6](C[6]N[6]Se)(C[6]C[6]H)(COO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	118.9260	0.000	1	118.9260	0.000	1	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]O[6]Cr)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Cr<6>,2|O<2>}	C[6](C[6]O[6]Cr)(C[6]C[6]H)(COO){1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4080	0.000	1	120.4080	0.000	1	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]I)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]I)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(COO){1|C<3>,1|H<1>,1|I<1>}	H(C[6]C[6]2)	123.3610	0.000	1	123.3610	0.000	1	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]I)(H)	C[6](C[6]C[6]H)2(CNN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]I)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(CNN){1|C<3>,1|H<1>,1|I<1>}	H(C[6]C[6]2)	120.1670	0.000	2	120.1670	0.000	2	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]N)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]N)(H){1|H<1>,1|O<2>,2|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(COO){1|C<4>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.6380	0.000	1	119.6380	0.000	1	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CCH){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	119.5570	0.000	1	119.6143	0.018	3	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CCH){1|C<3>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	119.7680	0.000	1	119.6143	0.018	3	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CCH){1|C<3>,2|N<3>}	H(C[6]C[6]2)	119.5180	0.000	1	119.6143	0.018	3	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CHN){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.3273	1.793	3	119.9995	0.323	33	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CHN){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9822	0.351	24	119.9995	0.323	33	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CHN){1|C<3>,1|N<2>,1|O<2>}	H(C[6]C[6]2)	119.8668	0.403	5	119.9995	0.323	33	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CHN){1|C<3>,2|N<3>}	H(C[6]C[6]2)	120.0940	0.000	1	119.9995	0.323	33	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CNO){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.6465	0.138	2	119.6465	0.019	2	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(COO){1|C<3>,2|N<3>}	H(C[6]C[6]2)	120.0319	0.472	27	120.0469	0.221	28	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(COO){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.4530	0.000	1	120.0469	0.221	28	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(CHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(CHH){1|C<3>,1|H<1>,1|N<4>}	H(C[6]C[6]2)	122.6020	0.000	1	122.6020	0.000	1	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(CNN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(CNN){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.6186	0.189	5	119.6186	0.036	5	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]N)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(COO){1|C<2>,1|C<3>,1|N<3>}	H(C[6]C[6]2)	120.8580	0.000	1	120.8580	0.000	1	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]Br)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|Br<1>,1|C<3>,1|O<1>}	C[6](C[6]C[6]Br)(C[6]C[6]H)(CHN){1|Br<1>,1|C<3>,1|O<2>}	H(C[6]C[6]2)	119.1530	0.000	1	119.1530	0.000	1	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]C[6]N)(CCH){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	117.9130	0.000	1	117.9130	0.000	1	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CHN){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.3790	0.454	2	119.3790	0.206	2	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	121.5155	0.217	2	121.2217	0.283	3	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|Cd<6>,1|C<3>,1|O<2>}	H(C[6]C[6]2)	120.6340	0.000	1	121.2217	0.283	3	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(CHN){1|C<3>,2|O<2>}	H(C[6]C[6]2)	120.0210	0.576	2	120.0210	0.331	2	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(COO){1|O<1>,2|C<3>}	H(C[6]C[6]2)	119.8140	0.035	2	119.8140	0.001	2	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]P)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]P)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CHH){1|C<3>,1|C<4>,1|P<3>}	H(C[6]C[6]2)	123.3690	5.756	2	123.3690	33.130	2	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]P)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]P)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|C<3>,1|H<1>,1|P<4>}	H(C[6]C[6]2)	119.6040	0.000	1	119.6040	0.000	1	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]P)(H)	C[6](C[6]C[6]H)2(CHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]P)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)2(CHH){1|C<3>,1|H<1>,1|P<3>}	H(C[6]C[6]2)	114.7510	2.130	2	115.8770	6.072	3	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]P)(H)	C[6](C[6]C[6]H)2(CHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]P)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(CHH){1|C<3>,1|H<1>,1|P<4>}	H(C[6]C[6]2)	118.1290	0.000	1	115.8770	6.072	3	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]S)(H)	C[6](C[6]C[6]H)2(CHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]S)(H){1|C<3>,1|H<1>,1|N<4>}	C[6](C[6]C[6]H)2(CHH){1|C<3>,1|H<1>,1|S<4>}	H(C[6]C[6]2)	121.1620	0.000	1	121.1620	0.000	1	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|C<2>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(CCH){1|C<4>,2|N<3>}	H(C[6]C[6]2)	118.5480	0.000	1	118.5480	0.000	1	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(CCO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|S<4>,2|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(CCO){1|H<1>,1|N<3>,2|C<4>}	H(C[6]C[6]2)	119.0400	0.000	1	119.0400	0.000	1	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(CCC)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(CCC){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	118.8690	0.000	1	118.8879	0.044	21	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(CCC)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(CCC){1|N<3>,2|C<3>}	H(C[6]C[6]2)	118.7927	0.233	8	118.8879	0.044	21	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(CCC)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(CCC){1|N<3>,2|C<4>}	H(C[6]C[6]2)	118.9529	0.185	12	118.8879	0.044	21	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(CC[6a]C)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(CC[6a]C){1|N<3>,2|C<4>}	H(C[6]C[6]2)	118.5900	0.231	2	118.5900	0.053	2	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|Al<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(COO){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.9540	0.058	2	120.5742	0.167	42	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(COO){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.5510	0.000	1	120.5742	0.167	42	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(COO){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.4430	0.000	1	120.5742	0.167	42	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(COO){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.5630	0.000	1	120.5742	0.167	42	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(COO){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3010	0.000	1	120.5742	0.167	42	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(COO){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3535	0.243	2	120.5742	0.167	42	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(COO){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.6467	0.148	4	120.5742	0.167	42	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(COO){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.8468	0.716	4	120.5742	0.167	42	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(COO){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5190	0.000	1	120.5742	0.167	42	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(COO){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3980	0.277	2	120.5742	0.167	42	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|Cu<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(COO){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.6840	0.181	2	120.5742	0.167	42	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(COO){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1770	0.000	1	120.5742	0.167	42	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|Mg<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(COO){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3990	0.184	3	120.5742	0.167	42	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(COO){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2080	0.000	1	120.5742	0.167	42	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|Mn<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(COO){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.8033	0.178	4	120.5742	0.167	42	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(COO){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1970	0.000	1	120.5742	0.167	42	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(COO){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.9477	0.055	4	120.5742	0.167	42	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(COO){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6698	0.205	6	120.5742	0.167	42	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|Zn<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(COO){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1860	0.000	1	120.5742	0.167	42	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(CCO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(CCO){1|N<3>,2|H<1>}	H(C[6]C[6]2)	118.8285	3.996	2	118.8285	15.967	2	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Hg<4>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(CNO){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.8030	0.000	1	119.8030	0.000	1	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(COO){1|N<3>,2|H<1>}	H(C[6]C[6]2)	121.7375	1.155	4	121.7375	1.334	4	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(COO){1|N<3>,2|H<1>}	H(C[6]C[6]2)	118.9690	0.099	2	118.9690	0.010	2	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CCH){1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4760	0.000	1	120.4760	0.000	1	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|N<2>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.4080	0.000	1	121.4080	0.000	1	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CBrC)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(CBrC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.9495	0.296	2	119.9495	0.088	2	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CCC)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(CCC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.6636	0.415	8	120.0736	0.414	36	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CCC)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(CCC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	121.6060	0.380	2	120.0736	0.414	36	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CCC)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cd<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CCC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.1561	0.379	8	120.0736	0.414	36	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CCC)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Co<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CCC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.0400	0.284	2	120.0736	0.414	36	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CCC)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Fe<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CCC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.8505	0.728	2	120.0736	0.414	36	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CCC)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Hg<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CCC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.2177	0.092	4	120.0736	0.414	36	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CCC)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CCC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.9923	0.961	6	120.0736	0.414	36	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CCC)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CCC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.0683	0.436	4	120.0736	0.414	36	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Al<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CCH){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.0607	0.154	4	119.8933	0.584	710	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CCH){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.5950	0.100	2	119.8933	0.584	710	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(CCH){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.4020	0.000	1	119.8933	0.584	710	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(CCH){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.6527	0.897	234	119.8933	0.584	710	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(CCH){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.7161	1.949	8	119.8933	0.584	710	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<3>}	C[6](C[6]C[6]H)2(CCH){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.5888	0.064	4	119.8933	0.584	710	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|W<6>}	C[6](C[6]C[6]H)2(CCH){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.6910	0.538	8	119.8933	0.584	710	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(CCH){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.0263	0.655	267	119.8933	0.584	710	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cd<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CCH){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.7987	0.192	4	119.8933	0.584	710	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cd<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CCH){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.0800	0.104	7	119.8933	0.584	710	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CCH){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.0309	0.351	10	119.8933	0.584	710	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Co<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CCH){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.5545	0.156	2	119.8933	0.584	710	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CCH){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.0917	0.303	12	119.8933	0.584	710	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CCH){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.7512	0.672	6	119.8933	0.584	710	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ga<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CCH){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.1122	0.125	6	119.8933	0.584	710	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(CCH){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.6160	0.415	14	119.8933	0.584	710	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CCH){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9256	0.246	5	119.8933	0.584	710	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CCH){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0270	0.000	1	119.8933	0.584	710	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CCH){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.0780	1.225	10	119.8933	0.584	710	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ir<9>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CCH){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.1415	0.323	2	119.8933	0.584	710	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CCH){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.4953	0.976	16	119.8933	0.584	710	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CCH){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.9321	0.181	11	119.8933	0.584	710	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Os<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CCH){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9277	0.305	3	119.8933	0.584	710	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CCH){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0105	0.101	2	119.8933	0.584	710	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CCH){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.8108	0.397	9	119.8933	0.584	710	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Rh<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CCH){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.9570	0.415	23	119.8933	0.584	710	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Sn<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CCH){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.0232	0.101	8	119.8933	0.584	710	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CCH){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.8001	0.246	10	119.8933	0.584	710	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Zn<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CCH){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.1534	0.617	16	119.8933	0.584	710	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Zn<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CCH){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.6618	0.604	5	119.8933	0.584	710	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CCO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(CCO){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.1370	0.234	23	120.2737	0.088	46	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CCO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cd<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CCO){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.3110	0.301	2	120.2737	0.088	46	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CCO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Co<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CCO){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.5057	0.337	6	120.2737	0.088	46	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CCO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CCO){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.2905	0.251	6	120.2737	0.088	46	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CCO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CCO){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.7740	0.000	1	120.2737	0.088	46	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CCO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CCO){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.7770	0.308	2	120.2737	0.088	46	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CCO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CCO){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.3800	0.206	2	120.2737	0.088	46	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CCO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Re<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CCO){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.1530	0.255	2	120.2737	0.088	46	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CCO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Zn<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CCO){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.3240	0.025	2	120.2737	0.088	46	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CCS)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(CCS){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.8162	0.530	4	119.8162	0.281	4	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CC[5]2)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(CC[5]2){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.9085	0.362	4	119.9085	0.131	4	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CC[5]C)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Mo<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CC[5]C){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.6255	0.271	4	119.6255	0.073	4	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CC[5a]2)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(CC[5a]2){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.8462	0.405	6	120.0823	0.187	11	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CC[5a]2)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(CC[5a]2){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.7690	0.000	1	120.0823	0.187	11	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CC[5a]2)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Zn<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CC[5a]2){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.2647	0.188	4	120.0823	0.187	11	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CC[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(CC[6]H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.8083	0.227	6	119.8817	0.078	8	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CC[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CC[6]H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.1020	0.399	2	119.8817	0.078	8	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CC[6a]N)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(CC[6a]N){1|N<3>,2|H<1>}	H(C[6]C[6]2)	121.7225	2.114	2	120.1751	1.651	8	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CC[6a]N)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CC[6a]N){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.6593	0.375	6	120.1751	1.651	8	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CC[6a]O)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(CC[6a]O){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.4045	0.013	2	120.2806	0.466	31	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CC[6a]O)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(CC[6a]O){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.1820	0.158	2	120.2806	0.466	31	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CC[6a]O)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CC[6a]O){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.2980	0.422	4	120.2806	0.466	31	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CC[6a]O)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CC[6a]O){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.3190	1.899	4	120.2806	0.466	31	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CC[6a]O)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CC[6a]O){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.4158	0.149	5	120.2806	0.466	31	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CC[6a]O)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(CC[6a]O){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.2610	0.025	2	120.2806	0.466	31	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CC[6a]O)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CC[6a]O){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.3302	0.146	6	120.2806	0.466	31	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CC[6a]O)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CC[6a]O){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.3852	0.100	4	120.2806	0.466	31	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CC[6a]O)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CC[6a]O){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.4680	0.078	2	120.2806	0.466	31	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CClO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(CClO){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.6305	0.047	2	120.6305	0.002	2	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(CHN){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.8789	0.117	19	120.1963	0.122	74	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(CHN){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.2311	0.254	26	120.1963	0.122	74	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cd<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CHN){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.4065	0.095	2	120.1963	0.122	74	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CHN){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.4243	0.157	6	120.1963	0.122	74	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CHN){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.3110	0.110	2	120.1963	0.122	74	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(CHN){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.9015	0.192	2	120.1963	0.122	74	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Hg<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CHN){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.2680	0.475	6	120.1963	0.122	74	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CHN){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.3250	0.000	1	120.1963	0.122	74	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Rh<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CHN){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.4867	0.473	6	120.1963	0.122	74	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Zn<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CHN){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.2947	0.272	4	120.1963	0.122	74	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CHO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CHO){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.1315	0.216	2	120.4650	0.357	3	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CHO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CHO){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.1320	0.000	1	120.4650	0.357	3	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CNN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(CNN){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.6860	0.110	2	120.0523	0.193	20	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CNN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(CNN){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.6720	0.079	2	120.0523	0.193	20	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CNN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Rh<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CNN){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.0206	0.416	16	120.0523	0.193	20	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ag<3>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CNO){1|N<3>,2|H<1>}	H(C[6]C[6]2)	124.6647	3.451	4	120.4317	0.769	269	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(CNO){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.0672	0.270	14	120.4317	0.769	269	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|D<1>,1|H<1>}	C[6](C[6]C[6]H)2(CNO){1|N<3>,2|H<1>}	H(C[6]C[6]2)	123.0425	0.481	4	120.4317	0.769	269	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(CNO){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.7045	0.216	2	120.4317	0.769	269	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(CNO){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.4013	0.621	135	120.4317	0.769	269	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cd<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CNO){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.3030	0.076	2	120.4317	0.769	269	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cd<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CNO){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.3730	0.098	2	120.4317	0.769	269	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Co<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CNO){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.5938	0.155	4	120.4317	0.769	269	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CNO){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.3341	0.260	26	120.4317	0.769	269	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Co<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CNO){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.5258	0.059	4	120.4317	0.769	269	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CNO){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.5705	0.200	4	120.4317	0.769	269	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(CNO){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.3255	0.185	4	120.4317	0.769	269	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Hg<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CNO){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.5075	0.230	4	120.4317	0.769	269	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CNO){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.2307	0.245	6	120.4317	0.769	269	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Mn<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CNO){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.5730	0.098	2	120.4317	0.769	269	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CNO){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.2968	0.132	8	120.4317	0.769	269	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CNO){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.1235	0.091	4	120.4317	0.769	269	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CNO){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.9405	0.522	15	120.4317	0.769	269	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Rh<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CNO){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.2740	0.352	6	120.4317	0.769	269	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CNO){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2200	0.000	1	120.4317	0.769	269	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CNO){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.2970	0.000	1	120.4317	0.769	269	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CNO){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.1754	0.441	11	120.4317	0.769	269	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Zn<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CNO){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.3400	0.122	6	120.4317	0.769	269	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CNS)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(CNS){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.1660	0.156	2	120.3418	0.025	31	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CNS)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(CNS){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.2685	0.137	4	120.3418	0.025	31	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CNS)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CNS){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.3689	0.156	15	120.3418	0.025	31	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CNS)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CNS){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.4250	0.106	8	120.3418	0.025	31	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CNS)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CNS){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.1280	0.093	2	120.3418	0.025	31	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CN[6]O)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(CN[6]O){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.9690	0.542	2	120.0937	0.157	6	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CN[6]O)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CN[6]O){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.1560	0.384	4	120.0937	0.157	6	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Au<3>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(COO){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.5990	0.216	2	120.3950	0.405	447	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(COO){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.9324	0.353	25	120.3950	0.405	447	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(COO){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1530	0.000	1	120.3950	0.405	447	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(COO){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9830	0.000	1	120.3950	0.405	447	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(COO){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.1528	0.648	76	120.3950	0.405	447	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(COO){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8740	0.000	1	120.3950	0.405	447	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(COO){1|H<1>,1|N<3>,1|P<4>}	H(C[6]C[6]2)	120.7000	0.000	1	120.3950	0.405	447	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(COO){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.4784	0.841	89	120.3950	0.405	447	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(COO){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5223	0.257	35	120.3950	0.405	447	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(COO){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7590	0.373	2	120.3950	0.405	447	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(COO){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.3158	0.273	14	120.3950	0.405	447	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(COO){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7250	0.388	3	120.3950	0.405	447	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(COO){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.4168	0.181	4	120.3950	0.405	447	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(COO){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4145	0.325	2	120.3950	0.405	447	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(COO){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8420	0.000	1	120.3950	0.405	447	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(COO){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.7677	0.536	6	120.3950	0.405	447	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(COO){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.4505	0.019	2	120.3950	0.405	447	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(COO){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4355	0.492	16	120.3950	0.405	447	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Mg<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(COO){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3997	0.228	3	120.3950	0.405	447	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(COO){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3370	0.262	3	120.3950	0.405	447	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(COO){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.4472	0.104	11	120.3950	0.405	447	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(COO){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4870	0.000	1	120.3950	0.405	447	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(COO){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.3910	0.034	4	120.3950	0.405	447	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Os<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(COO){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5347	0.298	6	120.3950	0.405	447	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(COO){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5247	0.477	4	120.3950	0.405	447	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(COO){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.5794	0.214	13	120.3950	0.405	447	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(COO){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1502	0.476	23	120.3950	0.405	447	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(COO){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.4523	0.132	6	120.3950	0.405	447	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Pt<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(COO){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.5095	0.305	2	120.3950	0.405	447	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Pt<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(COO){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6463	0.150	11	120.3950	0.405	447	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Pt<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(COO){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.4845	0.214	10	120.3950	0.405	447	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(COO){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3669	0.329	12	120.3950	0.405	447	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(COO){1|N<3>,2|H<1>}	H(C[6]C[6]2)	121.4603	1.217	6	120.3950	0.405	447	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Rh<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(COO){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2675	0.131	2	120.3950	0.405	447	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(COO){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5257	0.954	39	120.3950	0.405	447	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(COO){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.3780	0.008	2	120.3950	0.405	447	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ru<9>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(COO){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.3397	0.164	4	120.3950	0.405	447	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Zn<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(COO){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.3263	0.160	3	120.3950	0.405	447	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Zn<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(COO){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4770	0.000	1	120.3950	0.405	447	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CPP)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(CPP){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.2670	0.269	2	119.2670	0.072	2	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(CCH){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	118.7680	0.000	1	118.7680	0.000	1	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]P)(H)	C[6](C[6]C[6]H)2(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]P)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(COO){1|H<1>,1|N<3>,1|P<4>}	H(C[6]C[6]2)	120.1540	0.000	1	120.1540	0.000	1	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]O[6]C)(H)	C[6](C[6]C[6]H)2(CCC)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]O[6]C)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CCC){1|C<3>,1|C<4>,1|O<2>}	H(C[6]C[6]2)	119.4785	0.213	2	119.4225	0.041	12	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]O[6]C)(H)	C[6](C[6]C[6]H)2(CCC)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]O[6]C)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CCC){1|O<2>,2|C<3>}	H(C[6]C[6]2)	119.3307	0.211	6	119.4225	0.041	12	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]O[6]C)(H)	C[6](C[6]C[6]H)2(CCC)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]O[6]C)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CCC){1|O<2>,2|C<4>}	H(C[6]C[6]2)	119.5323	0.155	4	119.4225	0.041	12	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]O[6]C)(H)	C[6](C[6]C[6]H)2(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]O[6]C)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CCH){1|O<2>,2|C<4>}	H(C[6]C[6]2)	119.0177	0.155	6	119.0177	0.024	6	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]P[6]C)(H)	C[6](C[6]C[6]H)2(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]P[6]C)(H){1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(CCH){1|P<4>,2|C<2>}	H(C[6]C[6]2)	116.6590	0.116	2	116.6590	0.013	2	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(CHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]C[6]H)(CHH){1|C<3>,2|C<4>}	H(C[6]C[6]2)	123.5260	0.000	1	123.5260	0.000	1	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CCN){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.2350	0.000	1	119.2350	0.000	1	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CC[5]H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<4>,2|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CC[5]H){1|C<4>,1|O<2>,2|C<3>}	H(C[6]C[6]2)	117.8000	0.000	1	117.8000	0.000	1	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CC[5a]H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<4>,2|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CC[5a]H){1|C<4>,1|O<2>,2|C<3>}	H(C[6]C[6]2)	117.6770	0.000	1	117.6770	0.000	1	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CC[6a]C)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|O<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CC[6a]C){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	111.8000	0.000	1	111.8000	0.000	1	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CHH){1|C<4>,2|C<3>}	H(C[6]C[6]2)	117.4090	0.000	1	118.2253	0.532	3	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CHH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	118.4540	0.000	1	118.2253	0.532	3	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CHH){1|C<3>,2|C<4>}	H(C[6]C[6]2)	118.8130	0.000	1	118.2253	0.532	3	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CHN){1|Br<1>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	118.8305	0.114	2	118.5583	2.962	17	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CHN){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	118.7226	0.268	5	118.5583	2.962	17	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CHN){1|C<3>,1|C<4>,1|O<2>}	H(C[6]C[6]2)	115.4810	0.000	1	118.5583	2.962	17	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CHN){1|C<3>,2|C<4>}	H(C[6]C[6]2)	118.9308	3.025	5	118.5583	2.962	17	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CHN){1|C<4>,2|C<3>}	H(C[6]C[6]2)	118.5205	0.097	4	118.5583	2.962	17	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CHO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CHO){1|C<3>,2|C<4>}	H(C[6]C[6]2)	118.7875	0.180	2	118.7875	0.033	2	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CNO){1|C<3>,2|C<4>}	H(C[6]C[6]2)	119.0195	0.138	2	116.9650	9.621	4	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CNO){1|C<4>,2|C<3>}	H(C[6]C[6]2)	114.9105	3.458	2	116.9650	9.621	4	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|N<3>,2|C<4>}	C[6](C[6]C[6]H)(C[6]N[6]C)(COO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	118.6573	0.034	3	118.6573	0.001	3	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CCH){1|Zn<4>,2|C<3>}	H(C[6]C[6]2)	119.3587	0.785	6	119.3587	0.616	6	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|N<2>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CHH){2|C<3>}	H(C[6]C[6]2)	119.8240	0.000	1	119.8240	0.000	1	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO){1|C<4>,2|C<3>}	H(C[6]C[6]2)	120.0464	0.814	18	120.0792	0.544	22	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO){1|O<1>,2|C<3>}	H(C[6]C[6]2)	120.2267	0.131	4	120.0792	0.544	22	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.1590	0.000	1	120.3065	0.265	11	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.7820	0.000	1	120.3065	0.265	11	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|Ni<6>,2|C<3>}	H(C[6]C[6]2)	120.0360	0.000	1	120.3065	0.265	11	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|Pd<4>,2|C<3>}	H(C[6]C[6]2)	120.6645	0.053	2	120.3065	0.265	11	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|Pt<6>,2|C<3>}	H(C[6]C[6]2)	120.2140	0.047	2	120.3065	0.265	11	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|Re<6>,2|C<3>}	H(C[6]C[6]2)	120.6593	0.264	4	120.3065	0.265	11	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(CC[6a]O)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<4>,1|O<2>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(CC[6a]O){1|C<3>,2|C<4>}	H(C[6]C[6]2)	118.3150	0.000	1	118.3150	0.000	1	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CCC)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<2>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(CCC){1|C<3>,1|C<4>}	H(C[6]C[6]2)	122.6195	0.258	2	120.5510	6.870	4	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CCC)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(CCC){1|C<4>,2|C<3>}	H(C[6]C[6]2)	118.4825	1.852	2	120.5510	6.870	4	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CC[6a]2)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(CC[6a]2){1|C<3>,2|C<4>}	H(C[6]C[6]2)	118.3592	0.195	25	118.3592	0.038	25	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CC[6a]H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(CC[6a]H){1|C<3>,2|C<4>}	H(C[6]C[6]2)	118.2494	0.121	5	118.2494	0.015	5	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)2(CHH){1|C<3>,2|C<4>}	H(C[6]C[6]2)	120.8330	0.802	2	119.2953	2.990	10	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(CHH){1|C<3>,2|C<4>}	H(C[6]C[6]2)	121.5265	0.551	2	119.2953	2.990	10	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(CHH){1|C<3>,2|C<4>}	H(C[6]C[6]2)	117.2950	0.359	2	119.2953	2.990	10	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(CHH){1|C<3>,2|C<4>}	H(C[6]C[6]2)	118.4110	0.083	4	119.2953	2.990	10	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(COO){1|C<2>,1|C<3>,1|N<3>}	H(C[6]C[6]2)	123.4040	0.000	1	121.5775	6.672	2	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(COO){1|O<1>,2|C<3>}	H(C[6]C[6]2)	119.7510	0.000	1	121.5775	6.672	2	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]Mo)(C[6]C[6]H)(CHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Mo<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]Mo)(C[6]C[6]H)(CHH){1|C<4>,2|C<3>}	H(C[6]C[6]2)	116.9335	9.213	2	116.9335	84.877	2	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(CC[6a]O)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|N<3>,2|H<1>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(CC[6a]O){1|C<4>,1|S<4>,3|C<3>}	H(C[6]C[6]2)	120.0380	0.000	1	120.0380	0.000	1	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(COO){1|C<4>,4|C<3>}	H(C[6]C[6]2)	118.9090	0.000	1	118.9090	0.000	1	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]C)(H){1|C<3>,1|C<4>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CCN){1|Cl<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.4175	1.620	2	120.4815	2.058	4	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CCN){1|Cl<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.5455	0.213	2	120.4815	2.058	4	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CHN){1|Cl<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.7454	1.089	5	119.6284	0.953	11	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CHN){2|Cl<1>,1|C<3>}	H(C[6]C[6]2)	119.5308	0.965	6	119.6284	0.953	11	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CC[6a]2)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(CC[6a]2){2|Cl<1>,1|C<3>}	H(C[6]C[6]2)	119.3206	0.229	16	119.3206	0.053	16	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]N[5])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]C[6]C)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.0990	0.000	1	120.4660	0.269	2	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]N[5])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]C[6]C)(H){1|Rh<7>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.8330	0.000	1	120.4660	0.269	2	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Ru<9>,1|N<3>,3|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(COO){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1770	0.000	1	120.1770	0.000	1	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CCH){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.4260	0.000	1	119.5055	0.142	10	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Ir<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CCH){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.1280	0.289	3	119.5055	0.142	10	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Ir<8>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CCH){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0740	0.000	1	119.5055	0.142	10	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Os<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CCH){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.6550	0.325	3	119.5055	0.142	10	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Re<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CCH){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.6030	0.232	2	119.5055	0.142	10	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Ir<8>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CHN){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7220	0.000	1	119.7220	0.000	1	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CHO)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Zn<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CHO){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5790	0.000	1	120.5790	0.000	1	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Ru<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CNO){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2200	0.000	1	120.2200	0.000	1	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Co<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(COO){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3829	0.241	33	120.2825	0.166	153	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Cu<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(COO){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	121.0490	0.525	4	120.2825	0.166	153	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Cu<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(COO){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0245	0.474	2	120.2825	0.166	153	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Ir<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(COO){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0817	0.338	12	120.2825	0.166	153	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Mn<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(COO){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4875	0.032	2	120.2825	0.166	153	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(COO){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1850	0.000	1	120.2825	0.166	153	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(COO){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.8820	0.000	1	120.2825	0.166	153	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Os<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(COO){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2878	0.422	6	120.2825	0.166	153	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Os<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(COO){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.5865	0.165	2	120.2825	0.166	153	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Pd<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(COO){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3970	0.285	4	120.2825	0.166	153	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Pt<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(COO){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2822	0.464	23	120.2825	0.166	153	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Pt<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(COO){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.7070	0.598	3	120.2825	0.166	153	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Pt<6>,1|C<2>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(COO){1|C<3>,1|N<3>}	H(C[6]C[6]2)	121.0810	0.000	1	120.2825	0.166	153	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Pt<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(COO){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0689	0.182	11	120.2825	0.166	153	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Re<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(COO){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1825	0.137	6	120.2825	0.166	153	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Rh<8>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(COO){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1095	0.224	2	120.2825	0.166	153	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Ru<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(COO){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1767	0.445	40	120.2825	0.166	153	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]C)(H){1|H<1>,1|O<1>,3|C<3>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CHN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	118.6220	0.000	1	118.6220	0.000	1	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CC[6a]2)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]C)(H){1|H<1>,1|O<1>,3|C<3>}	C[6](C[6]C[6]H)2(CC[6a]2){3|C<3>}	H(C[6]C[6]2)	118.4300	0.000	1	118.4300	0.000	1	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CCC)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H){1|C<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(CCC){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	118.9640	0.000	1	118.9640	0.000	1	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(COO)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H){1|Ir<6>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(COO){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.2460	0.647	4	120.1257	0.307	22	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(COO)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H){1|Pt<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(COO){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.3366	0.290	17	120.1257	0.307	22	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(COO)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H){1|Ru<6>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(COO){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0590	0.000	1	120.1257	0.307	22	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6a]O[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CCC)	H(C[6]C[6]2)	C[6](C[6]C[6a]O[6])(C[6]C[6]C)(H){1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(CCC){1|O<2>,2|C<3>}	H(C[6]C[6]2)	119.4235	0.016	2	119.4235	0.000	2	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6a]O[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CC[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]O[6])(C[6]C[6]C)(H){1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(CC[6]H){1|O<2>,2|C<3>}	H(C[6]C[6]2)	118.6585	0.457	2	118.6585	0.209	2	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6a]Si[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(CC[6a]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]Si[6])(C[6]C[6]C)(H){2|C<4>,4|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(CC[6a]H){1|Si<4>,2|C<3>}	H(C[6]C[6]2)	115.9400	0.000	1	115.9400	0.000	1	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CCH)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]C)(H){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CCH){3|N<3>}	H(C[6]C[6]2)	121.0344	0.200	70	121.0344	0.040	70	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CNS)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]C)(H){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CNS){3|N<3>}	H(C[6]C[6]2)	121.5385	0.221	19	121.5385	0.049	19	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(COO)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]C)(H){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(COO){1|C<3>,2|N<3>}	H(C[6]C[6]2)	122.3320	1.516	4	121.6996	0.619	21	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(COO)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]C)(H){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(COO){3|N<3>}	H(C[6]C[6]2)	121.5476	0.509	14	121.6996	0.619	21	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(COO)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]C)(H){1|Mn<8>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(COO){3|N<3>}	H(C[6]C[6]2)	121.2800	0.000	1	121.6996	0.619	21	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(COO)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]C)(H){1|Zn<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(COO){1|C<3>,2|N<3>}	H(C[6]C[6]2)	121.7085	0.134	2	121.6996	0.619	21	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(CCH)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]C[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(CCH){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9780	0.132	8	119.9780	0.017	8	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]Si[5,6]H)(C[6]C[6]C)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(CC[3]H)	H(C[6]C[6]2)	C[6](C[6]Si[5,6]H)(C[6]C[6]C)(H){2|C<3>,2|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(CC[3]H){1|Si<4>,2|H<1>}	H(C[6]C[6]2)	115.3400	0.000	1	115.3400	0.000	1	120.0399	1.398	3163	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a,6]O)(C[6]C[6]2)(H)	C[6](C[6]C[5a,6]O)(C[6]C[6]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]O)(C[6]C[6]2)(H){1|N<3>,1|O<1>,3|C<3>}	C[6](C[6]C[5a,6]O)(C[6]C[6]2)(C[6]C[6]H){1|H<1>,1|N<2>,2|O<1>,3|C<3>}	H(C[6]C[6]2)	118.0430	0.173	2	118.0430	0.030	2	119.9168	0.940	1944	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]2)(H)	C[6](C[6]C[6,6a]O)(C[6]C[6]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]2)(H){1|O<1>,4|C<3>}	C[6](C[6]C[6,6a]O)(C[6]C[6]2)(C[6]C[6]H){1|H<1>,1|O<1>,1|O<2>,4|C<3>}	H(C[6]C[6]2)	118.0030	0.236	6	118.3794	1.038	7	119.9168	0.940	1944	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]2)(H)	C[6](C[6]C[6,6a]O)(C[6]C[6]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]2)(H){1|O<1>,4|C<3>}	C[6](C[6]C[6,6a]O)(C[6]C[6]2)(C[6]C[6]H){1|H<1>,2|O<1>,4|C<3>}	H(C[6]C[6]2)	120.6380	0.000	1	118.3794	1.038	7	119.9168	0.940	1944	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6]C)(H)	C[6](C[6]C[5,6]C[6])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6]C)(H){1|C<4>,1|H<1>,1|O<1>,2|C<3>}	C[6](C[6]C[5,6]C[6])(C[6]C[6]H)2{1|H<1>,1|N<3>,2|C<4>,4|C<3>}	H(C[6]C[6]2)	117.8170	0.109	2	117.8170	0.012	2	119.9168	0.940	1944	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6]C)(H)	C[6](C[6]C[6]2)(C[6]C[6]C)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6]C)(H){1|C<4>,1|O<1>,3|C<3>}	C[6](C[6]C[6]2)(C[6]C[6]C)(C[6]C[6]H){1|H<1>,1|O<1>,2|C<4>,3|C<3>}	H(C[6]C[6]2)	117.8620	0.000	1	117.8620	0.000	1	119.9168	0.940	1944	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6]C)(H)	C[6](C[6]C[6]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6]C)(H){1|H<1>,1|O<1>,3|C<3>}	C[6](C[6]C[6]2)(C[6]C[6]H)2{2|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	118.0295	0.026	2	118.0295	0.001	2	119.9168	0.940	1944	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[5a,6]2)(C[6]C[6]H)(C[6]N[6]H){1|Co<6>,1|H<1>,2|N<3>,3|C<3>}	H(C[6]C[6]2)	120.6810	0.000	1	120.6810	0.000	1	119.9168	0.940	1944	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6]H)(H){1|C<2>,2|C<3>,2|H<1>}	C[6](C[6]C[5a,6]2)(C[6]C[6]H)2{1|H<1>,2|N<3>,3|C<3>}	H(C[6]C[6]2)	114.6880	0.000	1	114.6880	0.000	1	119.9168	0.940	1944	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]2)(C[6]C[6]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6]H)(H){1|H<1>,4|C<3>}	C[6](C[6]C[6,6a]2)(C[6]C[6]2)(C[6]C[6]H){1|H<1>,1|O<1>,7|C<3>}	H(C[6]C[6]2)	119.6870	0.165	2	119.6870	0.027	2	119.9168	0.940	1944	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6]H)(H)	C[6](C[6]C[6]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6]2)(C[6]C[6]H)(C[6]N[6]H){1|Ni<6>,1|N<3>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	120.1166	0.456	16	120.0560	0.172	29	119.9168	0.940	1944	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6]H)(H)	C[6](C[6]C[6]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6]2)(C[6]C[6]H)(C[6]N[6]H){1|Zn<6>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.0975	0.387	8	120.0560	0.172	29	119.9168	0.940	1944	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6]H)(H)	C[6](C[6]C[6]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6]2)(C[6]C[6]H)(C[6]N[6]H){1|N<3>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	119.5595	0.015	2	120.0560	0.172	29	119.9168	0.940	1944	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6]H)(H)	C[6](C[6]C[6]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6]2)(C[6]C[6]H)(C[6]N[6]H){2|C<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.9533	0.162	3	120.0560	0.172	29	119.9168	0.940	1944	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6]H)(H)	C[6](C[6]C[6]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6]H)(H){1|C<2>,2|C<3>,2|H<1>}	C[6](C[6]C[6]2)(C[6]C[6]H)2{1|Te<2>,1|C<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	115.3610	0.000	1	117.9767	1.375	7	119.9168	0.940	1944	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6]H)(H)	C[6](C[6]C[6]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6]H)(H){1|H<1>,1|O<1>,3|C<3>}	C[6](C[6]C[6]2)(C[6]C[6]H)2{3|C<3>,4|H<1>}	H(C[6]C[6]2)	118.3900	0.051	4	117.9767	1.375	7	119.9168	0.940	1944	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6]H)(H)	C[6](C[6]C[6]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6]H)(H){1|H<1>,4|C<3>}	C[6](C[6]C[6]2)(C[6]C[6]H)2{3|C<3>,4|H<1>}	H(C[6]C[6]2)	118.4580	0.506	2	117.9767	1.375	7	119.9168	0.940	1944	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(C[6]N[6]2)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]O)(C[6]N[6]2){1|C<3>,2|C<4>,4|H<1>}	H(C[6]C[6]2)	119.1850	0.000	1	119.1850	0.000	1	119.9168	0.940	1944	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(C[6]N[6]2)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>,2|N<3>}	C[6](C[6]C[6]H)2(C[6]N[6]2){1|C<3>,1|N<3>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	119.6350	0.000	1	119.6350	0.000	1	119.9168	0.940	1944	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]Au)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6]H)(H){1|Au<4>,1|C<2>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]Au)(C[6]C[6]H){2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.4830	0.000	1	119.4830	0.000	1	119.9168	0.940	1944	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)2{1|Pd<4>,1|C<2>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	118.9015	0.960	2	118.9015	0.921	2	119.9168	0.940	1944	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6]H)(H)	C[6](C[6]N[6]Pd)(C[6]C[6]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6]H)(H){1|Pd<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]N[6]Pd)(C[6]C[6]2)(C[6]C[6]H){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4430	0.014	2	120.4430	0.000	2	119.9168	0.940	1944	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6]N)(H)	C[6](C[6]C[6]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6]N)(H){1|H<1>,1|O<1>,3|C<3>}	C[6](C[6]C[6]2)(C[6]C[6]H)2{2|H<1>,2|N<3>,3|C<3>}	H(C[6]C[6]2)	118.8240	0.390	6	118.8240	0.152	6	119.9168	0.940	1944	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(C[6]N[6]2)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<1>,2|N<3>}	C[6](C[6]C[6]H)2(C[6]N[6]2){1|C<3>,1|N<3>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	119.1540	0.000	1	119.1540	0.000	1	119.9168	0.940	1944	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6]O)(H)	C[6](C[6]C[6]2)(C[6]C[6]H)(C[6]C[6]O)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6]O)(H){1|C<4>,1|O<1>,3|C<3>}	C[6](C[6]C[6]2)(C[6]C[6]H)(C[6]C[6]O){2|H<1>,2|O<1>,3|C<3>}	H(C[6]C[6]2)	125.7150	0.000	1	125.7150	0.000	1	119.9168	0.940	1944	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]C)(H)	C[6](C[6]C[6]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]C)(H){1|C<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]2)(C[6]C[6]H)2{1|N<3>,2|C<3>,2|O<1>,2|O<2>}	H(C[6]C[6]2)	118.3872	0.138	8	118.4067	0.164	20	119.9168	0.940	1944	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]C)(H)	C[6](C[6]C[6]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]C)(H){1|C<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]2)(C[6]C[6]H)2{1|N<3>,2|O<1>,4|C<4>}	H(C[6]C[6]2)	118.2005	0.104	10	118.4067	0.164	20	119.9168	0.940	1944	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]C)(H)	C[6](C[6]C[6]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]C)(H){1|Pd<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]2)(C[6]C[6]H)2{1|N<3>,2|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.5155	0.018	2	118.4067	0.164	20	119.9168	0.940	1944	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](C[6]C[5a,6]2)(C[6]C[6]Cl)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|Cl<1>,1|Co<6>,3|C<3>}	C[6](C[6]C[5a,6]2)(C[6]C[6]Cl)(C[6]C[6]H){2|C<3>,2|H<1>,3|N<3>}	H(C[6]C[6]2)	119.9660	0.000	1	119.9660	0.000	1	119.9168	0.940	1944	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](C[6]C[5a,6]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|Co<6>,1|H<1>,3|C<3>}	C[6](C[6]C[5a,6]2)(C[6]C[6]H)2{2|C<3>,2|H<1>,3|N<3>}	H(C[6]C[6]2)	120.2832	0.408	6	120.2600	0.142	7	119.9168	0.940	1944	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](C[6]C[5a,6]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|Pt<4>,1|H<1>,3|C<3>}	C[6](C[6]C[5a,6]2)(C[6]C[6]H)2{1|H<1>,3|C<3>,3|N<3>}	H(C[6]C[6]2)	120.1210	0.000	1	120.2600	0.142	7	119.9168	0.940	1944	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](C[6]C[6]2)(C[6]C[6]C)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|H<1>,4|C<3>}	C[6](C[6]C[6]2)(C[6]C[6]C)(C[6]C[6]H){1|N<3>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.0125	0.207	2	120.0125	0.043	2	119.9168	0.940	1944	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](C[6]C[6]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|Al<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]2)(C[6]C[6]H)2{1|N<3>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	120.3678	0.079	4	119.9570	0.857	1797	119.9168	0.940	1944	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](C[6]C[6]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|B<3>,1|H<1>,3|C<3>}	C[6](C[6]C[6]2)(C[6]C[6]H)2{1|N<3>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	119.3978	0.736	6	119.9570	0.857	1797	119.9168	0.940	1944	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](C[6]C[6]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|B<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]2)(C[6]C[6]H)2{1|N<3>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	119.7695	0.308	2	119.9570	0.857	1797	119.9168	0.940	1944	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](C[6]C[6]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|B<6>,1|H<1>,3|C<3>}	C[6](C[6]C[6]2)(C[6]C[6]H)2{1|N<3>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	119.9515	0.025	2	119.9570	0.857	1797	119.9168	0.940	1944	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](C[6]C[6]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|C<2>,1|H<1>,2|C<3>}	C[6](C[6]C[6]2)(C[6]C[6]H)2{1|C<2>,1|C<3>,1|N<2>,3|H<1>}	H(C[6]C[6]2)	106.3540	0.000	1	119.9570	0.857	1797	119.9168	0.940	1944	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](C[6]C[6]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|C<2>,2|C<3>,2|H<1>}	C[6](C[6]C[6]2)(C[6]C[6]H)2{1|N<3>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	120.3865	0.838	2	119.9570	0.857	1797	119.9168	0.940	1944	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](C[6]C[6]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|C<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]2)(C[6]C[6]H)2{1|N<3>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	119.8218	0.751	687	119.9570	0.857	1797	119.9168	0.940	1944	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](C[6]C[6]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|Cd<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]2)(C[6]C[6]H)2{1|N<3>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	119.8335	0.257	2	119.9570	0.857	1797	119.9168	0.940	1944	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](C[6]C[6]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|Cd<6>,1|H<1>,3|C<3>}	C[6](C[6]C[6]2)(C[6]C[6]H)2{1|N<3>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	119.8990	0.346	2	119.9570	0.857	1797	119.9168	0.940	1944	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](C[6]C[6]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|Co<5>,1|H<1>,3|C<3>}	C[6](C[6]C[6]2)(C[6]C[6]H)2{1|N<3>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	120.2420	0.013	2	119.9570	0.857	1797	119.9168	0.940	1944	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](C[6]C[6]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|Co<6>,1|H<1>,3|C<3>}	C[6](C[6]C[6]2)(C[6]C[6]H)2{1|N<3>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	119.9744	0.318	38	119.9570	0.857	1797	119.9168	0.940	1944	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](C[6]C[6]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|Co<8>,1|H<1>,3|C<3>}	C[6](C[6]C[6]2)(C[6]C[6]H)2{1|N<3>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	119.6785	0.190	2	119.9570	0.857	1797	119.9168	0.940	1944	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](C[6]C[6]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|Cu<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]2)(C[6]C[6]H)2{1|N<3>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	119.9176	0.401	17	119.9570	0.857	1797	119.9168	0.940	1944	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](C[6]C[6]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|Cu<5>,1|H<1>,3|C<3>}	C[6](C[6]C[6]2)(C[6]C[6]H)2{1|N<3>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	120.2063	0.741	10	119.9570	0.857	1797	119.9168	0.940	1944	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](C[6]C[6]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|Fe<6>,1|H<1>,3|C<3>}	C[6](C[6]C[6]2)(C[6]C[6]H)2{1|N<3>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	120.1925	0.374	21	119.9570	0.857	1797	119.9168	0.940	1944	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](C[6]C[6]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|Ga<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]2)(C[6]C[6]H)2{1|N<3>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	120.1102	0.401	6	119.9570	0.857	1797	119.9168	0.940	1944	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](C[6]C[6]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|H<1>,1|O<1>,3|C<3>}	C[6](C[6]C[6]2)(C[6]C[6]H)2{1|N<3>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	119.8787	1.370	171	119.9570	0.857	1797	119.9168	0.940	1944	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](C[6]C[6]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|H<1>,1|O<2>,3|C<3>}	C[6](C[6]C[6]2)(C[6]C[6]H)2{1|N<3>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	119.7677	0.954	38	119.9570	0.857	1797	119.9168	0.940	1944	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](C[6]C[6]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|H<1>,1|W<6>,3|C<3>}	C[6](C[6]C[6]2)(C[6]C[6]H)2{1|N<3>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	120.1260	0.167	4	119.9570	0.857	1797	119.9168	0.940	1944	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](C[6]C[6]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|H<1>,4|C<3>}	C[6](C[6]C[6]2)(C[6]C[6]H)2{1|N<3>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	120.1461	1.092	70	119.9570	0.857	1797	119.9168	0.940	1944	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](C[6]C[6]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|Ir<6>,1|H<1>,3|C<3>}	C[6](C[6]C[6]2)(C[6]C[6]H)2{1|N<3>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.4730	0.684	2	119.9570	0.857	1797	119.9168	0.940	1944	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](C[6]C[6]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|Ir<8>,1|H<1>,3|C<3>}	C[6](C[6]C[6]2)(C[6]C[6]H)2{1|N<3>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	119.7717	0.499	4	119.9570	0.857	1797	119.9168	0.940	1944	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](C[6]C[6]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|Mn<6>,1|H<1>,3|C<3>}	C[6](C[6]C[6]2)(C[6]C[6]H)2{1|N<3>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	120.0405	0.505	12	119.9570	0.857	1797	119.9168	0.940	1944	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](C[6]C[6]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|Mo<6>,1|H<1>,3|C<3>}	C[6](C[6]C[6]2)(C[6]C[6]H)2{1|N<3>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	119.9655	0.311	6	119.9570	0.857	1797	119.9168	0.940	1944	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](C[6]C[6]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|Ni<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]2)(C[6]C[6]H)2{1|N<3>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	120.4225	0.964	10	119.9570	0.857	1797	119.9168	0.940	1944	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](C[6]C[6]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|Ni<6>,1|H<1>,3|C<3>}	C[6](C[6]C[6]2)(C[6]C[6]H)2{1|N<3>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	120.2807	0.088	4	119.9570	0.857	1797	119.9168	0.940	1944	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](C[6]C[6]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|Os<7>,1|H<1>,3|C<3>}	C[6](C[6]C[6]2)(C[6]C[6]H)2{1|N<3>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.1010	0.000	1	119.9570	0.857	1797	119.9168	0.940	1944	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](C[6]C[6]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|Pd<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]2)(C[6]C[6]H)2{1|C<3>,2|N<3>,4|H<1>}	H(C[6]C[6]2)	119.8539	0.466	18	119.9570	0.857	1797	119.9168	0.940	1944	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](C[6]C[6]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|Pd<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]2)(C[6]C[6]H)2{1|N<3>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	120.1316	0.484	38	119.9570	0.857	1797	119.9168	0.940	1944	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](C[6]C[6]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|Pt<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]2)(C[6]C[6]H)2{1|N<3>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	120.0895	0.625	19	119.9570	0.857	1797	119.9168	0.940	1944	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](C[6]C[6]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|Re<6>,1|H<1>,3|C<3>}	C[6](C[6]C[6]2)(C[6]C[6]H)2{1|N<3>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	120.0768	1.161	20	119.9570	0.857	1797	119.9168	0.940	1944	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](C[6]C[6]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|Rh<8>,1|H<1>,3|C<3>}	C[6](C[6]C[6]2)(C[6]C[6]H)2{1|N<3>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	119.8732	0.597	25	119.9570	0.857	1797	119.9168	0.940	1944	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](C[6]C[6]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|Rh<9>,1|H<1>,3|C<3>}	C[6](C[6]C[6]2)(C[6]C[6]H)2{1|N<3>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	119.9460	0.120	2	119.9570	0.857	1797	119.9168	0.940	1944	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](C[6]C[6]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|Ru<6>,1|H<1>,3|C<3>}	C[6](C[6]C[6]2)(C[6]C[6]H)2{1|N<3>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	120.3349	0.368	9	119.9570	0.857	1797	119.9168	0.940	1944	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](C[6]C[6]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|Ru<6>,1|H<1>,3|C<3>}	C[6](C[6]C[6]2)(C[6]C[6]H)2{1|N<3>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.7620	0.044	2	119.9570	0.857	1797	119.9168	0.940	1944	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](C[6]C[6]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|Sn<5>,1|H<1>,3|C<3>}	C[6](C[6]C[6]2)(C[6]C[6]H)2{1|N<3>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	119.9265	0.118	2	119.9570	0.857	1797	119.9168	0.940	1944	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](C[6]C[6]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|Ti<12>,1|H<1>,3|C<3>}	C[6](C[6]C[6]2)(C[6]C[6]H)2{1|N<3>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	119.7620	0.229	4	119.9570	0.857	1797	119.9168	0.940	1944	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](C[6]C[6]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|Zn<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]2)(C[6]C[6]H)2{1|N<3>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	120.1421	0.351	16	119.9570	0.857	1797	119.9168	0.940	1944	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](C[6]C[6]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|Zn<5>,1|H<1>,3|C<3>}	C[6](C[6]C[6]2)(C[6]C[6]H)2{1|N<3>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	120.0517	0.338	6	119.9570	0.857	1797	119.9168	0.940	1944	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](C[6]C[6]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|Zn<6>,1|H<1>,3|C<3>}	C[6](C[6]C[6]2)(C[6]C[6]H)2{1|N<3>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	120.1275	0.033	2	119.9570	0.857	1797	119.9168	0.940	1944	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](C[6]C[6]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){2|H<1>,3|C<3>}	C[6](C[6]C[6]2)(C[6]C[6]H)2{1|N<3>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	120.1249	0.886	508	119.9570	0.857	1797	119.9168	0.940	1944	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)2{1|N<3>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	120.3247	0.205	4	120.3247	0.042	4	119.9168	0.940	1944	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|Ir<6>,1|C<4>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]Ir)(C[6]C[6]H){1|N<3>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	120.5230	0.141	4	120.5230	0.020	4	119.9168	0.940	1944	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]O[6]C)(H)	C[6](C[6]C[6]H)2(C[6]N[6]2)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]O[6]C)(H){1|C<3>,1|H<1>,2|N<3>}	C[6](C[6]C[6]H)2(C[6]N[6]2){1|O<2>,2|C<4>,4|C<3>}	H(C[6]C[6]2)	118.5810	0.231	2	118.5810	0.053	2	119.9168	0.940	1944	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]2)(H)	C[6](C[6]C[5a,6]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]2)(H){1|Pt<4>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6]C[5a,6]2)(C[6]C[6]H)2{1|H<1>,3|C<3>,3|N<3>}	H(C[6]C[6]2)	119.7340	0.000	1	119.7340	0.000	1	119.9168	0.940	1944	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]2)(H)	C[6](C[6]C[6]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]2)(H){1|Co<6>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6]C[6]2)(C[6]C[6]H)2{1|N<3>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.4223	0.199	7	120.3881	0.197	21	119.9168	0.940	1944	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]2)(H)	C[6](C[6]C[6]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]2)(H){1|Cr<6>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6]C[6]2)(C[6]C[6]H)2{1|N<3>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.6645	0.247	2	120.3881	0.197	21	119.9168	0.940	1944	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]2)(H)	C[6](C[6]C[6]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]2)(H){1|Cu<6>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6]C[6]2)(C[6]C[6]H)2{1|N<3>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.2263	0.603	3	120.3881	0.197	21	119.9168	0.940	1944	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]2)(H)	C[6](C[6]C[6]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]2)(H){1|Fe<6>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6]C[6]2)(C[6]C[6]H)2{1|N<3>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.6190	0.218	2	120.3881	0.197	21	119.9168	0.940	1944	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]2)(H)	C[6](C[6]C[6]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]2)(H){1|Ir<6>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6]C[6]2)(C[6]C[6]H)2{1|N<3>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.0230	0.434	2	120.3881	0.197	21	119.9168	0.940	1944	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]2)(H)	C[6](C[6]C[6]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]2)(H){1|Ni<6>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6]C[6]2)(C[6]C[6]H)2{1|N<3>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.5070	0.954	3	120.3881	0.197	21	119.9168	0.940	1944	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]2)(H)	C[6](C[6]C[6]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]2)(H){1|Ru<6>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6]C[6]2)(C[6]C[6]H)2{1|N<3>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.1910	0.363	2	120.3881	0.197	21	119.9168	0.940	1944	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]2)(H)	C[6](C[6]C[6]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]2)(H){1|Os<7>,1|H<1>,5|C<3>}	C[6](C[6]C[6]2)(C[6]C[6]H)2{1|N<3>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	118.5340	0.000	1	118.5340	0.000	1	119.9168	0.940	1944	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]2)(H)	C[6](C[6]C[6]H)2(C[6]N[6]2)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]2)(H){1|H<1>,2|N<3>,4|C<3>}	C[6](C[6]C[6]H)2(C[6]N[6]2){1|N<3>,6|C<3>}	H(C[6]C[6]2)	118.5210	0.293	2	118.5210	0.086	2	119.9168	0.940	1944	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]2)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]2)(H){2|Pt<4>,1|N<3>,4|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]Pt)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.1480	0.000	1	120.1480	0.000	1	119.9168	0.940	1944	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]O[6])(C[6]C[6]2)(H)	C[6](C[6]C[6]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]O[6])(C[6]C[6]2)(H){1|H<1>,5|C<3>}	C[6](C[6]C[6]2)(C[6]C[6]H)2{1|O<2>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.6076	1.885	8	119.6076	3.552	8	119.9168	0.940	1944	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]O[6])(C[6]C[6]2)(H)	C[6](C[6]C[6]H)2(C[6]N[6]2)	H(C[6]C[6]2)	C[6](C[6]C[6a]O[6])(C[6]C[6]2)(H){1|H<1>,2|N<3>,3|C<3>}	C[6](C[6]C[6]H)2(C[6]N[6]2){1|O<2>,6|C<3>}	H(C[6]C[6]2)	120.1455	0.091	2	120.1455	0.008	2	119.9168	0.940	1944	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]S[6])(C[6]C[6]2)(H)	C[6](C[6]C[6]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]S[6])(C[6]C[6]2)(H){1|H<1>,5|C<3>}	C[6](C[6]C[6]2)(C[6]C[6]H)2{1|S<2>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	116.5605	0.026	2	116.5605	0.001	2	119.9168	0.940	1944	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[3,6]O)(C[6]C[6]N)(H)	C[6](C[6]C[3,6]O)(C[6]C[6]H)(NCH)	H(C[6]C[6]2)	C[6](C[6]C[3,6]O)(C[6]C[6]N)(H){1|C<4>,1|O<1>,2|O<2>}	C[6](C[6]C[3,6]O)(C[6]C[6]H)(NCH){1|O<1>,1|O<2>,2|C<4>}	H(C[6]C[6]2)	119.3640	0.468	2	119.3640	0.219	2	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]N)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(NOO)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]N)(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(NOO){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.1840	0.000	1	120.5463	0.113	3	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]N)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(NOO)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]N)(H){1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(NOO){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.7275	0.169	2	120.5463	0.113	3	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[5,6]N)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(NOO)	H(C[6]C[6]2)	C[6](C[6]C[5,6]N)(C[6]C[6]N)(H){1|C<3>,1|H<1>,2|O<2>}	C[6](C[6]C[6]H)2(NOO){1|C<4>,2|N<3>}	H(C[6]C[6]2)	119.0660	1.407	2	119.0660	1.980	2	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]O)(NHH){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.5755	0.069	2	119.5755	0.005	2	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(NOO)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|N<2>,1|N<3>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(NOO){1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.3710	0.202	2	119.3710	0.041	2	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(NHH)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]N)(H){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(NHH){1|C<3>,2|N<3>}	H(C[6]C[6]2)	120.8570	0.034	2	120.8570	0.001	2	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(NOO)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]N)(H){1|H<1>,1|N<3>,1|O<1>,2|C<3>}	C[6](C[6]C[6]H)2(NOO){3|C<3>}	H(C[6]C[6]2)	119.8932	0.189	4	119.8932	0.036	4	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6,6a]N)(C[6]C[6]N)(H)	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(NC[6a]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]N)(C[6]C[6]N)(H){1|O<1>,2|C<3>}	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(NC[6a]H){1|N<2>,2|C<3>}	H(C[6]C[6]2)	120.1760	0.000	1	120.1760	0.000	1	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]N)(H)	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]N)(H){1|O<1>,2|C<3>}	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(NCC){1|O<1>,2|C<3>}	H(C[6]C[6]2)	118.7315	0.576	4	118.7315	0.331	4	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]N)(H)	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]N)(H){1|O<1>,2|C<3>}	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(NCH){1|O<1>,2|C<3>}	H(C[6]C[6]2)	119.2617	0.545	17	119.2994	0.305	18	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]N)(H)	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]N)(H){1|O<1>,2|C<3>}	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(NCH){1|O<2>,2|C<3>}	H(C[6]C[6]2)	119.9410	0.000	1	119.2994	0.305	18	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]N)(H)	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(NC[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]N)(H){1|O<1>,2|C<3>}	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(NC[6]H){1|O<1>,2|C<3>}	H(C[6]C[6]2)	118.2360	0.000	1	118.2360	0.000	1	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]N)(H)	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(NC[6a]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]N)(H){1|O<1>,2|C<3>}	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(NC[6a]H){1|O<1>,2|C<3>}	H(C[6]C[6]2)	118.8175	0.100	2	118.8175	0.010	2	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]N)(H)	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(NC[6a]Pd)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]N)(H){1|O<2>,2|C<3>}	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(NC[6a]Pd){1|O<1>,2|C<3>}	H(C[6]C[6]2)	118.5353	0.893	3	118.5353	0.798	3	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]N)(H)	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]N)(H){1|O<1>,2|C<3>}	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(NHH){1|O<1>,2|C<3>}	H(C[6]C[6]2)	118.5467	0.387	3	118.5467	0.150	3	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]O)(NHH){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.1530	0.000	1	119.1530	0.000	1	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(NOO)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6]N)(H){1|H<1>,1|O<1>,3|C<3>}	C[6](C[6]C[6]H)(C[6]C[6]O)(NOO){1|N<3>,2|C<3>}	H(C[6]C[6]2)	118.8498	0.496	6	118.8498	0.246	6	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(NOO)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6]N)(H){1|N<3>,1|O<1>,2|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(NOO){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.0720	0.000	1	120.0720	0.000	1	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(NC[6a]O)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(NC[6a]O){2|Br<1>,1|C<3>}	H(C[6]C[6]2)	120.2360	0.262	2	120.2360	0.068	2	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(NCH){1|C<3>,2|C<4>}	H(C[6]C[6]2)	119.7600	0.000	1	119.7600	0.000	1	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(NHH){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.6064	0.188	5	119.6064	0.035	5	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NCH){1|Pd<4>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	119.8300	0.274	4	119.8300	0.075	4	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(NOO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(NOO){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.9085	0.012	2	120.0414	0.155	61	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(NOO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(NOO){1|C<4>,2|C<3>}	H(C[6]C[6]2)	119.8505	0.441	2	120.0414	0.155	61	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(NOO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(NOO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.9506	0.281	26	120.0414	0.155	61	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(NOO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(NOO){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.1262	0.461	29	120.0414	0.155	61	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(NOO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(NOO){1|O<2>,2|C<3>}	H(C[6]C[6]2)	119.8300	0.000	1	120.0414	0.155	61	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(NOO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(NOO){3|C<3>}	H(C[6]C[6]2)	120.8020	0.000	1	120.0414	0.155	61	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]N)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(NOO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(NOO){1|C<4>,1|N<3>,1|O<1>,2|C<3>}	H(C[6]C[6]2)	119.2740	0.000	1	119.2740	0.000	1	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]N)(H)	C[6](C[6]N[6]Cl)(C[6]C[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]N)(H){1|Cl<1>,1|H<1>,1|N<3>}	C[6](C[6]N[6]Cl)(C[6]C[6]H)(NHH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	118.6570	0.000	1	118.6570	0.000	1	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(NCH){1|Cl<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	118.8050	0.000	1	118.8050	0.000	1	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(NCuC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(NCuC){1|C<2>,2|H<1>}	H(C[6]C[6]2)	118.4760	0.000	1	118.4760	0.000	1	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(NHH){1|C<2>,2|H<1>}	H(C[6]C[6]2)	122.0080	0.000	1	122.0080	0.000	1	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(NPdN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(NPdN){1|C<2>,2|H<1>}	H(C[6]C[6]2)	117.5870	0.000	1	117.5870	0.000	1	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(NMoC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(NMoC){1|C<2>,2|H<1>}	H(C[6]C[6]2)	117.6330	0.000	1	117.6330	0.000	1	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(NZnC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(NZnC){1|C<2>,2|H<1>}	H(C[6]C[6]2)	120.5500	0.000	1	120.5500	0.000	1	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(NCH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	121.0800	0.000	1	121.0800	0.000	1	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(NOO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(NOO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9880	0.000	1	119.6217	0.239	4	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(NOO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(NOO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.7945	0.131	2	119.6217	0.239	4	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(NOO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|N<3>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(NOO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	118.9100	0.000	1	119.6217	0.239	4	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(NPdP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(NPdP){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.4950	0.000	1	119.4950	0.000	1	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]C[6]P)(NC[6]Ti)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<2>,1|C<4>,1|P<4>}	C[6](C[6]C[6]H)(C[6]C[6]P)(NC[6]Ti){1|C<3>,1|H<1>}	H(C[6]C[6]2)	116.4530	0.000	1	116.7595	0.188	2	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]C[6]P)(NC[6]Ti)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|P<4>,2|C<3>}	C[6](C[6]C[6]H)(C[6]C[6]P)(NC[6]Ti){1|C<3>,2|H<1>}	H(C[6]C[6]2)	117.0660	0.000	1	116.7595	0.188	2	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(NHH){1|Zn<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9900	0.000	1	119.9900	0.000	1	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NCH){1|Pt<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0050	0.000	1	120.4632	0.435	135	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NCH){1|Pt<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3856	0.143	5	120.4632	0.435	135	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NCH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3160	0.000	1	120.4632	0.435	135	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NCH){1|Ag<3>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6590	0.000	1	120.4632	0.435	135	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NCH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.1826	0.365	5	120.4632	0.435	135	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NCH){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	120.3790	0.000	1	120.4632	0.435	135	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NCH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9297	0.406	22	120.4632	0.435	135	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NCH){1|Cd<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5476	0.400	7	120.4632	0.435	135	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NCH){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4500	0.190	5	120.4632	0.435	135	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NCH){1|Cu<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1137	0.081	3	120.4632	0.435	135	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NCH){1|Hg<3>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9650	0.000	1	120.4632	0.435	135	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NCH){1|Hg<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5574	0.304	12	120.4632	0.435	135	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NCH){1|Mn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3985	0.299	2	120.4632	0.435	135	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NCH){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.0217	0.269	4	120.4632	0.435	135	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NCH){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7023	0.865	52	120.4632	0.435	135	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NCH){1|Zn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3873	0.360	12	120.4632	0.435	135	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NCH){1|Zn<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7440	0.000	1	120.4632	0.435	135	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NC[6a]2)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NC[6a]2){1|Ir<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8000	0.000	1	119.8000	0.000	1	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NCoC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NCoC){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.9022	0.272	9	119.9022	0.074	9	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NHH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.4495	0.204	4	119.6418	0.924	74	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NHH){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1345	0.138	2	119.6418	0.924	74	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NHH){1|Fe<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.0410	0.000	1	119.6418	0.924	74	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NHH){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1561	0.801	7	119.6418	0.924	74	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NHH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.9284	0.357	7	119.6418	0.924	74	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NHH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.2919	1.087	35	119.6418	0.924	74	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NHH){1|Cd<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2605	0.194	2	119.6418	0.924	74	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NHH){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	117.5080	0.000	1	119.6418	0.924	74	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NHH){1|Co<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2795	0.327	2	119.6418	0.924	74	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NHH){1|Cu<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5190	0.000	1	119.6418	0.924	74	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NHH){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1560	0.000	1	119.6418	0.924	74	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NHH){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3910	0.000	1	119.6418	0.924	74	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NHH){1|Mn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1290	0.000	1	119.6418	0.924	74	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NHH){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.2835	1.705	2	119.6418	0.924	74	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NHH){1|Re<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2113	0.218	4	119.6418	0.924	74	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NHH){1|Ru<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5160	0.182	2	119.6418	0.924	74	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NHH){1|Zn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3510	0.000	1	119.6418	0.924	74	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NHP){1|Cd<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5563	1.265	7	120.8207	1.238	15	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NHP){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.0521	0.987	8	120.8207	1.238	15	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NIrC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NIrC){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.7970	0.000	1	119.7970	0.000	1	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NIrN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NIrN){1|Ir<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.1635	0.078	2	121.1635	0.006	2	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NNiC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NNiC){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.8992	0.428	4	119.8992	0.183	4	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NOO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NOO){1|Ir<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.1650	0.000	1	120.8899	0.701	14	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NOO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NOO){1|Pt<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.9870	0.335	2	120.8899	0.701	14	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NOO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NOO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2692	0.820	6	120.8899	0.701	14	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NOO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NOO){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.8230	0.000	1	120.8899	0.701	14	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NOO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NOO){1|Co<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.5210	0.000	1	120.8899	0.701	14	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NOO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NOO){1|Ni<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	122.0105	0.333	2	120.8899	0.701	14	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NOO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NOO){1|Zn<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.3390	0.000	1	120.8899	0.701	14	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(NHH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	118.7445	1.098	17	118.7445	1.206	17	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(NOO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(NOO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.6926	0.359	18	119.6926	0.129	18	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NCC){1|C<2>,2|H<1>}	H(C[6]C[6]2)	125.7299	9.637	8	123.8619	66.811	12	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(NCC){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	120.1260	0.601	4	123.8619	66.811	12	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<2>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(NCH){1|C<3>,1|H<1>}	H(C[6]C[6]2)	117.1450	0.000	1	117.1287	4.572	6	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<2>,2|H<1>}	C[6](C[6]C[6]H)2(NCH){1|C<3>,1|H<1>}	H(C[6]C[6]2)	118.0920	0.000	1	117.1287	4.572	6	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)2(NCH){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	115.7310	0.000	1	117.1287	4.572	6	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NCH){1|C<2>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	114.0130	0.000	1	117.1287	4.572	6	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NCH){1|C<2>,2|H<1>}	H(C[6]C[6]2)	118.8955	2.007	2	117.1287	4.572	6	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(NC[6]2)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<2>,2|H<1>}	C[6](C[6]C[6]H)2(NC[6]2){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.0780	0.000	2	119.0780	0.000	2	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(NC[6]Cu)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<2>,2|H<1>}	C[6](C[6]C[6]H)2(NC[6]Cu){1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0890	0.000	1	120.0890	0.000	1	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(NC[6a]2)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(NC[6a]2){1|Ag<5>,1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7430	0.000	1	119.7430	0.000	1	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(NC[6a]S)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(NC[6a]S){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.0280	0.000	1	119.0280	0.000	1	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(NCuC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(NCuC){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	119.9442	1.093	4	119.9442	1.195	4	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NHH){1|C<2>,2|H<1>}	H(C[6]C[6]2)	116.2400	1.438	2	116.2400	2.069	2	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(NOO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<2>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(NOO){1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.9170	0.000	1	120.1586	0.717	114	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(NOO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<2>,1|H<1>,1|N<4>}	C[6](C[6]C[6]H)2(NOO){1|C<3>,1|H<1>}	H(C[6]C[6]2)	123.4540	0.000	1	120.1586	0.717	114	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(NOO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(NOO){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	121.7100	0.000	1	120.1586	0.717	114	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(NOO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(NOO){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.2167	0.180	3	120.1586	0.717	114	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(NOO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(NOO){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7069	1.042	17	120.1586	0.717	114	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(NOO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(NOO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3029	0.420	64	120.1586	0.717	114	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(NOO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(NOO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.7971	1.035	26	120.1586	0.717	114	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(NOO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(NOO){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	121.2180	0.000	1	120.1586	0.717	114	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(NZnC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(NZnC){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2070	0.072	2	120.2070	0.005	2	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(NCC){1|Zn<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.6380	0.000	1	120.6380	0.000	1	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(NC[5]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(NC[5]H){1|Re<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.4690	0.315	2	119.4690	0.099	2	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(NC[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(NC[6]H){1|Re<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.5605	0.233	4	119.5605	0.054	4	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(NHH){1|Cd<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.8590	0.000	1	119.7398	0.075	4	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(NHH){1|Mn<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.9400	0.000	1	119.7398	0.075	4	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(NHH){1|Ni<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.3360	0.000	1	119.7398	0.075	4	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(NHH){1|Zn<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.8240	0.000	1	119.7398	0.075	4	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(NNiC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(NNiC){1|Ni<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.5670	0.000	1	120.5670	0.000	1	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(NOO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(NOO){1|H<1>,1|N<3>,1|O<1>,2|C<3>}	H(C[6]C[6]2)	119.3740	0.331	2	119.3902	3.582	6	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(NOO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(NOO){1|Pt<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.3982	2.436	4	119.3902	3.582	6	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(NHH){1|Fe<6>,1|H<1>,1|N<2>,2|C<3>}	H(C[6]C[6]2)	119.6930	0.000	1	119.6930	0.000	1	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(NOO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(NOO){1|H<1>,1|N<2>,1|O<1>,2|C<3>}	H(C[6]C[6]2)	120.3610	0.000	1	120.3610	0.000	1	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]N[6]Cl)(C[6]C[6]H)(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|Cl<1>,1|H<1>,1|N<3>}	C[6](C[6]N[6]Cl)(C[6]C[6]H)(NCH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.5090	0.000	1	119.5090	0.000	1	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]N[6]Cl)(C[6]C[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|Cl<1>,1|H<1>,1|N<3>}	C[6](C[6]N[6]Cl)(C[6]C[6]H)(NHH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.3657	0.312	3	119.3657	0.097	3	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]C[6]N)(NCH){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	117.1470	0.000	1	117.1470	0.000	1	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(NC[6a]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]C[6]O)(H){1|C<3>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(NC[6a]H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	118.9940	0.000	1	118.9940	0.000	1	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|N<2>}	C[6](C[6]C[6]H)(C[6]C[6]N)(NHH){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	118.7340	0.000	1	118.7340	0.000	1	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(NCC){1|C<3>,1|C<4>,1|O<1>}	H(C[6]C[6]2)	119.0530	0.000	1	118.9043	0.019	3	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]C[6]O)(H){1|C<3>,1|N<3>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(NCC){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	118.8300	0.068	2	118.9043	0.019	3	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(NCH){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	118.9057	0.149	3	119.0344	0.042	5	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]C[6]O)(H){1|C<3>,1|N<3>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(NCH){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	119.2275	0.032	2	119.0344	0.042	5	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(NC[6a]C)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(NC[6a]C){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	119.1290	0.000	1	118.7660	0.148	3	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(NC[6a]C)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]C[6]O)(H){1|C<3>,1|N<3>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(NC[6a]C){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	118.5845	0.315	2	118.7660	0.148	3	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(NC[6a]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]C[6]O)(H){1|C<3>,1|N<3>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(NC[6a]H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	120.7980	2.051	2	120.7980	4.205	2	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]C[6]O)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(NCC){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	119.2458	1.358	4	119.2458	1.843	4	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)2(NCH){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	120.3110	0.000	1	120.3110	0.000	1	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(NC[6a]S)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(NC[6a]S){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.0780	0.000	1	119.0780	0.000	1	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(NCuC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]C[6]O)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(NCuC){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	119.6225	0.962	4	119.6225	0.925	4	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(NOO)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(NOO){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	118.8770	0.000	1	120.2193	1.375	3	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(NOO)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(NOO){1|O<2>,2|C<3>}	H(C[6]C[6]2)	120.7380	0.000	1	120.2193	1.375	3	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(NOO)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]C[6]O)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(NOO){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	121.0430	0.000	1	120.2193	1.375	3	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]C[6]S)(H)	C[6](C[6]C[6]H)2(NOO)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]C[6]S)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(NOO){1|C<3>,1|N<3>,1|S<4>}	H(C[6]C[6]2)	120.3890	0.000	1	120.3890	0.000	1	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]C)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NCC){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.6950	0.000	1	119.8358	0.132	23	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]C)(H){1|Cu<3>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NCC){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.1245	0.189	2	119.8358	0.132	23	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]C)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NCC){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9050	0.007	2	119.8358	0.132	23	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]C)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NCC){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.0040	0.000	1	119.8358	0.132	23	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]C)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NCC){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.5320	0.000	1	119.8358	0.132	23	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]C)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NCC){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.1220	0.432	3	119.8358	0.132	23	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]C)(H){1|Fe<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NCC){1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.9127	0.397	3	119.8358	0.132	23	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NCC){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7080	0.000	1	119.8358	0.132	23	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NCC){1|N<3>,2|C<4>}	H(C[6]C[6]2)	119.7785	0.177	2	119.8358	0.132	23	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]C)(H){1|Ir<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NCC){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9663	0.086	3	119.8358	0.132	23	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NCC){1|N<3>,2|C<4>}	H(C[6]C[6]2)	119.9163	0.450	4	119.8358	0.132	23	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(NCO)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]C)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NCO){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	114.5510	0.000	1	114.5510	0.000	1	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NHH){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8605	0.130	4	119.8605	0.017	4	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(NOO)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(NOO){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1215	0.361	2	120.4468	0.271	5	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(NOO)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(NOO){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3870	0.000	1	120.4468	0.271	5	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(NOO)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(NOO){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3100	0.000	1	120.4468	0.271	5	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(NOO)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NOO){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.2940	0.000	1	120.4468	0.271	5	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]C)(H)	C[6](C[6]Si[6]H)(C[6]C[6]H)(NC[6a]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]C)(H){1|Si<4>,1|C<3>,1|H<1>}	C[6](C[6]Si[6]H)(C[6]C[6]H)(NC[6a]H){2|Br<1>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	116.7420	0.000	1	116.7420	0.000	1	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]C)(H)	C[6](C[6]Si[6]H)(C[6]C[6]H)(NC[6a]Si)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]C)(H){1|Si<4>,1|C<3>,1|H<1>}	C[6](C[6]Si[6]H)(C[6]C[6]H)(NC[6a]Si){2|Br<1>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	117.0090	0.000	1	117.0090	0.000	1	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]Br)(C[6]C[6]H)(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Br<1>,1|C<3>,1|H<1>}	C[6](C[6]C[6]Br)(C[6]C[6]H)(NCC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.0820	0.000	1	119.0820	0.000	1	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(NC[6a]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(NC[6a]H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.8465	0.102	4	119.8465	0.010	4	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,2|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(NHH){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.5753	0.262	3	119.7680	0.076	6	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Cd<6>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(NHH){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.9940	0.103	2	119.7680	0.076	6	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Zn<4>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(NHH){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.8940	0.000	1	119.7680	0.076	6	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(NOO)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|O<1>}	C[6](C[6]C[6]C)(C[6]C[6]H)(NOO){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.9728	0.582	30	119.9728	0.338	30	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Cl<1>,1|C<3>,1|H<1>}	C[6](C[6]C[6]Cl)(C[6]C[6]H)(NCC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.0590	0.000	1	119.0590	0.000	1	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]C[6]N)(NHH){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.2510	0.000	1	119.4761	0.650	14	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(NHH){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.2643	1.016	8	119.4761	0.650	14	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|N<4>}	C[6](C[6]C[6]H)(C[6]C[6]N)(NHH){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.8602	0.141	5	119.4761	0.650	14	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(NZnC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(NZnC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.9140	0.000	1	119.9140	0.000	1	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]S)(NC[6a]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|S<4>}	C[6](C[6]C[6]H)(C[6]C[6]S)(NC[6a]H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.5535	0.067	2	119.6505	0.014	4	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]S)(NC[6a]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|S<4>}	C[6](C[6]C[6]H)(C[6]C[6]S)(NC[6a]H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.7475	0.033	2	119.6505	0.014	4	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]S)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|S<4>}	C[6](C[6]C[6]H)(C[6]C[6]S)(NHH){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.5385	0.196	2	119.5385	0.038	2	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Ag<2>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NCC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.0390	0.041	2	119.9274	0.248	757	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Ag<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NCC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.1395	0.066	2	119.9274	0.248	757	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Al<3>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NCC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.9220	0.102	4	119.9274	0.248	757	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Al<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NCC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.9320	0.054	4	119.9274	0.248	757	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Al<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NCC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.5060	0.117	2	119.9274	0.248	757	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|As<3>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NCC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.7365	0.256	6	119.9274	0.248	757	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|As<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NCC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.8500	0.034	2	119.9274	0.248	757	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Au<2>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NCC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.3612	0.488	4	119.9274	0.248	757	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|B<3>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NCC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.7096	0.255	8	119.9274	0.248	757	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NCC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.8699	0.139	52	119.9274	0.248	757	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(NCC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.6097	0.203	20	119.9274	0.248	757	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|I<1>}	C[6](C[6]C[6]H)2(NCC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.8155	0.190	4	119.9274	0.248	757	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|I<3>}	C[6](C[6]C[6]H)2(NCC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.0160	0.105	2	119.9274	0.248	757	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(NCC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.6785	0.050	2	119.9274	0.248	757	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(NCC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.8186	0.305	8	119.9274	0.248	757	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|P<3>}	C[6](C[6]C[6]H)2(NCC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.6853	0.374	15	119.9274	0.248	757	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|P<4>}	C[6](C[6]C[6]H)2(NCC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.7020	0.208	24	119.9274	0.248	757	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	C[6](C[6]C[6]H)2(NCC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.5000	0.086	2	119.9274	0.248	757	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|S<4>}	C[6](C[6]C[6]H)2(NCC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.6765	0.211	2	119.9274	0.248	757	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|W<9>}	C[6](C[6]C[6]H)2(NCC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.9731	0.292	8	119.9274	0.248	757	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(NCC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.0481	0.690	210	119.9274	0.248	757	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Co<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NCC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.9570	0.181	2	119.9274	0.248	757	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Co<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NCC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.9465	0.210	2	119.9274	0.248	757	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NCC){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6100	0.000	1	119.9274	0.248	757	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NCC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.9360	0.192	9	119.9274	0.248	757	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Cr<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NCC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.9925	0.090	2	119.9274	0.248	757	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Cr<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NCC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	121.3260	0.684	2	119.9274	0.248	757	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Cu<3>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NCC){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0465	0.111	2	119.9274	0.248	757	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Cu<3>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NCC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.0172	0.137	6	119.9274	0.248	757	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NCC){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1335	0.162	2	119.9274	0.248	757	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NCC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.0591	0.215	12	119.9274	0.248	757	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NCC){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1990	0.000	1	119.9274	0.248	757	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NCC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.9484	0.288	20	119.9274	0.248	757	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Fe<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NCC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.0288	0.159	6	119.9274	0.248	757	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Fe<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NCC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.9732	0.174	6	119.9274	0.248	757	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NCC){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4790	0.000	1	119.9274	0.248	757	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NCC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.1905	0.316	2	119.9274	0.248	757	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Ga<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NCC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.3863	0.879	8	119.9274	0.248	757	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Ge<3>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NCC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.9405	0.280	4	119.9274	0.248	757	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(NCC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.5214	0.301	34	119.9274	0.248	757	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|In<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NCC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.9970	0.069	2	119.9274	0.248	757	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NCC){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2095	0.318	13	119.9274	0.248	757	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NCC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.9127	0.223	12	119.9274	0.248	757	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NCC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.9560	0.129	2	119.9274	0.248	757	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Mg<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NCC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.1225	0.391	4	119.9274	0.248	757	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Mg<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NCC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.1508	0.223	4	119.9274	0.248	757	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NCC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.0321	0.105	8	119.9274	0.248	757	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Mo<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NCC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.8465	0.142	22	119.9274	0.248	757	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Nb<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NCC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.1555	0.078	2	119.9274	0.248	757	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Ni<3>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NCC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.8548	0.728	6	119.9274	0.248	757	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NCC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.9532	0.130	4	119.9274	0.248	757	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NCC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.9726	0.481	40	119.9274	0.248	757	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NCC){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8890	0.000	1	119.9274	0.248	757	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NCC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.4757	0.766	6	119.9274	0.248	757	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Pt<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NCC){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4675	0.189	2	119.9274	0.248	757	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Pt<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NCC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.8940	0.279	8	119.9274	0.248	757	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NCC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.6912	0.685	15	119.9274	0.248	757	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Re<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NCC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.8810	0.397	2	119.9274	0.248	757	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Rh<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NCC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.3245	0.307	4	119.9274	0.248	757	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NCC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.8586	0.237	33	119.9274	0.248	757	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Ru<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NCC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.5635	0.106	4	119.9274	0.248	757	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Ru<9>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NCC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.8470	0.212	5	119.9274	0.248	757	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Si<3>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NCC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.0065	0.062	2	119.9274	0.248	757	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Si<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NCC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.9871	0.369	22	119.9274	0.248	757	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Si<4>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(NCC){1|N<3>,1|P<4>,2|H<1>}	H(C[6]C[6]2)	120.9200	0.000	1	119.9274	0.248	757	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Si<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NCC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.0438	0.087	4	119.9274	0.248	757	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Sn<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NCC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.6605	0.190	2	119.9274	0.248	757	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Te<3>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NCC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.0605	0.012	2	119.9274	0.248	757	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Th<13>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NCC){1|Th<13>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7780	0.000	1	119.9274	0.248	757	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Ti<10>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NCC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.9680	0.096	4	119.9274	0.248	757	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NCC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.8620	0.064	2	119.9274	0.248	757	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Zn<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NCC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.9183	0.142	7	119.9274	0.248	757	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Zr<12>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NCC){1|Zr<12>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.3035	0.957	2	119.9274	0.248	757	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Zr<13>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NCC){1|Zr<13>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	122.3790	0.000	1	119.9274	0.248	757	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Zr<13>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(NCC){1|Zr<13>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.5780	0.000	1	119.9274	0.248	757	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Zr<14>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NCC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.1725	0.209	2	119.9274	0.248	757	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(NCH){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.1335	0.264	20	120.4856	0.694	106	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(NCH){1|N<3>,2|H<1>}	H(C[6]C[6]2)	122.4440	1.551	2	120.4856	0.694	106	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(NCH){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.5500	0.968	30	120.4856	0.694	106	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Cd<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NCH){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.4685	0.697	2	120.4856	0.694	106	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Cd<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NCH){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.7140	0.477	2	120.4856	0.694	106	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NCH){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.8595	1.588	6	120.4856	0.694	106	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NCH){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.7800	0.783	4	120.4856	0.694	106	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NCH){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.1760	1.290	2	120.4856	0.694	106	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NCH){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.1689	0.435	16	120.4856	0.694	106	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NCH){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.6586	0.669	18	120.4856	0.694	106	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Zn<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NCH){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.4657	0.495	4	120.4856	0.694	106	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NCN)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(NCN){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.7430	2.038	2	120.0025	1.167	6	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NCN)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(NCN){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.1322	0.702	4	120.0025	1.167	6	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NCO)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NCO){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.0280	0.000	1	120.5886	0.129	10	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NCO)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NCO){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.3790	0.245	4	120.5886	0.129	10	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NCO)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NCO){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.5228	0.226	4	120.5886	0.129	10	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NCO)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Zn<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NCO){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.2510	0.000	1	120.5886	0.129	10	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NC[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(NC[6]H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.2711	0.404	46	120.2737	0.153	50	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NC[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NC[6]H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.2325	0.295	2	120.2737	0.153	50	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NC[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NC[6]H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.3755	0.264	2	120.2737	0.153	50	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NC[6a]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(NC[6a]H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.0623	0.104	4	120.0970	0.032	8	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NC[6a]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(NC[6a]H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.1510	0.313	2	120.0970	0.032	8	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NC[6a]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NC[6a]H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.1125	0.286	2	120.0970	0.032	8	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NC[6a]O)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NC[6a]O){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.7345	0.469	19	120.7345	0.220	19	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NCoC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(NCoC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.4433	0.242	4	119.4433	0.059	4	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NFeC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(NFeC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.4562	0.308	4	119.4562	0.095	4	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Au<3>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NHH){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.8095	0.443	2	120.0520	0.349	387	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(NHH){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.9082	0.524	82	120.0520	0.349	387	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|D<1>,1|H<1>}	C[6](C[6]C[6]H)2(NHH){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.8410	0.285	4	120.0520	0.349	387	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|W<5>}	C[6](C[6]C[6]H)2(NHH){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.8208	0.362	6	120.0520	0.349	387	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(NHH){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.0831	0.607	233	120.0520	0.349	387	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Cd<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NHH){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.3115	0.127	2	120.0520	0.349	387	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Co<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NHH){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.1210	0.020	2	120.0520	0.349	387	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NHH){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.1103	0.132	4	120.0520	0.349	387	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NHH){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.8356	0.257	5	120.0520	0.349	387	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NHH){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.9825	0.102	4	120.0520	0.349	387	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NHH){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4397	0.296	3	120.0520	0.349	387	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NHH){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2073	0.174	4	120.0520	0.349	387	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NHH){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.6655	2.071	2	120.0520	0.349	387	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NHH){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.6490	0.000	1	120.0520	0.349	387	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NHH){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.9060	0.079	2	120.0520	0.349	387	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NHH){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.9986	0.442	10	120.0520	0.349	387	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Ru<9>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NHH){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4610	0.000	1	120.0520	0.349	387	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Sn<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NHH){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.2535	0.153	4	120.0520	0.349	387	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NHH){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.5889	1.294	8	120.0520	0.349	387	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Zn<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NHH){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.2245	0.118	4	120.0520	0.349	387	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Zn<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NHH){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.9910	0.134	4	120.0520	0.349	387	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NHN)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(NHN){1|N<3>,2|H<1>}	H(C[6]C[6]2)	121.1090	0.175	2	120.5403	0.195	8	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NHN)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(NHN){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.3507	0.308	6	120.5403	0.195	8	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NHP)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Sn<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NHP){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.2055	0.114	2	120.2055	0.013	2	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NHS)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(NHS){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.4063	0.168	14	120.4063	0.028	14	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NOO)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(NOO){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8630	0.076	2	121.0973	0.504	35	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NOO)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(NOO){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.3150	0.000	1	121.0973	0.504	35	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NOO)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(NOO){1|Cl<1>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6370	0.000	1	121.0973	0.504	35	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NOO)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(NOO){1|H<1>,1|I<1>,1|N<3>}	H(C[6]C[6]2)	120.5220	0.000	2	121.0973	0.504	35	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NOO)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(NOO){1|H<1>,2|N<3>}	H(C[6]C[6]2)	121.3090	0.000	1	121.0973	0.504	35	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NOO)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(NOO){1|N<3>,2|H<1>}	H(C[6]C[6]2)	121.1534	0.960	16	121.0973	0.504	35	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NOO)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(NOO){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.9450	0.000	1	121.0973	0.504	35	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NOO)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(NOO){1|N<3>,2|H<1>}	H(C[6]C[6]2)	121.0272	0.513	6	121.0973	0.504	35	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NOO)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NOO){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.6975	0.059	2	121.0973	0.504	35	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NOO)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NOO){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.3570	0.000	1	121.0973	0.504	35	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NOO)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NOO){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.0295	0.125	2	121.0973	0.504	35	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NPdC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(NPdC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.9625	0.012	2	119.9625	0.000	2	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NRuC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(NRuC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.0750	0.308	2	120.0240	0.077	4	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(NRuC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(NRuC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.9730	0.355	2	120.0240	0.077	4	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]I)(H)	C[6](C[6]C[6]H)2(NOO)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]I)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(NOO){1|H<1>,1|I<1>,1|N<3>}	H(C[6]C[6]2)	120.5190	0.000	2	120.5190	0.000	2	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]N)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]N)(H){1|C<2>,1|C<3>,1|H<1>}	C[6](C[6]C[6]C)(C[6]C[6]H)(NHH){1|S<1>,2|N<3>}	H(C[6]C[6]2)	119.9455	0.308	2	119.9455	0.095	2	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]N)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(NOO)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]N)(H){1|C<3>,1|C<4>,1|O<1>}	C[6](C[6]C[6]C)(C[6]C[6]H)(NOO){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.0260	0.000	1	120.0260	0.000	1	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]N)2(H){1|C<3>,1|O<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(NCH){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.5291	0.600	8	120.3098	0.254	41	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]N)2(H){1|C<3>,2|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(NCH){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.8420	0.074	2	120.3098	0.254	41	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]N)2(H){1|C<3>,2|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(NCH){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.3140	0.123	2	120.3098	0.254	41	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]N)2(H){1|C<3>,2|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(NCH){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5256	0.220	23	120.3098	0.254	41	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]N)2(H){1|C<3>,2|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(NCH){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.3445	0.089	6	120.3098	0.254	41	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(NC[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)2(H){1|C<3>,2|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(NC[6]H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7535	0.012	2	120.7535	0.000	2	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(NC[6a]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)2(H){1|C<3>,1|N<3>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(NC[6a]H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	119.0000	0.000	1	119.0000	0.000	1	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(NCuC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)2(H){1|C<3>,1|O<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(NCuC){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	118.5490	0.000	1	118.5490	0.000	1	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]N)2(H){1|C<3>,1|O<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(NHH){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1920	0.013	2	120.1920	0.000	2	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(NHN)	H(C[6]C[6]2)	C[6](C[6]C[6]N)2(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(NHN){1|C<3>,1|N<3>,1|S<4>}	H(C[6]C[6]2)	120.8430	0.000	1	120.8430	0.000	1	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(NNiC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)2(H){1|C<3>,1|O<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(NNiC){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.1960	0.000	1	120.0880	0.011	3	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(NNiC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)2(H){1|C<3>,1|O<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(NNiC){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0340	0.064	2	120.0880	0.011	3	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(NOO)	H(C[6]C[6]2)	C[6](C[6]C[6]N)2(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(NOO){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8329	1.084	17	120.3078	0.983	728	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(NOO)	H(C[6]C[6]2)	C[6](C[6]C[6]N)2(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(NOO){1|C<3>,2|N<3>}	H(C[6]C[6]2)	120.3479	0.900	668	120.3078	0.983	728	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(NOO)	H(C[6]C[6]2)	C[6](C[6]C[6]N)2(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(NOO){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.1315	2.170	29	120.3078	0.983	728	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(NOO)	H(C[6]C[6]2)	C[6](C[6]C[6]N)2(H){1|C<3>,1|O<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(NOO){1|C<3>,2|N<3>}	H(C[6]C[6]2)	119.4855	0.162	13	120.3078	0.983	728	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(NOO)	H(C[6]C[6]2)	C[6](C[6]C[6]N)2(H){1|C<3>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(NOO){1|C<2>,2|N<3>}	H(C[6]C[6]2)	117.3930	0.000	1	120.3078	0.983	728	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(NPdC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)2(H){1|C<3>,1|O<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(NPdC){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.3930	0.412	3	119.3930	0.170	3	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(NPtC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)2(H){1|C<3>,1|O<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(NPtC){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9490	0.569	2	119.9490	0.323	2	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(NOO)	H(C[6]C[6]2)	C[6](C[6]C[6]N)2(H){3|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(NOO){1|C<3>,1|N<3>,1|O<1>}	H(C[6]C[6]2)	120.1350	0.000	2	120.1350	0.000	2	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)2(H)	C[6](C[6]C[6]H)2(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]N)2(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NCH){1|C<2>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5230	0.000	1	120.5230	0.000	1	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)2(H)	C[6](C[6]C[6]H)2(NOO)	H(C[6]C[6]2)	C[6](C[6]C[6]N)2(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(NOO){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7718	1.163	17	120.5774	0.938	716	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)2(H)	C[6](C[6]C[6]H)2(NOO)	H(C[6]C[6]2)	C[6](C[6]C[6]N)2(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(NOO){1|C<3>,1|N<3>,1|S<4>}	H(C[6]C[6]2)	120.8020	0.000	1	120.5774	0.938	716	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)2(H)	C[6](C[6]C[6]H)2(NOO)	H(C[6]C[6]2)	C[6](C[6]C[6]N)2(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(NOO){1|C<3>,2|N<3>}	H(C[6]C[6]2)	120.5589	0.883	669	120.5774	0.938	716	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)2(H)	C[6](C[6]C[6]H)2(NOO)	H(C[6]C[6]2)	C[6](C[6]C[6]N)2(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(NOO){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.8824	2.110	29	120.5774	0.938	716	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]N)(H){1|Co<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(NCC){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.4555	0.605	4	120.3476	0.392	10	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]N)(H){1|Pt<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(NCC){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.6575	0.366	4	120.3476	0.392	10	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]N)(H){1|Pt<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(NCC){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.5120	0.450	2	120.3476	0.392	10	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]N)(H){1|Zn<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(NCH){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.9370	0.443	2	120.9370	0.196	2	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(NCO)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]N)(H){1|Zn<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(NCO){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.9090	0.000	1	120.9090	0.000	1	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(NC[6a]2)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]N)(H){1|Os<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(NC[6a]2){1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.8418	0.671	4	120.0172	0.349	6	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(NC[6a]2)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]N)(H){1|Re<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(NC[6a]2){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.2630	0.000	1	120.0172	0.349	6	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(NC[6a]2)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]N)(H){1|Ru<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(NC[6a]2){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.4730	0.000	1	120.0172	0.349	6	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]N)(H){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(NHH){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9160	0.020	2	120.0217	0.034	3	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]N)(H){1|Pt<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(NHH){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2330	0.000	1	120.0217	0.034	3	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(NOO)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]N)(H){1|Cu<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(NOO){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.3455	0.090	2	121.4145	0.016	4	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(NOO)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]N)(H){1|Ru<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(NOO){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.4835	0.146	2	121.4145	0.016	4	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N)(H){1|C<4>,2|H<1>,3|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(NHH){1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.0560	0.178	2	119.0560	0.032	2	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N)(H){1|Ni<5>,1|H<1>,1|O<2>,3|C<3>}	C[6](C[6]C[6]H)2(NCC){1|C<4>,2|C<3>}	H(C[6]C[6]2)	119.0825	0.141	4	119.0825	0.020	4	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]N)(H){1|Cu<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(NCC){1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.4290	0.006	2	119.3594	0.065	16	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]N)(H){1|Cu<5>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(NCC){1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.0943	0.197	3	119.3594	0.065	16	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]N)(H){1|Ir<6>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(NCC){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.4069	0.263	10	119.3594	0.065	16	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]N)(H){1|Pt<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(NCC){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.5410	0.000	1	119.3594	0.065	16	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(NC[6a]2)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]N)(H){1|Re<6>,1|H<1>,1|N<2>,2|C<3>}	C[6](C[6]C[6]H)2(NC[6a]2){1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.7540	0.000	1	119.7540	0.000	1	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]N)(H){1|Fe<6>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(NHH){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.9900	0.000	1	120.3855	0.731	2	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]N)(H){1|Ru<9>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(NHH){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7810	0.000	1	120.3855	0.731	2	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]N[4,6]C)(C[6]C[6]N)(H)	C[6](C[6]C[4,6]H)(C[6]C[6]H)(NCC)	H(C[6]C[6]2)	C[6](C[6]N[4,6]C)(C[6]C[6]N)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[4,6]H)(C[6]C[6]H)(NCC){1|N<3>,2|C<4>}	H(C[6]C[6]2)	120.3540	0.000	1	120.3540	0.000	1	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]N[4,6]H)(C[6]C[6]N)(H)	C[6](C[6]C[4,6]H)(C[6]C[6]H)(NCC)	H(C[6]C[6]2)	C[6](C[6]N[4,6]H)(C[6]C[6]N)(H){1|Si<4>,1|C<3>,1|H<1>}	C[6](C[6]C[4,6]H)(C[6]C[6]H)(NCC){1|Si<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9870	0.000	1	119.9870	0.000	1	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(NHH)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]N)(H){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(NHH){1|C<3>,2|N<3>}	H(C[6]C[6]2)	121.1670	0.396	2	121.1670	0.157	2	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(NOO)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<1>,2|C<4>}	C[6](C[6]C[6]H)2(NOO){1|H<1>,2|N<3>}	H(C[6]C[6]2)	119.8430	0.000	1	119.8430	0.000	1	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]N[6]Cl)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(NOO)	H(C[6]C[6]2)	C[6](C[6]N[6]Cl)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(NOO){1|Cl<1>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6390	0.000	1	120.9083	0.060	3	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]N[6]Cl)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(NOO)	H(C[6]C[6]2)	C[6](C[6]N[6]Cl)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(NOO){2|Cl<1>,1|N<3>}	H(C[6]C[6]2)	121.0430	0.106	2	120.9083	0.060	3	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]N[6]Th)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(NCC)	H(C[6]C[6]2)	C[6](C[6]N[6]Th)(C[6]C[6]N)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NCC){1|Th<13>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	118.8830	0.000	1	118.8830	0.000	1	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]N[6]Zr)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(NCC)	H(C[6]C[6]2)	C[6](C[6]N[6]Zr)(C[6]C[6]N)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NCC){1|Zr<12>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0935	0.286	2	120.2820	0.148	3	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]N[6]Zr)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(NCC)	H(C[6]C[6]2)	C[6](C[6]N[6]Zr)(C[6]C[6]N)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NCC){1|Zr<13>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6590	0.000	1	120.2820	0.148	3	120.1903	1.019	3721	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N[5]-3:	C[6]-3:	C[6](C[6]C[6]N[5])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(N[5]C[5]2)	H(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]C[6]C)(H){1|H<1>,1|O<1>,3|C<3>}	C[6](C[6]C[6]H)(C[6]C[6]O)(N[5]C[5]2){1|C<3>,1|C<4>,1|N<2>,1|N<3>,3|H<1>}	H(C[6]C[6]2)	119.5760	0.000	1	119.5680	0.000	2	120.0442	2.443	38	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N[5]-3:	C[6]-3:	C[6](C[6]C[6]N[5])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(N[5]C[5]2)	H(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]C[6]C)(H){1|H<1>,1|O<1>,3|C<3>}	C[6](C[6]C[6]H)(C[6]C[6]O)(N[5]C[5]2){1|Fe<8>,1|H<1>,1|N<3>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	119.5600	0.000	1	119.5680	0.000	2	120.0442	2.443	38	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N[5]-3:	C[6]-3:	C[6](C[6]C[6]N[5])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(N[5]C[5]2)	H(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]C[6]C)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(N[5]C[5]2){1|Rh<6>,1|C<4>,1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.0340	0.000	1	120.0340	0.000	1	120.0442	2.443	38	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N[5]-3:	C[6]-3:	C[6](C[6]C[6]N[5])(C[6]C[6]C)(H)	C[6](C[6]N[6]Rh)(C[6]C[6]H)(N[5]C[5]2)	H(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]C[6]C)(H){1|Rh<7>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]N[6]Rh)(C[6]C[6]H)(N[5]C[5]2){1|C<4>,1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.7310	0.000	1	120.7310	0.000	1	120.0442	2.443	38	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N[5]-3:	C[6]-3:	C[6](C[6]C[6]N[5])(C[6]C[6]H)(H)	C[6](C[6]C[6]Br)(C[6]C[6]H)(N[5]C[5]2)	H(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]C[6]H)(H){1|Br<1>,1|H<1>,2|C<3>,2|C<4>}	C[6](C[6]C[6]Br)(C[6]C[6]H)(N[5]C[5]2){1|C<3>,1|O<1>,1|O<2>,2|C<4>,4|H<1>}	H(C[6]C[6]2)	118.8220	0.000	1	118.8220	0.000	1	120.0442	2.443	38	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N[5]-3:	C[6]-3:	C[6](C[6]C[6]N[5])(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(N[5]C[5]2)	H(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]C[6]H)(H){2|C<3>,2|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(N[5]C[5]2){1|Rh<6>,1|C<2>,1|N<3>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	119.9710	0.000	1	119.9710	0.000	1	120.0442	2.443	38	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N[5]-3:	C[6]-3:	C[6](C[6]C[6]N[5])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(N[5]C[5]2)	H(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(N[5]C[5]2){1|Pd<4>,1|H<1>,2|O<1>,3|C<3>}	H(C[6]C[6]2)	121.0753	0.395	3	120.8897	0.242	4	120.0442	2.443	38	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N[5]-3:	C[6]-3:	C[6](C[6]C[6]N[5])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(N[5]C[5]2)	H(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(N[5]C[5]2){1|Re<6>,1|H<1>,2|O<1>,3|C<3>}	H(C[6]C[6]2)	120.3330	0.000	1	120.8897	0.242	4	120.0442	2.443	38	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N[5]-3:	C[6]-3:	C[6](C[6]C[6]N[5])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(N[5]C[5]2)	H(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]C[6]H)(H){1|C<2>,1|H<1>,1|I<1>,2|C<3>}	C[6](C[6]C[6]H)2(N[5]C[5]2){1|C<4>,1|H<1>,1|O<1>,1|O<2>,2|C<3>}	H(C[6]C[6]2)	111.9620	0.000	1	117.0903	20.266	3	120.0442	2.443	38	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N[5]-3:	C[6]-3:	C[6](C[6]C[6]N[5])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(N[5]C[5]2)	H(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]C[6]H)(H){1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(N[5]C[5]2){1|Pt<4>,1|C<2>,1|C<3>,1|N<2>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.6545	1.040	2	117.0903	20.266	3	120.0442	2.443	38	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N[5]-3:	C[6]-3:	C[6](C[6]C[6]N[5])(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(N[5]C[5]2)	H(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]C[6]O)(H){1|C<3>,1|N<3>,1|O<1>,2|C<4>}	C[6](C[6]C[6]H)(C[6]C[6]O)(N[5]C[5]2){1|O<1>,2|C<3>,2|C<4>,4|H<1>}	H(C[6]C[6]2)	118.4590	0.000	1	118.4590	0.000	1	120.0442	2.443	38	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N[5]-3:	C[6]-3:	C[6](C[6]C[6]N[5])(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(N[5]C[5]2)	H(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]N[6]C)(H){1|Co<4>,1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(N[5]C[5]2){1|N<3>,2|C<3>,2|C<4>,4|H<1>}	H(C[6]C[6]2)	120.3558	0.232	4	120.2080	0.053	8	120.0442	2.443	38	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N[5]-3:	C[6]-3:	C[6](C[6]C[6]N[5])(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(N[5]C[5]2)	H(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]N[6]C)(H){1|Co<5>,1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(N[5]C[5]2){1|N<3>,4|C<4>,4|H<1>}	H(C[6]C[6]2)	119.9720	0.037	2	120.2080	0.053	8	120.0442	2.443	38	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N[5]-3:	C[6]-3:	C[6](C[6]C[6]N[5])(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(N[5]C[5]2)	H(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]N[6]C)(H){1|Ir<6>,1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(N[5]C[5]2){1|N<3>,4|C<4>,4|H<1>}	H(C[6]C[6]2)	120.1485	0.016	2	120.2080	0.053	8	120.0442	2.443	38	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N[5]-3:	C[6]-3:	C[6](C[6]C[6]N[5])(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(N[5]C[5]2)	H(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]N[6]H)(H){2|C<3>,3|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(N[5]C[5]2){1|N<3>,2|C<4>,6|H<1>}	H(C[6]C[6]2)	119.1920	0.000	1	119.1920	0.000	1	120.0442	2.443	38	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N[5]-3:	C[6]-3:	C[6](C[6]C[6]N[5])(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(N[5]C[5]2)	H(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]N[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(N[5]C[5]2){1|N<3>,2|C<4>,6|H<1>}	H(C[6]C[6]2)	119.7385	0.375	2	120.1314	0.290	10	120.0442	2.443	38	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N[5]-3:	C[6]-3:	C[6](C[6]C[6]N[5])(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(N[5]C[5]2)	H(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]N[6]H)(H){1|Cu<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(N[5]C[5]2){1|N<3>,2|C<4>,2|H<1>,2|O<1>}	H(C[6]C[6]2)	120.7090	0.065	2	120.1314	0.290	10	120.0442	2.443	38	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N[5]-3:	C[6]-3:	C[6](C[6]C[6]N[5])(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(N[5]C[5]2)	H(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]N[6]H)(H){1|H<1>,2|C<3>,2|C<4>}	C[6](C[6]C[6]H)2(N[5]C[5]2){1|N<3>,2|C<4>,6|H<1>}	H(C[6]C[6]2)	119.7400	0.143	2	120.1314	0.290	10	120.0442	2.443	38	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N[5]-3:	C[6]-3:	C[6](C[6]C[6]N[5])(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(N[5]C[5]2)	H(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]N[6]H)(H){1|Zn<3>,1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(N[5]C[5]2){1|N<3>,2|C<4>,6|H<1>}	H(C[6]C[6]2)	119.7700	0.068	2	120.1314	0.290	10	120.0442	2.443	38	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N[5]-3:	C[6]-3:	C[6](C[6]C[6]N[5])(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(N[5]C[5]2)	H(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]N[6]H)(H){1|Zn<5>,1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(N[5]C[5]2){1|N<3>,2|C<4>,6|H<1>}	H(C[6]C[6]2)	120.6995	0.500	2	120.1314	0.290	10	120.0442	2.443	38	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N[5]-3:	C[6]-3:	C[6](C[6]C[6]N[5])(C[6]N[6]H)(H)	C[6](C[6]C[6]Ir)(C[6]C[6]H)(N[5]C[5]2)	H(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]N[6]H)(H){2|Ir<8>,3|C<3>}	C[6](C[6]C[6]Ir)(C[6]C[6]H)(N[5]C[5]2){1|C<3>,2|N<3>,3|H<1>}	H(C[6]C[6]2)	121.1870	0.000	1	121.1870	0.000	1	120.0442	2.443	38	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N[5]-3:	C[6]-3:	C[6](C[6]C[6]N[5])(C[6]N[6]H)(H)	C[6](C[6]C[6]Rh)(C[6]C[6]H)(N[5]C[5]2)	H(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]N[6]H)(H){1|Rh<6>,1|C<4>,3|C<3>}	C[6](C[6]C[6]Rh)(C[6]C[6]H)(N[5]C[5]2){1|C<3>,2|N<3>,3|H<1>}	H(C[6]C[6]2)	121.7630	0.000	1	121.6760	0.015	2	120.0442	2.443	38	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N[5]-3:	C[6]-3:	C[6](C[6]C[6]N[5])(C[6]N[6]H)(H)	C[6](C[6]C[6]Rh)(C[6]C[6]H)(N[5]C[5]2)	H(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]N[6]H)(H){2|Rh<8>,3|C<3>}	C[6](C[6]C[6]Rh)(C[6]C[6]H)(N[5]C[5]2){1|C<3>,2|N<3>,3|H<1>}	H(C[6]C[6]2)	121.5890	0.000	1	121.6760	0.015	2	120.0442	2.443	38	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N[5]-3:	C[6]-3:	C[6](C[6]C[6]N[5])(C[6]N[6]H)(H)	C[6](C[6]C[6]Ru)(C[6]C[6]H)(N[5]C[5]2)	H(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]N[6]H)(H){2|Ru<9>,3|C<3>}	C[6](C[6]C[6]Ru)(C[6]C[6]H)(N[5]C[5]2){1|C<3>,2|N<3>,3|H<1>}	H(C[6]C[6]2)	121.4940	0.560	2	121.4940	0.314	2	120.0442	2.443	38	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]Br)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(N[6]C[6]U)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]Br)(H){1|H<1>,1|N<3>,1|U<9>,2|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(N[6]C[6]U){1|Br<1>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.5530	0.041	2	120.5530	0.002	2	120.0626	0.729	204	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(N[6]C[6]C)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(N[6]C[6]C){1|C<4>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.3440	0.000	1	119.5277	0.064	6	120.0626	0.729	204	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(N[6]C[6]C)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(N[6]C[6]C){2|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.5644	0.265	5	119.5277	0.064	6	120.0626	0.729	204	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(N[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(N[6]C[6]H){1|C<4>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.2090	0.157	2	119.8335	0.585	4	120.0626	0.729	204	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(N[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(N[6]C[6]H){2|H<1>,5|C<3>}	H(C[6]C[6]2)	120.7510	0.000	1	119.8335	0.585	4	120.0626	0.729	204	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(N[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(N[6]C[6]H){3|H<1>,4|C<3>}	H(C[6]C[6]2)	120.1650	0.000	1	119.8335	0.585	4	120.0626	0.729	204	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(N[6]C[6]O)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|H<1>,1|N<3>,1|O<1>,2|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(N[6]C[6]O){1|C<4>,1|O<1>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	117.3740	0.000	1	118.9245	4.808	2	120.0626	0.729	204	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(N[6]C[6]O)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|H<1>,1|N<3>,1|O<1>,2|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(N[6]C[6]O){1|H<1>,1|O<1>,2|C<4>,3|C<3>}	H(C[6]C[6]2)	120.4750	0.000	1	118.9245	4.808	2	120.0626	0.729	204	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(N[6]C[6]W)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|H<1>,1|N<3>,1|W<6>,2|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(N[6]C[6]W){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.5118	0.119	4	119.5118	0.014	4	120.0626	0.729	204	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]2)(C[6]C[6]H)(N[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){2|H<1>,3|C<3>}	C[6](C[6]C[6]2)(C[6]C[6]H)(N[6]C[6]H){3|C<3>,4|H<1>}	H(C[6]C[6]2)	120.3885	0.135	2	120.3885	0.018	2	120.0626	0.729	204	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]2)(C[6]C[6]H)(N[6]C[6]V)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|V<7>,2|C<3>}	C[6](C[6]C[6]2)(C[6]C[6]H)(N[6]C[6]V){1|O<2>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.0970	0.211	2	119.9663	0.054	4	120.0626	0.729	204	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]2)(C[6]C[6]H)(N[6]C[6]V)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|V<8>,2|C<3>}	C[6](C[6]C[6]2)(C[6]C[6]H)(N[6]C[6]V){1|O<2>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.8355	0.218	2	119.9663	0.054	4	120.0626	0.729	204	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]2)(N[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|C<3>,1|N<2>,1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]2)(N[6]C[6]H){1|C<3>,2|N<3>,3|H<1>}	H(C[6]C[6]2)	120.4830	0.000	1	120.5805	0.019	4	120.0626	0.729	204	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]2)(N[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|C<3>,2|H<1>,2|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]2)(N[6]C[6]H){1|S<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5475	0.135	2	120.5805	0.019	4	120.0626	0.729	204	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]2)(N[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|C<3>,2|H<1>,2|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]2)(N[6]C[6]H){2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.7440	0.000	1	120.5805	0.019	4	120.0626	0.729	204	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(N[6]C[6]2)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(N[6]C[6]2){1|B<4>,1|H<1>,2|O<1>,3|C<3>}	H(C[6]C[6]2)	120.8937	0.121	7	120.8849	0.013	8	120.0626	0.729	204	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(N[6]C[6]2)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(N[6]C[6]2){1|C<4>,1|H<1>,2|O<1>,3|C<3>}	H(C[6]C[6]2)	120.8230	0.000	1	120.8849	0.013	8	120.0626	0.729	204	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(N[6]C[6]2)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cl<1>,1|C<2>,1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(N[6]C[6]2){1|H<1>,2|O<1>,3|C<3>}	H(C[6]C[6]2)	120.2110	0.000	1	120.2110	0.000	1	120.0626	0.729	204	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(N[6]C[6]C)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(N[6]C[6]C){1|C<4>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.8215	0.071	2	120.7402	1.109	6	120.0626	0.729	204	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(N[6]C[6]C)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(N[6]C[6]C){1|Re<6>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	121.6297	0.628	3	120.7402	1.109	6	120.0626	0.729	204	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(N[6]C[6]C)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(N[6]C[6]C){2|C<3>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	119.9090	0.000	1	120.7402	1.109	6	120.0626	0.729	204	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(N[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(N[6]C[6]H){3|C<3>,4|H<1>}	H(C[6]C[6]2)	119.4445	0.161	2	120.2840	0.228	35	120.0626	0.729	204	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(N[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(N[6]C[6]H){1|O<1>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.9990	0.000	1	120.2840	0.228	35	120.0626	0.729	204	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(N[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(N[6]C[6]H){3|C<3>,4|H<1>}	H(C[6]C[6]2)	120.3245	0.436	30	120.2840	0.228	35	120.0626	0.729	204	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(N[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(N[6]C[6]H){3|H<1>,4|C<3>}	H(C[6]C[6]2)	120.6595	0.616	2	120.2840	0.228	35	120.0626	0.729	204	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(N[6]C[6]O)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>,2|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(N[6]C[6]O){1|O<1>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.1350	0.000	1	119.5246	0.238	26	120.0626	0.729	204	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(N[6]C[6]O)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>,2|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(N[6]C[6]O){1|O<1>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.0187	0.372	4	119.5246	0.238	26	120.0626	0.729	204	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(N[6]C[6]O)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>,2|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(N[6]C[6]O){3|C<3>,4|H<1>}	H(C[6]C[6]2)	119.0310	0.000	1	119.5246	0.238	26	120.0626	0.729	204	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(N[6]C[6]O)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<2>,2|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(N[6]C[6]O){1|Fe<6>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	118.9617	0.150	4	119.5246	0.238	26	120.0626	0.729	204	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(N[6]C[6]O)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<2>,2|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(N[6]C[6]O){1|Ni<6>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.1808	0.298	4	119.5246	0.238	26	120.0626	0.729	204	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(N[6]C[6]O)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<2>,2|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(N[6]C[6]O){1|O<2>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.7357	0.377	12	119.5246	0.238	26	120.0626	0.729	204	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(N[6]C[6]V)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|V<5>,2|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(N[6]C[6]V){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.4920	1.905	2	120.0273	1.751	33	120.0626	0.729	204	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(N[6]C[6]V)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|V<5>,2|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(N[6]C[6]V){3|C<3>,3|H<1>}	H(C[6]C[6]2)	117.4815	2.254	2	120.0273	1.751	33	120.0626	0.729	204	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(N[6]C[6]V)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|V<6>,2|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(N[6]C[6]V){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.0000	1.317	19	120.0273	1.751	33	120.0626	0.729	204	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(N[6]C[6]V)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|V<7>,2|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(N[6]C[6]V){1|B<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.6030	0.000	1	120.0273	1.751	33	120.0626	0.729	204	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(N[6]C[6]V)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|V<7>,2|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(N[6]C[6]V){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.4120	0.000	1	120.0273	1.751	33	120.0626	0.729	204	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(N[6]C[6]V)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|V<7>,2|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(N[6]C[6]V){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.6265	0.183	2	120.0273	1.751	33	120.0626	0.729	204	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(N[6]C[6]V)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|V<7>,2|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(N[6]C[6]V){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.3090	0.369	2	120.0273	1.751	33	120.0626	0.729	204	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(N[6]C[6]V)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|V<8>,2|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(N[6]C[6]V){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.5173	0.280	4	120.0273	1.751	33	120.0626	0.729	204	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(N[6]C[6]W)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|W<6>,2|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(N[6]C[6]W){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.2960	0.000	1	120.1375	0.035	10	120.0626	0.729	204	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(N[6]C[6]W)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|W<6>,2|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(N[6]C[6]W){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.1240	0.177	7	120.1375	0.035	10	120.0626	0.729	204	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(N[6]C[6]W)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|W<8>,2|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(N[6]C[6]W){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.1055	0.317	2	120.1375	0.035	10	120.0626	0.729	204	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]P[6])(C[6]C[6]H)(N[6]C[6]W)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|H<1>,1|P<3>,1|W<6>,2|C<3>}	C[6](C[6]C[6]P[6])(C[6]C[6]H)(N[6]C[6]W){3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.8858	0.291	4	119.8858	0.085	4	120.0626	0.729	204	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]N[5]N[6])(H)	C[6](C[6]C[6]H)2(N[6]C[6]2)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]N[5]N[6])(H){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>,2|C<4>}	C[6](C[6]C[6]H)2(N[6]C[6]2){2|C<4>,3|N<3>,4|H<1>}	H(C[6]C[6]2)	120.9195	0.229	4	120.9195	0.053	4	120.0626	0.729	204	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(N[6]C[6]2)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H){1|C<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(N[6]C[6]2){1|N<3>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	120.8290	0.000	1	120.8290	0.000	1	120.0626	0.729	204	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(N[6]C[6]2)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H){1|C<3>,1|H<1>,3|C<4>}	C[6](C[6]C[6]H)2(N[6]C[6]2){1|N<3>,2|C<4>,6|H<1>}	H(C[6]C[6]2)	119.8010	0.099	4	120.3294	0.989	23	120.0626	0.729	204	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(N[6]C[6]2)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(N[6]C[6]2){1|N<3>,2|C<4>,6|H<1>}	H(C[6]C[6]2)	120.6679	0.970	7	120.3294	0.989	23	120.0626	0.729	204	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(N[6]C[6]2)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H){1|Cu<6>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(N[6]C[6]2){1|N<3>,2|C<3>,2|H<1>,2|O<1>}	H(C[6]C[6]2)	120.6215	0.145	2	120.3294	0.989	23	120.0626	0.729	204	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(N[6]C[6]2)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H){1|H<1>,2|C<3>,2|C<4>}	C[6](C[6]C[6]H)2(N[6]C[6]2){1|N<3>,2|C<4>,6|H<1>}	H(C[6]C[6]2)	119.5140	0.061	2	120.3294	0.989	23	120.0626	0.729	204	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(N[6]C[6]2)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(N[6]C[6]2){1|N<3>,2|C<4>,6|H<1>}	H(C[6]C[6]2)	119.8675	1.823	4	120.3294	0.989	23	120.0626	0.729	204	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(N[6]C[6]2)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H){1|Zn<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(N[6]C[6]2){1|N<3>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	120.9890	0.151	4	120.3294	0.989	23	120.0626	0.729	204	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(N[6]C[6]V)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H){1|N<3>,1|V<7>,2|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(N[6]C[6]V){1|N<2>,1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	121.9900	0.000	1	121.6890	0.181	2	120.0626	0.729	204	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(N[6]C[6]V)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H){1|N<3>,1|V<7>,2|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(N[6]C[6]V){1|N<2>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	121.3880	0.000	1	121.6890	0.181	2	120.0626	0.729	204	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6]C[6]H)2(N[6]C[6]2)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|H<1>,1|O<1>,5|C<3>}	C[6](C[6]C[6]H)2(N[6]C[6]2){7|C<3>}	H(C[6]C[6]2)	119.5906	0.161	17	119.5906	0.026	17	120.0626	0.729	204	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(N[6]C[6]W)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|H<1>,1|N<3>,1|W<6>,4|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(N[6]C[6]W){1|H<1>,5|C<3>}	H(C[6]C[6]2)	119.4457	0.381	6	119.4457	0.145	6	120.0626	0.729	204	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:O-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(OCoNi)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<2>,1|C<3>,1|H<1>}	C[6](C[6]C[6]C)(C[6]C[6]H)(OCoNi){1|C<3>,1|H<1>}	H(C[6]C[6]2)	115.6480	0.000	1	115.6480	0.000	1	115.6480	0.000	1	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:P-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]P)(H)	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(PHH)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]P)(H){1|O<1>,2|C<3>}	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(PHH){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.1590	0.000	1	119.1590	0.000	1	120.0409	4.502	8	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:P-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]P)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(PCC)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]P)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]C[6]N)(PCC){1|H<1>,2|C<3>}	H(C[6]C[6]2)	122.1225	2.060	2	122.1225	4.243	2	120.0409	4.502	8	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:P-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]P)(H)	C[6](C[6]C[6]H)2(PC[6a]2)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]P)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(PC[6a]2){1|C<3>,2|C<4>}	H(C[6]C[6]2)	118.8800	0.204	2	118.8800	0.041	2	120.0409	4.502	8	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:P-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](C[6]C[6]H)2(PC[6]C)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<2>,2|H<1>}	C[6](C[6]C[6]H)2(PC[6]C){1|C<3>,1|H<1>}	H(C[6]C[6]2)	122.8040	0.000	1	119.7210	7.390	3	120.0409	4.502	8	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:P-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](C[6]C[6]H)2(PC[6]C)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(PC[6]C){1|C<2>,2|H<1>}	H(C[6]C[6]2)	118.1795	0.723	2	119.7210	7.390	3	120.0409	4.502	8	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:P[6]-3:	C[6]-3:	C[6](C[6]C[6]P[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]P[6])(C[6]C[6]H)(P[6]C[6]W)	H(C[6]C[6]2)	C[6](C[6]C[6]P[6])(C[6]C[6]C)(H){1|C<4>,1|P<3>,1|W<6>,2|C<3>}	C[6](C[6]C[6]P[6])(C[6]C[6]H)(P[6]C[6]W){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	116.9455	0.006	2	116.9455	0.000	2	117.3875	0.142	6	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:P[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]P[6])(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(P[6]C[6]W)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]P[6])(H){1|H<1>,1|N<3>,1|W<6>,4|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(P[6]C[6]W){1|H<1>,5|C<3>}	H(C[6]C[6]2)	117.6085	0.203	4	117.6085	0.041	4	117.3875	0.142	6	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]S)(H)	C[6](C[6]C[6]H)2(SMo2)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]S)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(SMo2){1|C<3>,2|C<4>}	H(C[6]C[6]2)	118.9325	0.097	2	118.9325	0.009	2	120.2029	1.448	20	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]S)(H)	C[6](C[6]C[6]H)2(SNO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]S)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(SNO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.9945	3.727	2	120.9945	13.892	2	120.2029	1.448	20	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]S)(H)	C[6](C[6]C[6]H)2(SPtC)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]S)(H){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(SPtC){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.6205	0.466	2	120.6205	0.217	2	120.2029	1.448	20	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-3:	C[6]-3:	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(SRu2)	H(C[6]C[6]2)	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(SRu2){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3665	0.375	2	120.3665	0.141	2	120.2029	1.448	20	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-3:	C[6]-3:	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(SCu2)	H(C[6]C[6]2)	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(SCu2){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.7606	0.201	8	119.7606	0.041	8	120.2029	1.448	20	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-3:	C[6]-3:	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(SIrC)	H(C[6]C[6]2)	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(SIrC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	121.0362	1.116	4	121.0362	1.246	4	120.2029	1.448	20	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[5,6]H)(H)	C[6](C[6]N[5,6]H)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[5,6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]N[5,6]H)(C[6a]C[6a]2)(C[6]C[6]H){1|B<4>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.5870	0.000	1	119.5870	0.000	1	118.6664	1.731	14	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[5a,6]O)(H)	C[6](C[6]C[5a,6]O)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[5a,6]O)(H){1|N<3>,1|O<1>,3|C<3>}	C[6](C[6]C[5a,6]O)(C[6a]C[6a]2)(C[6]C[6]H){1|H<1>,1|N<2>,1|O<1>,1|O<2>,3|C<3>}	H(C[6]C[6]2)	117.5970	0.000	1	117.5970	0.000	1	118.6664	1.731	14	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6,6]H)(H)	C[6](C[6]N[6,6]H)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6,6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]N[6,6]H)(C[6a]C[6a]2)(C[6]C[6]H){1|B<4>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.8780	0.000	1	119.8780	0.000	1	118.6664	1.731	14	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6,6a]H)(H)	C[6](C[6]N[6,6a]C[6a])(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6,6a]H)(H){1|N<3>,4|C<3>}	C[6](C[6]N[6,6a]C[6a])(C[6a]C[6a]2)(C[6]C[6]H){3|H<1>,6|C<3>}	H(C[6]C[6]2)	119.7127	0.305	3	119.7127	0.093	3	118.6664	1.731	14	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6,6a]O)(H)	C[6](C[6]C[6,6a]O)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6,6a]O)(H){1|O<1>,4|C<3>}	C[6](C[6]C[6,6a]O)(C[6a]C[6a]2)(C[6]C[6]H){1|C<4>,1|O<1>,1|O<2>,4|C<3>}	H(C[6]C[6]2)	118.4640	0.000	1	118.4640	0.000	1	118.6664	1.731	14	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[5x3,5x5,20x6]N[6])(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|C<6>,1|N<3>,3|C<3>}	C[6](C[6]C[5x3,5x5,20x6]N[6])(C[6a]C[6a]2)(C[6]C[6]H){1|Pt<4>,1|C<6>,3|C<3>,3|H<1>,4|B<6>}	H(C[6]C[6]2)	118.7400	0.000	1	118.7400	0.000	1	118.6664	1.731	14	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6]C[6a]N[6])(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Ru<6>,1|N<2>,1|N<3>,4|C<3>}	C[6](C[6]C[6a]N[6])(C[6a]C[6a]2)(C[6]C[6]H){1|N<3>,2|C<3>,2|H<1>,3|N<2>}	H(C[6]C[6]2)	120.0470	0.000	1	120.0470	0.000	1	118.6664	1.731	14	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6a]S[6])(H)	C[6](C[6]C[6a]O[6])(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6a]S[6])(H){1|O<2>,2|O<1>,5|C<3>}	C[6](C[6]C[6a]O[6])(C[6a]C[6a]2)(C[6]C[6]H){1|S<4>,2|H<1>,5|C<3>}	H(C[6]C[6]2)	116.7840	0.000	1	116.7840	0.000	1	118.6664	1.731	14	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[5a,6]H)(H)	C[6](C[6]C[5a,6]C[6a])(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[5a,6]H)(H){5|C<3>}	C[6](C[6]C[5a,6]C[6a])(C[6a]C[6a]2)(C[6]C[6]H){1|N<3>,3|H<1>,5|C<3>}	H(C[6]C[6]2)	118.5480	0.000	1	118.5480	0.000	1	118.6664	1.731	14	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6,6a]Os)(H)	C[6](C[6]C[6,6a]H)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6,6a]Os)(H){1|H<1>,4|C<3>}	C[6](C[6]C[6,6a]H)(C[6a]C[6a]2)(C[6]C[6]H){1|Os<7>,1|N<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.5310	0.000	1	119.5310	0.000	1	118.6664	1.731	14	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])2(H)	C[6](C[6]C[6a]P[6])(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])2(H){1|P<3>,6|C<3>}	C[6](C[6]C[6a]P[6])(C[6a]C[6a]2)(C[6]C[6]H){1|S<1>,2|H<1>,6|C<3>}	H(C[6]C[6]2)	116.5080	0.054	2	116.5080	0.003	2	118.6664	1.731	14	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[5]-3:N[6]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(N[5]C[5]2)(N[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[6]H)(N[5]C[5]2)(N[6]C[6]H){1|C<3>,1|N<3>,2|C<4>,5|H<1>}	H(C[6]C[6]2)	120.7530	0.069	2	121.0697	0.739	4	121.2268	0.700	9	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[5]-3:N[6]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(N[5]C[5]2)(N[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[6]H)(N[5]C[5]2)(N[6]C[6]H){1|C<4>,3|H<1>,5|C<3>}	H(C[6]C[6]2)	120.4350	0.000	1	121.0697	0.739	4	121.2268	0.700	9	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[5]-3:N[6]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(N[5]C[5]2)(N[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){2|H<1>,3|C<3>}	C[6](C[6]C[6]H)(N[5]C[5]2)(N[6]C[6]H){2|C<3>,2|N<3>,3|H<1>}	H(C[6]C[6]2)	122.3380	0.000	1	121.0697	0.739	4	121.2268	0.700	9	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[5]-3:N[6]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(N[5]C[5]2)(N[6]C[6]V)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|H<1>,1|V<6>,3|C<3>}	C[6](C[6]C[6]H)(N[5]C[5]2)(N[6]C[6]V){2|C<3>,2|H<1>,2|N<3>}	H(C[6]C[6]2)	121.7270	0.365	4	121.7270	0.133	4	121.2268	0.700	9	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[5]-3:N[6]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(N[5]C[5]2)(N[6]C[6]O)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<1>,2|C<4>}	C[6](C[6]C[6]H)(N[5]C[5]2)(N[6]C[6]O){1|N<3>,2|C<3>,2|C<4>,4|H<1>}	H(C[6]C[6]2)	119.8540	0.000	1	119.8540	0.000	1	121.2268	0.700	9	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]C)(H){1|C<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)(N[6]C[6]C)(CCH){3|C<3>}	H(C[6]C[6]2)	118.4301	0.090	8	118.4301	0.008	8	119.7039	1.184	185	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]C)(CCH){3|C<3>}	H(C[6]C[6]2)	118.7403	0.207	7	118.7403	0.043	7	119.7039	1.184	185	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CHP)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CHP){1|C<3>,2|C<4>}	H(C[6]C[6]2)	120.0873	0.158	3	120.0873	0.025	3	119.7039	1.184	185	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(COO){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	118.9410	0.000	1	119.8025	1.484	2	119.7039	1.184	185	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(COO){3|C<3>}	H(C[6]C[6]2)	120.6640	0.000	1	119.8025	1.484	2	119.7039	1.184	185	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(N[6]C[6]O)(COO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.6070	0.000	1	119.6070	0.000	1	119.7039	1.184	185	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]B)(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]B)(CCH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.2030	0.000	1	119.2030	0.000	1	119.7039	1.184	185	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]B)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|B<3>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]B)(CHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2510	0.000	1	120.2510	0.000	1	119.7039	1.184	185	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(CCC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]C)(CCC){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.0250	0.000	1	119.0250	0.000	1	119.7039	1.184	185	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]C)(CCH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.5075	0.498	22	119.5133	0.221	25	119.7039	1.184	185	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]C)(CCH){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.5557	0.219	3	119.5133	0.221	25	119.7039	1.184	185	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]C)(COO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.3745	0.176	2	119.3745	0.031	2	119.7039	1.184	185	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CCC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CCC){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7705	0.585	2	119.7705	0.342	2	119.7039	1.184	185	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CCH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8082	0.327	9	119.8082	0.107	9	119.7039	1.184	185	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CCN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.1989	1.173	14	119.3334	1.331	16	119.7039	1.184	185	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CCN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.2755	0.221	2	119.3334	1.331	16	119.7039	1.184	185	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CCO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CCO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	118.5185	1.537	4	118.5185	2.362	4	119.7039	1.184	185	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CC[5]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CC[5]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2240	0.000	1	120.2240	0.000	1	119.7039	1.184	185	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CC[5a]2)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CC[5a]2){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9610	0.000	1	119.9610	0.000	1	119.7039	1.184	185	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CC[6a]N)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CC[6a]N){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0507	0.124	3	120.0507	0.015	3	119.7039	1.184	185	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CC[6a]O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CC[6a]O){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3900	0.000	1	120.3900	0.000	1	119.7039	1.184	185	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CClO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CClO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6250	0.000	1	120.6250	0.000	1	119.7039	1.184	185	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9174	0.696	14	119.9174	0.484	14	119.7039	1.184	185	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CNN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CNN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3010	0.000	1	120.3010	0.000	1	119.7039	1.184	185	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CNO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4410	0.108	5	120.4410	0.012	5	119.7039	1.184	185	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CN[5]O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CN[5]O){1|C<3>,2|H<1>}	H(C[6]C[6]2)	121.3185	0.863	2	121.3185	0.745	2	119.7039	1.184	185	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|P<4>}	C[6](C[6]C[6]H)(N[6]C[6]H)(COO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4680	0.000	1	120.1676	1.270	36	119.7039	1.184	185	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(COO){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.4890	0.000	1	120.1676	1.270	36	119.7039	1.184	185	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(COO){1|C<3>,1|H<1>,1|P<4>}	H(C[6]C[6]2)	120.4220	0.000	1	120.1676	1.270	36	119.7039	1.184	185	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(COO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0864	1.265	23	120.1676	1.270	36	119.7039	1.184	185	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(COO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.2667	0.984	10	120.1676	1.270	36	119.7039	1.184	185	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(N[6]C[6]O)(CCH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	114.3755	0.302	2	114.3755	0.091	2	119.7039	1.184	185	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(CCO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(N[6]C[6]O)(CCO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.6515	0.380	2	119.6515	0.144	2	119.7039	1.184	185	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(CC[5]O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(N[6]C[6]O)(CC[5]O){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1330	0.000	1	120.1330	0.000	1	119.7039	1.184	185	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(N[6]C[6]O)(CHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.6415	0.064	2	119.6415	0.004	2	119.7039	1.184	185	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(N[6]C[6]O)(CNO){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.1875	0.274	2	120.1875	0.075	2	119.7039	1.184	185	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(N[6]C[6]O)(COO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	117.4570	0.000	1	118.4070	1.805	2	119.7039	1.184	185	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(N[6]C[6]O)(COO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.3570	0.000	1	118.4070	1.805	2	119.7039	1.184	185	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]V)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|V<6>}	C[6](C[6]C[6]H)(N[6]C[6]V)(CCN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5260	0.000	1	120.5260	0.000	1	119.7039	1.184	185	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]V)(CC[6a]N)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|V<5>}	C[6](C[6]C[6]H)(N[6]C[6]V)(CC[6a]N){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4250	0.014	2	120.5323	0.021	4	119.7039	1.184	185	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]V)(CC[6a]N)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|V<6>}	C[6](C[6]C[6]H)(N[6]C[6]V)(CC[6a]N){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6395	0.124	2	120.5323	0.021	4	119.7039	1.184	185	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]V)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|V<7>}	C[6](C[6]C[6]H)(N[6]C[6]V)(CNO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4610	0.000	1	120.4610	0.000	1	119.7039	1.184	185	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]V)(COS)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|V<6>}	C[6](C[6]C[6]H)(N[6]C[6]V)(COS){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.1660	0.249	2	120.1660	0.062	2	119.7039	1.184	185	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(N[6]C[6]O)(COO){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1350	0.383	2	120.1853	0.081	3	119.7039	1.184	185	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(N[6]C[6]O)(COO){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2860	0.000	1	120.1853	0.081	3	119.7039	1.184	185	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CNO){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.3900	0.164	3	120.3900	0.027	3	119.7039	1.184	185	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(COO){1|O<2>,2|C<3>}	H(C[6]C[6]2)	119.9831	0.578	10	119.9831	0.334	10	119.7039	1.184	185	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-3:	C[6]-3:	C[6](C[6]N[6]C)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]N[6]C)(C[6]N[6]O)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(COO){1|N<2>,2|O<1>}	H(C[6]C[6]2)	121.0000	0.000	1	121.0000	0.000	1	119.7039	1.184	185	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-3:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](C[6]C[6]H)(N[6]C[6]2)(CHH)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){2|C<3>}	C[6](C[6]C[6]H)(N[6]C[6]2)(CHH){1|C<2>,1|C<3>,1|C<4>,1|N<2>,1|O<1>}	H(C[6]C[6]2)	121.2230	0.000	1	121.2230	0.000	1	119.7039	1.184	185	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-3:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CHH)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CHH){1|C<4>,1|N<3>,1|S<1>}	H(C[6]C[6]2)	117.5790	0.000	1	117.5790	0.000	1	119.7039	1.184	185	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[3x3,4,3x5,14x6]C[6])(C[6]C[6]N[6])(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[3x3,4,3x5,14x6]C[6])(C[6]C[6]N[6])(H){1|Ir<6>,1|H<1>,1|N<3>,2|C<3>,4|B<6>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ir)(C[6]C[6]H){1|C<5>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.9640	0.000	1	119.9640	0.000	1	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6]N[6])(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6]N[6])(H){1|Fe<10>,1|Cu<5>,1|H<1>,1|N<3>,2|C<3>,2|C<4>}	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H){1|C<4>,1|H<1>,4|C<3>}	H(C[6]C[6]2)	119.9485	0.218	2	119.9792	0.019	4	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6]N[6])(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6]N[6])(H){1|Fe<10>,1|Cu<6>,1|H<1>,1|N<3>,2|C<3>,2|C<4>}	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H){1|C<4>,1|H<1>,4|C<3>}	H(C[6]C[6]2)	120.0100	0.075	2	119.9792	0.019	4	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6]N[6])(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6]N[6])(H){1|Fe<10>,1|Ir<6>,1|H<1>,1|N<3>,2|C<3>,2|C<4>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ir)(C[6]C[6]H){1|C<4>,1|H<1>,4|C<3>}	H(C[6]C[6]2)	120.2860	0.191	2	120.2860	0.036	2	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6]N[6])(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6]N[6])(H){1|Fe<10>,1|Pt<4>,1|H<1>,1|N<3>,2|C<3>,2|C<4>}	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H){1|C<4>,1|H<1>,4|C<3>}	H(C[6]C[6]2)	119.8750	0.000	1	119.8750	0.000	1	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6]N[6])(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Zn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6]N[6])(H){1|Fe<10>,1|Zn<5>,1|H<1>,1|N<3>,2|C<3>,2|C<4>}	C[6](C[6]C[6]N[6])(N[6]C[6]Zn)(C[6]C[6]H){1|C<4>,1|H<1>,4|C<3>}	H(C[6]C[6]2)	120.2760	0.057	2	120.2760	0.003	2	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]N[6])(H){1|Fe<6>,1|H<1>,1|N<3>,1|S<2>,3|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Fe)(C[6]C[6]H){1|H<1>,5|C<3>}	H(C[6]C[6]2)	119.8957	0.118	4	119.8957	0.014	4	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]N[6])(H){1|Pt<4>,1|H<1>,1|N<3>,1|S<2>,3|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H){1|H<1>,5|C<3>}	H(C[6]C[6]2)	120.1920	0.307	2	120.1920	0.094	2	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Re)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]N[6])(H){1|Re<6>,1|H<1>,1|N<2>,1|N<3>,3|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Re)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.1420	0.095	2	119.9223	0.118	4	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Re)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]N[6])(H){1|Re<6>,1|H<1>,1|N<3>,1|O<2>,3|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Re)(C[6]C[6]H){1|H<1>,5|C<3>}	H(C[6]C[6]2)	119.9770	0.000	1	119.9223	0.118	4	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Re)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]N[6])(H){1|Re<6>,1|H<1>,1|N<3>,1|S<2>,3|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Re)(C[6]C[6]H){1|H<1>,5|C<3>}	H(C[6]C[6]2)	119.4280	0.000	1	119.9223	0.118	4	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]N[6])(H){1|Ru<6>,1|H<1>,1|N<3>,1|S<2>,3|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(C[6]C[6]H){1|H<1>,5|C<3>}	H(C[6]C[6]2)	120.2116	0.374	8	120.2116	0.140	8	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Zn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]N[6])(H){1|Zn<5>,1|H<1>,1|N<3>,1|S<2>,3|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Zn)(C[6]C[6]H){1|H<1>,5|C<3>}	H(C[6]C[6]2)	119.9360	0.379	8	119.9155	0.121	11	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Zn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]N[6])(H){1|Zn<6>,1|H<1>,1|N<3>,1|S<2>,3|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Zn)(C[6]C[6]H){1|H<1>,5|C<3>}	H(C[6]C[6]2)	119.8610	0.311	3	119.9155	0.121	11	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6]C[6a])(C[6]C[6]N[6])(H)	C[6](C[6]C[6]N[6])(N[6]C[6,6]Cd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]C[6a])(C[6]C[6]N[6])(H){1|Cd<5>,1|C<4>,1|N<3>,4|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6,6]Cd)(C[6]C[6]H){1|C<4>,1|H<1>,4|C<3>}	H(C[6]C[6]2)	120.0070	0.000	1	120.0070	0.000	1	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H)	C[6](C[6]C[5a,6]N[6])(N[6]C[6,6a]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H){1|Ir<6>,1|N<3>,3|C<3>}	C[6](C[6]C[5a,6]N[6])(N[6]C[6,6a]Ir)(C[6]C[6]H){1|H<1>,1|N<3>,4|C<3>}	H(C[6]C[6]2)	120.3240	0.367	3	120.3240	0.135	3	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H)	C[6](C[6]C[5a,6]N[6])(N[6]C[6,6a]Re)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H){1|Re<6>,1|N<3>,3|C<3>}	C[6](C[6]C[5a,6]N[6])(N[6]C[6,6a]Re)(C[6]C[6]H){1|H<1>,1|N<3>,4|C<3>}	H(C[6]C[6]2)	119.9040	0.000	1	119.9040	0.000	1	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H)	C[6](C[6]C[6,6a]C[6])(N[6]C[6,6a]H)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H){1|H<1>,4|C<3>}	C[6](C[6]C[6,6a]C[6])(N[6]C[6,6a]H)(C[6]C[6]H){1|C<4>,1|H<1>,1|O<1>,4|C<3>}	H(C[6]C[6]2)	119.4930	0.031	2	119.4930	0.001	2	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[3x6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[3x6]Mn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[3x6]H)(H){1|Mn<5>,1|C<4>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[3x6]Mn)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.4977	0.194	3	120.2812	0.109	5	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[3x6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[3x6]Mn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[3x6]H)(H){1|Mn<6>,1|C<4>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[3x6]Mn)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.9565	0.098	2	120.2812	0.109	5	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[3x6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[3x6]Re)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[3x6]H)(H){1|Re<6>,1|C<4>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[3x6]Re)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.8996	0.961	5	119.8996	0.923	5	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6,6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6,6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6,6]H)(H){1|Cu<3>,1|N<3>,3|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6,6]Cu)(C[6]C[6]H){1|N<2>,1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2940	0.000	1	120.1845	0.024	2	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6,6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6,6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6,6]H)(H){1|Cu<4>,1|N<3>,3|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6,6]Cu)(C[6]C[6]H){1|N<2>,1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0750	0.000	1	120.1845	0.024	2	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6,6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6,6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6,6]H)(H){1|Pd<3>,1|N<3>,3|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6,6]Pd)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.9970	0.000	1	119.8120	0.028	3	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6,6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6,6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6,6]H)(H){1|Pd<4>,1|N<3>,3|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6,6]Pd)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.7195	0.066	2	119.8120	0.028	3	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6,6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6,6]Re)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6,6]H)(H){1|Re<5>,1|N<3>,3|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6,6]Re)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.0280	0.000	1	120.0280	0.000	1	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6,6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6,6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6,6]H)(H){1|Ru<5>,1|C<4>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6,6]Ru)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	121.1670	0.000	1	120.3211	0.178	7	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6,6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6,6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6,6]H)(H){1|Ru<5>,1|N<3>,3|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6,6]Ru)(C[6]C[6]H){1|N<2>,1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0635	0.033	2	120.3211	0.178	7	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6,6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6,6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6,6]H)(H){1|Ru<5>,1|N<3>,3|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6,6]Ru)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.3040	0.180	2	120.3211	0.178	7	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6,6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6,6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6,6]H)(H){1|Ru<6>,2|C<3>,2|N<3>}	C[6](C[6]C[6]N[6])(N[6]C[6,6]Ru)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.4400	0.000	1	120.3211	0.178	7	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6,6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6,6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6,6]H)(H){1|Ru<6>,2|C<3>,2|N<3>}	C[6](C[6]C[6]N[6])(N[6]C[6,6]Ru)(C[6]C[6]H){1|H<1>,2|C<4>,3|C<3>}	H(C[6]C[6]2)	119.9060	0.000	1	120.3211	0.178	7	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]2)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Co)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]2)(H){1|Co<6>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Co)(C[6]C[6]H){1|H<1>,5|C<3>}	H(C[6]C[6]2)	120.4310	0.211	5	120.4310	0.045	5	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]2)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Cr)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]2)(H){1|Cr<6>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Cr)(C[6]C[6]H){1|H<1>,5|C<3>}	H(C[6]C[6]2)	120.6385	0.186	2	120.6385	0.035	2	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]2)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]2)(H){1|Cu<6>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H){1|H<1>,5|C<3>}	H(C[6]C[6]2)	119.9443	0.478	3	119.9443	0.228	3	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]2)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]2)(H){1|Fe<6>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Fe)(C[6]C[6]H){1|H<1>,5|C<3>}	H(C[6]C[6]2)	120.5560	0.110	2	120.5560	0.012	2	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]2)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]2)(H){1|Ir<6>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ir)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.0120	0.288	2	120.0120	0.083	2	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]2)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ni)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]2)(H){1|Ni<6>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ni)(C[6]C[6]H){1|H<1>,5|C<3>}	H(C[6]C[6]2)	120.4685	0.757	4	120.4685	0.573	4	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]2)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]2)(H){1|Pt<4>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.6340	0.000	1	119.6340	0.000	1	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]2)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]2)(H){1|Ru<6>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.9080	0.038	2	119.9080	0.001	2	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]Br)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]Br)(H){1|Cu<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H){1|Br<1>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	121.1750	0.000	1	121.1750	0.000	1	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]Br)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]Br)(H){1|Pt<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H){1|Br<1>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.9256	0.424	5	120.9256	0.180	5	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ag)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Ag<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ag)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.4497	0.238	8	119.4497	0.056	8	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Cd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Cd<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Cd)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.2990	0.208	2	119.3353	0.016	4	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Cd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Cd<7>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Cd)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.3715	0.012	2	119.3353	0.016	4	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Co)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Co<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Co)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.9105	0.037	2	120.2520	0.135	38	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Co)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Co<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Co)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.7520	0.250	5	120.2520	0.135	38	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Co)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Co<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Co)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.4145	0.216	29	120.2520	0.135	38	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Co)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Co<7>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Co)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.4870	0.113	2	120.2520	0.135	38	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Cr)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Cr<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Cr)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.3888	0.319	4	119.3888	0.102	4	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Cu<3>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.0360	0.037	2	119.9332	0.087	55	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Cu<4>,1|C<4>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H){1|H<1>,2|C<4>,3|C<3>}	H(C[6]C[6]2)	119.7475	0.508	2	119.9332	0.087	55	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Cu<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H){1|C<4>,1|H<1>,4|C<3>}	H(C[6]C[6]2)	120.2523	0.522	4	119.9332	0.087	55	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Cu<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.9090	0.171	7	119.9332	0.087	55	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Cu<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.0545	0.368	2	119.9332	0.087	55	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Cu<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H){1|C<4>,1|H<1>,4|C<3>}	H(C[6]C[6]2)	120.1328	0.115	16	119.9332	0.087	55	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Cu<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.7343	0.224	22	119.9332	0.087	55	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Fe)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.8697	0.229	12	119.8697	0.052	12	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Hg)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Hg<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Hg)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.6695	0.161	2	119.6695	0.026	2	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Ir<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ir)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.0270	0.208	2	119.7038	0.326	115	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Ir<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ir)(C[6]C[6]H){1|C<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.6735	0.961	2	119.7038	0.326	115	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Ir<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ir)(C[6]C[6]H){1|C<4>,1|H<1>,4|C<3>}	H(C[6]C[6]2)	119.9597	0.798	3	119.7038	0.326	115	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Ir<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ir)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.5882	0.529	78	119.7038	0.326	115	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Ir<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ir)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.8679	0.460	16	119.7038	0.326	115	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Ir<7>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ir)(C[6]C[6]H){1|C<4>,1|H<1>,4|C<3>}	H(C[6]C[6]2)	119.7060	0.339	2	119.7038	0.326	115	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Ir<7>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ir)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.5125	0.753	2	119.7038	0.326	115	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Ir<8>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ir)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.3640	0.459	8	119.7038	0.326	115	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Ir<8>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ir)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.7730	0.192	2	119.7038	0.326	115	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Mn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Mn<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Mn)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.9435	0.081	2	119.6364	0.237	43	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Mn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Mn<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Mn)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.5760	0.462	39	119.6364	0.237	43	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Mn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Mn<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Mn)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.5070	0.049	2	119.6364	0.237	43	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Mo)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Mo<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Mo)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.3023	0.228	12	119.2480	0.117	19	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Mo)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Mo<7>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Mo)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.3106	0.364	5	119.2480	0.117	19	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Mo)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Mo<8>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Mo)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	118.7660	0.690	2	119.2480	0.117	19	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ni)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Ni<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ni)(C[6]C[6]H){1|C<4>,1|H<1>,4|C<3>}	H(C[6]C[6]2)	120.1630	0.161	2	119.7454	0.392	50	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ni)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Ni<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ni)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.5450	0.702	26	119.7454	0.392	50	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ni)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Ni<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ni)(C[6]C[6]H){1|C<4>,1|H<1>,4|C<3>}	H(C[6]C[6]2)	120.0835	0.028	2	119.7454	0.392	50	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ni)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Ni<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ni)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.9610	0.148	2	119.7454	0.392	50	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ni)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Ni<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ni)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.8754	0.481	17	119.7454	0.392	50	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ni)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Ni<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ni)(C[6]C[6]H){1|H<1>,2|C<4>,3|C<3>}	H(C[6]C[6]2)	120.8020	0.000	1	119.7454	0.392	50	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Os)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Os<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Os)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.6476	0.332	9	119.9300	0.240	20	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Os)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Os<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Os)(C[6]C[6]H){1|H<1>,5|C<3>}	H(C[6]C[6]2)	120.5155	0.094	2	119.9300	0.240	20	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Os)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Os<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Os)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.0823	0.507	9	119.9300	0.240	20	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Pd<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Pd)(C[6]C[6]H){1|C<4>,1|H<1>,4|C<3>}	H(C[6]C[6]2)	120.0450	0.082	2	119.6697	0.136	70	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Pd<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Pd)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.6171	0.311	58	119.6697	0.136	70	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Pd<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Pd)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.4055	0.247	4	119.6697	0.136	70	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Pd<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Pd)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.5627	0.453	6	119.6697	0.136	70	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Pt<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H){1|C<2>,1|H<1>,4|C<3>}	H(C[6]C[6]2)	120.0120	0.161	4	119.6957	0.561	238	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Pt<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H){1|C<4>,1|H<1>,4|C<3>}	H(C[6]C[6]2)	120.1134	0.595	27	119.6957	0.561	238	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Pt<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.4451	0.849	92	119.6957	0.561	238	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Pt<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H){1|H<1>,2|C<4>,3|C<3>}	H(C[6]C[6]2)	119.7195	0.279	6	119.6957	0.561	238	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Pt<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H){1|H<1>,5|C<3>}	H(C[6]C[6]2)	120.4915	0.585	2	119.6957	0.561	238	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Pt<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.4814	0.343	25	119.6957	0.561	238	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Pt<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.3829	0.389	10	119.6957	0.561	238	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Pt<6>,1|C<2>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H){1|H<1>,4|C<3>}	H(C[6]C[6]2)	121.0930	0.000	1	119.6957	0.561	238	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Pt<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H){1|C<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.7200	0.000	1	119.6957	0.561	238	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Pt<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H){1|C<4>,1|H<1>,4|C<3>}	H(C[6]C[6]2)	120.5155	0.100	2	119.6957	0.561	238	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Pt<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.4358	0.517	58	119.6957	0.561	238	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Pt<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.1225	0.198	10	119.6957	0.561	238	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Re)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Re<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Re)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.7740	0.038	2	119.7624	0.184	60	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Re)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Re<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Re)(C[6]C[6]H){1|C<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.5530	0.167	5	119.7624	0.184	60	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Re)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Re<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Re)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.6376	0.357	46	119.7624	0.184	60	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Re)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Re<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Re)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.0149	0.354	7	119.7624	0.184	60	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Rh)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Rh<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Rh)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.7925	0.011	2	119.6945	0.060	22	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Rh)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Rh<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Rh)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.6229	0.218	16	119.6945	0.060	22	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Rh)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Rh<8>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Rh)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.7495	0.045	2	119.6945	0.060	22	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Rh)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Rh<8>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Rh)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.1145	0.303	2	119.6945	0.060	22	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Ru<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(C[6]C[6]H){1|C<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.7630	0.000	1	119.8292	0.409	98	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Ru<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(C[6]C[6]H){1|C<4>,1|H<1>,4|C<3>}	H(C[6]C[6]2)	119.4720	0.000	1	119.8292	0.409	98	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Ru<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.5175	0.608	50	119.8292	0.409	98	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Ru<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.2304	0.488	41	119.8292	0.409	98	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Ru<8>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.7715	0.152	2	119.8292	0.409	98	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Ru<9>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.4980	0.124	2	119.8292	0.409	98	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Ru<9>,1|N<3>,3|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.1680	0.000	1	119.8292	0.409	98	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Sn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Sn<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Sn)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.8660	0.000	1	119.8660	0.000	1	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Zn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Zn<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Zn)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.8615	0.142	2	120.1727	0.533	30	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Zn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Zn<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Zn)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.5450	0.000	1	120.1727	0.533	30	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Zn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Zn<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Zn)(C[6]C[6]H){1|C<2>,1|H<1>,4|C<3>}	H(C[6]C[6]2)	120.7668	0.128	5	120.1727	0.533	30	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Zn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Zn<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Zn)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.9410	0.339	4	120.1727	0.533	30	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Zn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Zn<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Zn)(C[6]C[6]H){1|C<4>,1|H<1>,4|C<3>}	H(C[6]C[6]2)	120.5563	1.195	7	120.1727	0.533	30	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Zn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Zn<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Zn)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.7656	0.361	11	120.1727	0.533	30	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]Cl)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Al)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]Cl)(H){1|Al<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Al)(C[6]C[6]H){1|Cl<1>,1|H<1>,4|C<3>}	H(C[6]C[6]2)	121.4040	0.122	2	121.4040	0.015	2	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]Cl)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Co)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]Cl)(H){1|Co<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Co)(C[6]C[6]H){1|Cl<1>,1|H<1>,4|C<3>}	H(C[6]C[6]2)	120.6166	2.101	7	120.6166	4.412	7	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]Cl)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]Cl)(H){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Fe)(C[6]C[6]H){1|Cl<1>,1|H<1>,4|C<3>}	H(C[6]C[6]2)	121.3120	0.117	2	121.3120	0.014	2	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]Cl)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]Cl)(H){1|Pt<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H){1|Cl<1>,1|H<1>,4|C<3>}	H(C[6]C[6]2)	121.0960	0.213	6	121.0960	0.046	6	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]Cl)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]Cl)(H){1|Ru<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(C[6]C[6]H){1|Cl<1>,1|H<1>,4|C<3>}	H(C[6]C[6]2)	120.9760	0.366	7	120.9760	0.134	7	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]F)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]F)(H){1|Ir<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ir)(C[6]C[6]H){1|F<1>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.4085	0.111	2	120.4085	0.012	2	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]N[6])(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[5,6]N[6])(N[6]C[6]Ru)(C[6]C[6]H){1|N<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.8420	0.000	1	119.8420	0.000	1	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]N[6])(N[6]C[6]Zn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Zn<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[5,6]N[6])(N[6]C[6]Zn)(C[6]C[6]H){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3953	0.322	6	120.3953	0.104	6	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]N[6])(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[5a,6]N[6])(N[6]C[6]Ir)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.4195	0.248	2	120.4195	0.062	2	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]N[6])(N[6]C[6]Co)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Co<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]N[6])(N[6]C[6]Co)(C[6]C[6]H){1|H<1>,1|N<2>,4|C<3>}	H(C[6]C[6]2)	120.1140	0.000	1	120.4060	0.063	4	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]N[6])(N[6]C[6]Co)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Co<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]N[6])(N[6]C[6]Co)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.3000	0.000	1	120.4060	0.063	4	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]N[6])(N[6]C[6]Co)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Co<6>,1|N<3>,3|C<3>}	C[6](C[6]C[6,6a]N[6])(N[6]C[6]Co)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.6050	0.113	2	120.4060	0.063	4	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]N[6])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]N[6])(N[6]C[6]Cu)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.1530	0.000	1	120.1530	0.000	1	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]N[6])(N[6]C[6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|C<4>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]N[6])(N[6]C[6]Pd)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.3470	0.000	1	120.3470	0.000	1	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ag)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ag<3>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ag)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.4260	0.010	2	120.2962	0.423	47	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ag)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ag<3>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ag)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.4035	0.351	4	120.2962	0.423	47	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ag)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ag<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ag)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.5460	0.138	4	120.2962	0.423	47	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ag)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ag<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ag)(C[6]C[6]H){1|N<2>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	120.3575	0.091	2	120.2962	0.423	47	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ag)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ag<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ag)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	121.3435	0.351	2	120.2962	0.423	47	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ag)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ag<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ag)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.1372	0.758	22	120.2962	0.423	47	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ag)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ag<5>,1|H<1>,1|N<2>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ag)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.6140	0.000	1	120.2962	0.423	47	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ag)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ag<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ag)(C[6]C[6]H){1|N<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.9640	0.044	2	120.2962	0.423	47	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ag)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ag<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ag)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.1770	0.263	2	120.2962	0.423	47	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ag)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ag<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ag)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.3255	0.813	6	120.2962	0.423	47	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Al)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Al<5>,1|C<3>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Al)(C[6]C[6]H){1|C<4>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.2620	0.000	1	120.6882	0.254	40	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Al)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Al<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Al)(C[6]C[6]H){1|C<4>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	120.3785	0.035	2	120.6882	0.254	40	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Al)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Al<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Al)(C[6]C[6]H){1|P<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.7543	0.143	9	120.6882	0.254	40	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Al)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Al<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Al)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.9699	0.297	14	120.6882	0.254	40	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Al)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Al<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Al)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.4802	0.374	6	120.6882	0.254	40	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Al)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Al<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Al)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.1615	1.404	2	120.6882	0.254	40	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Al)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Al<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Al)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.4900	0.819	6	120.6882	0.254	40	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Au)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Au<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Au)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.4775	0.556	2	119.9832	0.473	4	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Au)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Au<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Au)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.6960	0.000	1	119.9832	0.473	4	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Au)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Au<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Au)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.2820	0.000	1	119.9832	0.473	4	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ba)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ba<12>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ba)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.2830	0.052	2	120.2830	0.003	2	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Bi)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Bi<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Bi)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.8040	0.492	2	120.6610	0.077	7	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Bi)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Bi<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Bi)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.4330	0.000	1	120.6610	0.077	7	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Bi)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Bi<7>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Bi)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.7345	0.303	2	120.6610	0.077	7	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Bi)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Bi<7>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Bi)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.5585	0.019	2	120.6610	0.077	7	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Cd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cd<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Cd)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.4425	0.068	4	120.2006	0.771	107	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Cd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cd<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Cd)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.2605	0.313	17	120.2006	0.771	107	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Cd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cd<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Cd)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.6283	0.268	6	120.2006	0.771	107	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Cd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cd<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Cd)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.7198	0.134	5	120.2006	0.771	107	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Cd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cd<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Cd)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.0970	1.041	71	120.2006	0.771	107	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Cd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cd<7>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Cd)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.2523	0.309	4	120.2006	0.771	107	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Co)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Co<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Co)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.5191	1.809	9	120.4451	0.344	689	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Co)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Co<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Co)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.3310	0.156	2	120.4451	0.344	689	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Co)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Co<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Co)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.6845	0.074	2	120.4451	0.344	689	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Co)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Co<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Co)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.2981	0.562	11	120.4451	0.344	689	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Co)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Co<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Co)(C[6]C[6]H){1|N<2>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	120.3900	0.000	1	120.4451	0.344	689	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Co)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Co<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Co)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.3780	0.585	2	120.4451	0.344	689	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Co)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Co<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Co)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.7077	0.488	3	120.4451	0.344	689	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Co)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Co<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Co)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.3711	0.367	21	120.4451	0.344	689	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Co)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Co<6>,1|C<2>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Co)(C[6]C[6]H){2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.5730	0.000	1	120.4451	0.344	689	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Co)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Co<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Co)(C[6]C[6]H){1|C<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.2070	0.321	3	120.4451	0.344	689	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Co)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Co<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Co)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.7252	0.170	13	120.4451	0.344	689	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Co)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Co<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Co)(C[6]C[6]H){1|N<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.4843	0.094	4	120.4451	0.344	689	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Co)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Co<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Co)(C[6]C[6]H){1|N<3>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	120.5670	0.000	1	120.4451	0.344	689	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Co)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Co<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Co)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	117.7290	0.000	1	120.4451	0.344	689	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Co)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Co<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Co)(C[6]C[6]H){1|S<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.3950	0.164	2	120.4451	0.344	689	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Co)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Co<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Co)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.7277	0.359	102	120.4451	0.344	689	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Co)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Co<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Co)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.4149	0.571	470	120.4451	0.344	689	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Co)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Co<6>,1|N<3>,3|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Co)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.3285	0.267	2	120.4451	0.344	689	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Co)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Co<6>,2|C<3>,2|N<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Co)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.9565	0.009	2	120.4451	0.344	689	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Co)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Co<7>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Co)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.3388	0.567	33	120.4451	0.344	689	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Co)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Co<8>,1|C<4>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Co)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.6480	0.000	1	120.4451	0.344	689	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Co)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Co<8>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Co)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.4493	0.263	3	120.4451	0.344	689	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Cr)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cr<6>,1|C<4>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Cr)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.4575	0.039	2	120.3551	0.294	102	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Cr)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cr<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Cr)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.6950	0.000	1	120.3551	0.294	102	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Cr)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cr<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Cr)(C[6]C[6]H){1|N<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.3040	0.102	3	120.3551	0.294	102	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Cr)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cr<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Cr)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.2006	0.256	8	120.3551	0.294	102	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Cr)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cr<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Cr)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.5772	0.266	25	120.3551	0.294	102	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Cr)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cr<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Cr)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.2569	0.656	57	120.3551	0.294	102	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Cr)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cr<8>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Cr)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	121.0540	0.008	2	120.3551	0.294	102	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Cr)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cr<8>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Cr)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.2278	0.291	4	120.3551	0.294	102	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<3>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.2680	0.207	4	120.3906	0.503	686	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|C<2>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.2047	0.260	3	120.3906	0.503	686	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|C<4>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H){1|N<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.3490	0.175	2	120.3906	0.503	686	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|C<4>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.9039	0.476	11	120.3906	0.503	686	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|H<1>,1|N<2>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H){1|H<1>,1|N<3>,4|C<3>}	H(C[6]C[6]2)	121.0177	0.117	3	120.3906	0.503	686	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H){1|C<2>,1|N<3>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	120.6990	0.000	1	120.3906	0.503	686	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.5960	0.323	44	120.3906	0.503	686	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H){1|Cu<4>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.3586	0.303	10	120.3906	0.503	686	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H){1|N<2>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	120.0595	1.484	2	120.3906	0.503	686	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H){1|N<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.2270	0.123	2	120.3906	0.503	686	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H){1|N<3>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	120.5950	0.000	1	120.3906	0.503	686	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.6730	0.681	3	120.3906	0.503	686	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H){1|O<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.4155	0.200	4	120.3906	0.503	686	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.5661	0.228	41	120.3906	0.503	686	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.2680	0.484	82	120.3906	0.503	686	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|H<1>,1|N<4>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H){1|Cu<4>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.3760	0.062	2	120.3906	0.503	686	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H){1|C<2>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	120.0090	0.000	1	120.3906	0.503	686	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|N<3>,3|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.2201	0.378	11	120.3906	0.503	686	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<5>,1|C<2>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H){2|H<1>,3|C<3>}	H(C[6]C[6]2)	117.6155	1.384	4	120.3906	0.503	686	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<5>,1|C<4>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.3696	0.314	16	120.3906	0.503	686	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H){1|C<2>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	116.3293	2.984	3	120.3906	0.503	686	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.6101	0.133	7	120.3906	0.503	686	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H){1|N<2>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	120.7680	0.184	2	120.3906	0.503	686	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H){1|N<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.7880	0.000	1	120.3906	0.503	686	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H){1|N<3>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	120.5295	0.540	2	120.3906	0.503	686	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.4377	0.262	3	120.3906	0.503	686	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H){1|O<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.9612	0.189	4	120.3906	0.503	686	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.8424	0.557	39	120.3906	0.503	686	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.4077	0.710	298	120.3906	0.503	686	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<5>,1|N<3>,3|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.2250	0.000	1	120.3906	0.503	686	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<6>,1|C<4>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.9260	0.393	2	120.3906	0.503	686	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.9275	0.025	2	120.3906	0.503	686	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H){1|O<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.9180	0.144	2	120.3906	0.503	686	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.3706	0.535	71	120.3906	0.503	686	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<7>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.6070	0.129	2	120.3906	0.503	686	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Eu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Eu<10>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Eu)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.7115	0.148	2	120.1731	0.203	17	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Eu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Eu<10>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Eu)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.1540	0.000	1	120.1731	0.203	17	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Eu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Eu<13>,1|C<4>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Eu)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.0535	0.206	2	120.1731	0.203	17	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Eu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Eu<8>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Eu)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.6955	0.006	2	120.1731	0.203	17	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Eu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Eu<8>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Eu)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.9867	0.432	10	120.1731	0.203	17	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Fe<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Fe)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.2505	0.011	2	120.3620	0.472	420	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Fe<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Fe)(C[6]C[6]H){1|P<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.8535	0.254	2	120.3620	0.472	420	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Fe<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Fe)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.6310	0.000	1	120.3620	0.472	420	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Fe<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Fe)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.3160	0.264	3	120.3620	0.472	420	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Fe<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Fe)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.5313	0.129	6	120.3620	0.472	420	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Fe<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Fe)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.2457	0.942	11	120.3620	0.472	420	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Fe<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Fe)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.0481	0.632	10	120.3620	0.472	420	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|C<4>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Fe)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.2809	0.214	15	120.3620	0.472	420	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Fe)(C[6]C[6]H){1|Br<1>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.3985	0.076	2	120.3620	0.472	420	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Fe)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.6278	0.228	21	120.3620	0.472	420	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Fe)(C[6]C[6]H){1|Cl<1>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.4016	0.225	8	120.3620	0.472	420	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Fe)(C[6]C[6]H){1|F<1>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.3603	0.081	4	120.3620	0.472	420	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Fe)(C[6]C[6]H){1|N<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.2848	0.148	4	120.3620	0.472	420	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Fe)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.7931	0.209	16	120.3620	0.472	420	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Fe)(C[6]C[6]H){1|O<2>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.4423	0.279	3	120.3620	0.472	420	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Fe)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.5049	1.126	53	120.3620	0.472	420	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Fe)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.2972	0.673	232	120.3620	0.472	420	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|N<3>,3|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Fe)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.3875	0.133	8	120.3620	0.472	420	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Fe<6>,2|C<3>,2|N<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Fe)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.7817	0.160	6	120.3620	0.472	420	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Fe<7>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Fe)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.3680	0.000	1	120.3620	0.472	420	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Fe<8>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Fe)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.5015	0.194	12	120.3620	0.472	420	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Hg)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Hg<4>,1|C<4>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Hg)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.5435	0.078	2	120.3494	0.221	20	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Hg)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Hg<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Hg)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.2790	0.569	2	120.3494	0.221	20	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Hg)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Hg<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Hg)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.9917	0.494	6	120.3494	0.221	20	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Hg)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Hg<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Hg)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.4915	0.200	2	120.3494	0.221	20	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Hg)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Hg<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Hg)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.5511	0.444	8	120.3494	0.221	20	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Br<1>,1|Ir<6>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ir)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.4703	0.315	3	120.2973	0.351	160	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|C<2>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ir)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.4670	0.000	1	120.2973	0.351	160	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|C<6>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ir)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.0400	0.184	3	120.2973	0.351	160	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ir)(C[6]C[6]H){1|C<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.3020	0.000	1	120.2973	0.351	160	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ir)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.7233	0.093	3	120.2973	0.351	160	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ir)(C[6]C[6]H){1|N<2>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	120.3990	0.000	1	120.2973	0.351	160	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ir)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.9770	0.387	2	120.2973	0.351	160	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ir)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.3578	0.678	18	120.2973	0.351	160	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ir)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.2828	0.659	79	120.2973	0.351	160	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|N<3>,3|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ir)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.3086	0.206	5	120.2973	0.351	160	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ir<6>,2|C<3>,2|N<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ir)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.6290	0.000	1	120.2973	0.351	160	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ir<7>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ir)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.4035	0.292	4	120.2973	0.351	160	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ir<8>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ir)(C[6]C[6]H){1|O<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.6032	0.470	6	120.2973	0.351	160	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ir<8>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ir)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.3062	0.510	31	120.2973	0.351	160	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ir<8>,1|N<3>,1|O<2>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ir)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.0345	0.276	2	120.2973	0.351	160	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Li)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Li<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Li)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.4625	0.313	2	120.4604	0.037	8	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Li)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Li<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Li)(C[6]C[6]H){1|Li<4>,1|B<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.2795	0.138	2	120.4604	0.037	8	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Li)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Li<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Li)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.4680	0.000	1	120.4604	0.037	8	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Li)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Li<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Li)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.6510	0.071	2	120.4604	0.037	8	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Li)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Li<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Li)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.4290	0.000	1	120.4604	0.037	8	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Mg)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Mg<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Mg)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.4085	0.271	2	120.4071	0.098	7	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Mg)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Mg<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Mg)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.6280	0.426	2	120.4071	0.098	7	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Mg)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Mg<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Mg)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.2590	0.291	3	120.4071	0.098	7	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Mn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Mn<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Mn)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.2930	0.045	2	120.3600	0.579	373	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Mn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Mn<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Mn)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	121.6178	1.703	6	120.3600	0.579	373	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Mn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Mn<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Mn)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.9124	0.889	22	120.3600	0.579	373	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Mn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Mn<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Mn)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.6868	0.163	4	120.3600	0.579	373	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Mn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Mn<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Mn)(C[6]C[6]H){1|N<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.5161	0.486	7	120.3600	0.579	373	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Mn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Mn<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Mn)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	121.3703	0.849	3	120.3600	0.579	373	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Mn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Mn<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Mn)(C[6]C[6]H){1|O<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.6349	0.085	12	120.3600	0.579	373	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Mn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Mn<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Mn)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.5336	0.707	38	120.3600	0.579	373	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Mn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Mn<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Mn)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.3056	0.705	266	120.3600	0.579	373	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Mn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Mn<6>,1|N<3>,3|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Mn)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.0570	0.000	1	120.3600	0.579	373	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Mn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Mn<7>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Mn)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.5173	0.957	12	120.3600	0.579	373	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Mo)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Mo<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Mo)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	121.1330	0.000	1	120.2085	0.196	72	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Mo)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Mo<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Mo)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.8994	0.154	8	120.2085	0.196	72	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Mo)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Mo<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Mo)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.2446	0.494	45	120.2085	0.196	72	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Mo)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Mo<6>,1|N<3>,3|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Mo)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.4455	0.161	2	120.2085	0.196	72	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Mo)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Mo<7>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Mo)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.3977	0.158	3	120.2085	0.196	72	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Mo)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Mo<7>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Mo)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.0310	0.378	6	120.2085	0.196	72	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Mo)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Mo<8>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Mo)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.2160	0.124	5	120.2085	0.196	72	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Mo)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Mo<9>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Mo)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.1650	0.216	2	120.2085	0.196	72	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ni)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ni<4>,1|C<4>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ni)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.2160	0.130	4	120.4007	0.942	607	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ni)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ni<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ni)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.5050	0.248	3	120.4007	0.942	607	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ni)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ni<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ni)(C[6]C[6]H){1|N<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.9937	0.133	3	120.4007	0.942	607	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ni)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ni<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ni)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.7410	0.000	1	120.4007	0.942	607	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ni)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ni<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ni)(C[6]C[6]H){1|Ni<4>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.8360	0.000	1	120.4007	0.942	607	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ni)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ni<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ni)(C[6]C[6]H){1|Ni<4>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.1010	0.000	1	120.4007	0.942	607	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ni)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ni<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ni)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	121.0581	0.831	7	120.4007	0.942	607	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ni)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ni<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ni)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.3711	0.984	40	120.4007	0.942	607	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ni)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ni<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ni)(C[6]C[6]H){1|N<2>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	120.4200	0.000	1	120.4007	0.942	607	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ni)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ni<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ni)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.5392	0.160	6	120.4007	0.942	607	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ni)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ni<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ni)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.4793	0.495	10	120.4007	0.942	607	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ni)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|C<4>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ni)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.2534	0.397	8	120.4007	0.942	607	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ni)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ni)(C[6]C[6]H){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.8300	0.040	2	120.4007	0.942	607	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ni)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ni)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.7887	0.245	6	120.4007	0.942	607	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ni)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ni)(C[6]C[6]H){1|N<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.4675	0.168	2	120.4007	0.942	607	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ni)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ni)(C[6]C[6]H){1|N<3>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	120.7913	0.164	6	120.4007	0.942	607	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ni)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ni)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.9447	0.377	7	120.4007	0.942	607	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ni)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ni)(C[6]C[6]H){1|Ni<6>,1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	121.2472	0.492	12	120.4007	0.942	607	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ni)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ni)(C[6]C[6]H){1|O<2>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.6560	0.192	4	120.4007	0.942	607	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ni)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ni)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.5735	1.287	63	120.4007	0.942	607	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ni)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ni)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.3190	0.993	399	120.4007	0.942	607	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ni)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|N<3>,3|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ni)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.2502	0.402	16	120.4007	0.942	607	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ni)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ni<7>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ni)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.1582	0.259	5	120.4007	0.942	607	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Os)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Os<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Os)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.4339	0.396	15	120.1726	0.411	202	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Os)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Os<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Os)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.1564	0.654	185	120.1726	0.411	202	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Os)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Os<8>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Os)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.7080	0.502	2	120.1726	0.411	202	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pd<3>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Pd)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.4250	0.006	2	120.2967	0.291	213	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|C<2>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Pd)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.7280	0.000	1	120.2967	0.291	213	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|C<4>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Pd)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.1513	0.266	8	120.2967	0.291	213	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Pd)(C[6]C[6]H){1|C<2>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	120.6270	0.000	1	120.2967	0.291	213	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Pd)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.5987	0.245	3	120.2967	0.291	213	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Pd)(C[6]C[6]H){1|N<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.7070	0.000	1	120.2967	0.291	213	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Pd)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.7390	0.000	1	120.2967	0.291	213	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Pd)(C[6]C[6]H){1|O<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.0960	0.000	1	120.2967	0.291	213	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Pd)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.8310	0.252	25	120.2967	0.291	213	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Pd)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.2424	0.514	154	120.2967	0.291	213	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|N<2>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Pd)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.5675	0.021	2	120.2967	0.291	213	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|N<3>,3|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Pd)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.8948	0.269	5	120.2967	0.291	213	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pd<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Pd)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.7005	2.580	2	120.2967	0.291	213	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pd<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Pd)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.4570	0.265	4	120.2967	0.291	213	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pd<7>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Pd)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.1687	0.241	3	120.2967	0.291	213	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|B<3>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.7000	0.000	1	120.3300	0.459	635	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|C<2>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.0443	0.504	40	120.3300	0.459	635	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|C<4>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.3448	0.386	20	120.3300	0.459	635	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,1|N<2>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0247	0.545	3	120.3300	0.459	635	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H){1|C<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.7030	0.000	1	120.3300	0.459	635	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H){1|C<4>,1|N<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.6908	0.520	4	120.3300	0.459	635	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.2660	0.000	1	120.3300	0.459	635	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H){1|N<2>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	120.3405	0.402	2	120.3300	0.459	635	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H){1|N<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.4997	0.464	3	120.3300	0.459	635	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.5176	0.197	11	120.3300	0.459	635	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H){1|O<1>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.0302	0.215	9	120.3300	0.459	635	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H){1|O<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.5250	0.319	4	120.3300	0.459	635	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.8389	0.615	104	120.3300	0.459	635	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.2660	0.655	344	120.3300	0.459	635	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|N<3>,3|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H){1|C<6>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.5980	0.000	1	120.3300	0.459	635	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|N<3>,3|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.0250	0.601	4	120.3300	0.459	635	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pt<4>,2|C<3>,2|N<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.0340	0.000	1	120.3300	0.459	635	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pt<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.3490	0.082	2	120.3300	0.459	635	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pt<6>,1|C<2>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H){1|C<4>,1|H<1>,1|N<2>,2|C<3>}	H(C[6]C[6]2)	120.3540	0.000	1	120.3300	0.459	635	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pt<6>,1|C<4>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.3085	0.627	2	120.3300	0.459	635	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pt<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H){1|C<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.6680	0.000	1	120.3300	0.459	635	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pt<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H){1|C<4>,1|N<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8902	0.582	6	120.3300	0.459	635	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pt<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H){1|N<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.5680	0.000	1	120.3300	0.459	635	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pt<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H){1|O<1>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.2000	0.000	1	120.3300	0.459	635	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pt<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.4800	0.099	2	120.3300	0.459	635	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pt<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.2729	0.327	54	120.3300	0.459	635	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pt<6>,1|N<3>,3|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.1926	2.276	7	120.3300	0.459	635	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pt<6>,2|C<3>,2|N<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.8298	0.578	5	120.3300	0.459	635	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Re)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Br<1>,1|Re<6>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Re)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.8630	0.552	2	120.2263	0.286	286	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Re)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cl<1>,1|Re<6>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Re)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.1303	0.357	3	120.2263	0.286	286	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Re)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Re<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Re)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.0249	0.800	9	120.2263	0.286	286	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Re)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Re<6>,1|C<2>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Re)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.2447	0.398	7	120.2263	0.286	286	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Re)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Re<6>,1|C<3>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Re)(C[6]C[6]H){1|C<3>,1|N<2>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	120.6120	0.000	1	120.2263	0.286	286	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Re)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Re<6>,1|C<3>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Re)(C[6]C[6]H){3|H<1>,4|C<3>}	H(C[6]C[6]2)	121.1490	0.000	1	120.2263	0.286	286	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Re)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Re<6>,1|C<4>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Re)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.1098	0.269	13	120.2263	0.286	286	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Re)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Re<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Re)(C[6]C[6]H){1|C<4>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	119.6740	0.000	1	120.2263	0.286	286	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Re)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Re<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Re)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.5053	0.115	8	120.2263	0.286	286	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Re)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Re<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Re)(C[6]C[6]H){1|C<4>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.6673	0.274	3	120.2263	0.286	286	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Re)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Re<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Re)(C[6]C[6]H){1|Cl<1>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.5690	0.000	1	120.2263	0.286	286	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Re)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Re<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Re)(C[6]C[6]H){1|N<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.5590	0.000	1	120.2263	0.286	286	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Re)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Re<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Re)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.5473	0.241	7	120.2263	0.286	286	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Re)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Re<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Re)(C[6]C[6]H){1|P<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	121.7620	0.000	1	120.2263	0.286	286	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Re)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Re<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Re)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.2144	0.318	12	120.2263	0.286	286	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Re)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Re<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Re)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.2109	0.558	208	120.2263	0.286	286	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Re)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Re<6>,1|N<3>,3|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Re)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.1133	0.236	3	120.2263	0.286	286	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Re)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Re<6>,2|C<3>,2|N<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Re)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.8805	0.302	2	120.2263	0.286	286	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Re)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Re<7>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Re)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.5100	0.000	1	120.2263	0.286	286	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Re)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Re<7>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Re)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.5055	0.073	2	120.2263	0.286	286	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Rh)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Rh<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Rh)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.1445	0.317	2	120.3250	0.092	64	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Rh)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Rh<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Rh)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.3850	0.157	4	120.3250	0.092	64	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Rh)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Rh<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Rh)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.7687	0.274	4	120.3250	0.092	64	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Rh)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Rh<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Rh)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.3773	0.348	9	120.3250	0.092	64	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Rh)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Rh<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Rh)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.4345	0.326	6	120.3250	0.092	64	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Rh)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Rh<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Rh)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.3116	0.198	12	120.3250	0.092	64	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Rh)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Rh<7>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Rh)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.8722	0.116	4	120.3250	0.092	64	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Rh)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Rh<8>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Rh)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.3508	0.204	19	120.3250	0.092	64	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Rh)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Rh<8>,1|N<3>,3|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Rh)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.0002	0.380	4	120.3250	0.092	64	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Br<1>,1|Ru<6>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.0535	0.416	2	120.1811	0.645	1037	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ru<10>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.3445	0.110	2	120.1811	0.645	1037	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ru<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.2068	0.226	5	120.1811	0.645	1037	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|C<2>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.2683	0.315	3	120.1811	0.645	1037	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|C<4>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.1777	0.529	11	120.1811	0.645	1037	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(C[6]C[6]H){1|C<2>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	124.1695	1.361	2	120.1811	0.645	1037	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.6496	0.330	11	120.1811	0.645	1037	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(C[6]C[6]H){1|N<2>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	120.3180	0.363	2	120.1811	0.645	1037	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(C[6]C[6]H){1|N<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.1250	0.000	1	120.1811	0.645	1037	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.5743	0.131	3	120.1811	0.645	1037	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(C[6]C[6]H){1|O<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.5583	0.388	4	120.1811	0.645	1037	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.4910	0.473	46	120.1811	0.645	1037	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.1361	0.841	845	120.1811	0.645	1037	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|N<3>,3|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.2901	0.344	18	120.1811	0.645	1037	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ru<7>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.0096	0.418	26	120.1811	0.645	1037	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ru<8>,1|C<2>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.2800	0.000	1	120.1811	0.645	1037	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ru<8>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.6340	0.000	1	120.1811	0.645	1037	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ru<8>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(C[6]C[6]H){1|N<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.4000	0.000	1	120.1811	0.645	1037	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ru<8>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.2299	0.250	14	120.1811	0.645	1037	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ru<9>,1|C<4>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.3500	0.168	2	120.1811	0.645	1037	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ru<9>,1|F<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.1420	0.246	5	120.1811	0.645	1037	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ru<9>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(C[6]C[6]H){1|C<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.2530	0.000	1	120.1811	0.645	1037	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ru<9>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(C[6]C[6]H){1|F<1>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.4250	0.052	2	120.1811	0.645	1037	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ru<9>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(C[6]C[6]H){1|N<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.4340	0.000	1	120.1811	0.645	1037	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ru<9>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.5695	0.556	4	120.1811	0.645	1037	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ru<9>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(C[6]C[6]H){1|O<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.7800	0.137	2	120.1811	0.645	1037	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ru<9>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.3915	0.191	22	120.1811	0.645	1037	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Sb)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Sb<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Sb)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.1720	0.000	1	120.1720	0.000	1	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Sm)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Sm<14>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Sm)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.5880	0.000	1	120.2642	0.050	6	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Sm)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Sm<14>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Sm)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.9650	0.000	1	120.2642	0.050	6	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Sm)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Sm<15>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Sm)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.1930	0.064	2	120.2642	0.050	6	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Sm)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Sm<15>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Sm)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.3230	0.192	2	120.2642	0.050	6	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Sn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Sn<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Sn)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.3228	0.115	10	120.3349	0.018	18	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Sn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Sn<7>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Sn)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.3757	0.179	4	120.3349	0.018	18	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Sn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Sn<8>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Sn)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.3245	0.163	4	120.3349	0.018	18	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Sr)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Sr<12>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Sr)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.3475	0.059	2	120.3475	0.003	2	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ti)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ti<11>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ti)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.5390	0.000	1	120.1540	0.756	2	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ti)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ti<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ti)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.7690	0.000	1	120.1540	0.756	2	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Zn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Zn<3>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Zn)(C[6]C[6]H){1|P<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.6930	0.000	1	120.5127	0.341	328	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Zn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Zn<3>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Zn)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.7350	0.000	1	120.5127	0.341	328	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Zn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Zn<4>,1|C<3>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Zn)(C[6]C[6]H){1|N<3>,1|O<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.3170	0.000	1	120.5127	0.341	328	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Zn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Zn<4>,1|C<4>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Zn)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.3290	0.451	4	120.5127	0.341	328	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Zn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Zn<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Zn)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.5744	0.172	8	120.5127	0.341	328	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Zn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Zn<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Zn)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.2613	0.532	4	120.5127	0.341	328	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Zn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Zn<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Zn)(C[6]C[6]H){1|Zn<5>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.8840	0.000	1	120.5127	0.341	328	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Zn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Zn<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Zn)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.4822	0.108	4	120.5127	0.341	328	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Zn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Zn<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Zn)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.4517	0.572	34	120.5127	0.341	328	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Zn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Zn<5>,1|C<4>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Zn)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.4470	0.096	2	120.5127	0.341	328	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Zn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Zn<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Zn)(C[6]C[6]H){1|N<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.7830	0.251	4	120.5127	0.341	328	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Zn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Zn<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Zn)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.8945	0.288	2	120.5127	0.341	328	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Zn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Zn<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Zn)(C[6]C[6]H){1|Zn<4>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	121.1750	0.000	1	120.5127	0.341	328	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Zn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Zn<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Zn)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.7232	0.248	18	120.5127	0.341	328	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Zn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Zn<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Zn)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.5870	0.301	127	120.5127	0.341	328	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Zn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Zn<6>,1|C<4>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Zn)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.2721	0.351	10	120.5127	0.341	328	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Zn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Zn<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Zn)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.5925	0.299	6	120.5127	0.341	328	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Zn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Zn<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Zn)(C[6]C[6]H){1|Zn<6>,1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.8855	0.479	2	120.5127	0.341	328	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Zn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Zn<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Zn)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.7376	0.206	8	120.5127	0.341	328	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Zn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Zn<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Zn)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.3756	0.932	90	120.5127	0.341	328	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Zr)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Zr<8>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Zr)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.0280	0.391	4	120.0280	0.153	4	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]N[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<5>,2|C<3>,2|N<3>}	C[6](C[6]C[6]N[6])(N[6]N[6]Cu)(C[6]C[6]H){1|Cu<5>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.9830	0.006	2	120.9830	0.000	2	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]N[6]Ni)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ni<6>,2|C<3>,2|N<3>}	C[6](C[6]C[6]N[6])(N[6]N[6]Ni)(C[6]C[6]H){1|Ni<6>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.8414	0.109	8	120.8414	0.012	8	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]P[6])(N[6]C[6]Mo)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Mo<6>,1|H<1>,1|P<3>,2|C<3>}	C[6](C[6]C[6]P[6])(N[6]C[6]Mo)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.6530	0.000	1	119.6530	0.000	1	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]C[6])(N[6]C[6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]N[5,6]C[6])(N[6]C[6]Pd)(C[6]C[6]H){1|N<3>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.0770	0.000	1	120.0770	0.000	1	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]N[5a,6]C[6])(N[6]C[6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]N[5a,6]C[6])(N[6]C[6]Pd)(C[6]C[6]H){1|N<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.3970	0.000	1	120.3970	0.000	1	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]I)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]I)(H){1|Pt<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H){1|H<1>,1|I<1>,4|C<3>}	H(C[6]C[6]2)	120.9415	0.090	2	120.9415	0.008	2	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]I)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]I)(H){1|Ru<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(C[6]C[6]H){1|I<1>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.1935	0.012	2	120.1935	0.000	2	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]N)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Co)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]N)(H){1|Co<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Co)(C[6]C[6]H){1|H<1>,1|N<3>,4|C<3>}	H(C[6]C[6]2)	120.3992	0.573	4	120.3992	0.329	4	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]N)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]N)(H){1|Cu<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	121.3650	0.035	2	121.3650	0.001	2	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]N)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]N)(H){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Fe)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.8850	0.010	2	119.8850	0.000	2	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]N)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]N)(H){1|Ir<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ir)(C[6]C[6]H){1|N<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.1330	0.322	2	120.1330	0.104	2	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]N)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Os)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]N)(H){1|Os<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Os)(C[6]C[6]H){1|H<1>,1|N<3>,4|C<3>}	H(C[6]C[6]2)	119.7747	0.698	4	119.7747	0.487	4	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]N)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]N)(H){1|Pt<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H){1|H<1>,1|N<3>,4|C<3>}	H(C[6]C[6]2)	120.5775	0.358	4	120.1883	0.384	7	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]N)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]N)(H){1|Pt<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.1360	0.000	1	120.1883	0.384	7	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]N)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]N)(H){1|Pt<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.4360	0.424	2	120.1883	0.384	7	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]N)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Re)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]N)(H){1|Re<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Re)(C[6]C[6]H){1|H<1>,1|N<3>,4|C<3>}	H(C[6]C[6]2)	119.9830	0.000	1	119.9830	0.000	1	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]N)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]N)(H){1|Ru<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	121.4500	0.126	2	121.4500	0.016	2	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]N)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Zn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]N)(H){1|Zn<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Zn)(C[6]C[6]H){1|H<1>,1|N<3>,4|C<3>}	H(C[6]C[6]2)	120.9380	0.587	2	120.2900	1.432	3	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]N)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Zn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]N)(H){1|Zn<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Zn)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	118.9940	0.000	1	120.2900	1.432	3	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]O)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Co)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]O)(H){1|Co<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Co)(C[6]C[6]H){1|H<1>,1|O<2>,4|C<3>}	H(C[6]C[6]2)	121.2705	0.655	4	120.8657	0.383	41	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]O)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Co)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]O)(H){1|Co<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Co)(C[6]C[6]H){1|H<1>,1|O<2>,4|C<3>}	H(C[6]C[6]2)	120.8236	0.627	33	120.8657	0.383	41	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]O)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Co)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]O)(H){1|Co<7>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Co)(C[6]C[6]H){1|H<1>,1|O<2>,4|C<3>}	H(C[6]C[6]2)	121.1650	0.430	2	120.8657	0.383	41	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]O)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Co)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]O)(H){1|Co<8>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Co)(C[6]C[6]H){1|O<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.4525	0.098	2	120.8657	0.383	41	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]O)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]O)(H){1|Cu<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H){1|O<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.6923	0.213	3	120.8232	0.180	9	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]O)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]O)(H){1|Cu<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H){1|H<1>,1|O<2>,4|C<3>}	H(C[6]C[6]2)	121.1197	0.428	4	120.8232	0.180	9	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]O)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]O)(H){1|Cu<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H){1|O<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.4265	0.282	2	120.8232	0.180	9	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]O)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]O)(H){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Fe)(C[6]C[6]H){1|H<1>,1|O<2>,4|C<3>}	H(C[6]C[6]2)	121.0030	0.327	3	121.0030	0.107	3	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]O)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]O)(H){1|Ir<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ir)(C[6]C[6]H){1|O<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.4578	0.113	4	120.5461	0.040	8	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]O)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]O)(H){1|Ir<8>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ir)(C[6]C[6]H){1|O<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.6345	0.246	4	120.5461	0.040	8	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]O)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Mn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]O)(H){1|Mn<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Mn)(C[6]C[6]H){1|H<1>,1|O<2>,4|C<3>}	H(C[6]C[6]2)	120.2782	1.533	4	120.3177	1.417	6	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]O)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Mn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]O)(H){1|Mn<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Mn)(C[6]C[6]H){1|O<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.3965	0.121	2	120.3177	1.417	6	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]O)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ni)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]O)(H){1|Ni<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ni)(C[6]C[6]H){1|H<1>,1|O<2>,4|C<3>}	H(C[6]C[6]2)	120.8141	0.150	7	120.8124	0.369	29	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]O)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ni)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]O)(H){1|Ni<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ni)(C[6]C[6]H){1|O<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.8119	0.697	22	120.8124	0.369	29	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]O)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]O)(H){1|Pt<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H){1|H<1>,1|O<2>,4|C<3>}	H(C[6]C[6]2)	120.6977	0.536	6	120.5317	0.266	10	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]O)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]O)(H){1|Pt<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H){1|O<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.2827	0.426	4	120.5317	0.266	10	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]O)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Re)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]O)(H){1|Re<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Re)(C[6]C[6]H){1|H<1>,1|O<2>,4|C<3>}	H(C[6]C[6]2)	120.3663	0.306	3	120.3002	0.107	15	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]O)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Re)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]O)(H){1|Re<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Re)(C[6]C[6]H){1|O<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.2837	0.343	12	120.3002	0.107	15	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]O)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Rh)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]O)(H){1|Rh<8>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Rh)(C[6]C[6]H){1|O<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.5065	0.059	2	120.5065	0.003	2	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]O)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]O)(H){1|Ru<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(C[6]C[6]H){1|O<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.6695	0.090	6	120.5984	0.034	17	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]O)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]O)(H){1|Ru<9>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(C[6]C[6]H){1|O<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.5596	0.214	11	120.5984	0.034	17	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]O)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Zn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]O)(H){1|Zn<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Zn)(C[6]C[6]H){1|H<1>,1|O<2>,4|C<3>}	H(C[6]C[6]2)	120.9238	0.235	6	120.6572	0.139	12	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]O)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Zn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]O)(H){1|Zn<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Zn)(C[6]C[6]H){1|O<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.3907	0.283	6	120.6572	0.139	12	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]P)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]P)(H){1|Pt<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H){1|P<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.2256	0.048	5	120.2256	0.002	5	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]P)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]P)(H){1|Ru<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(C[6]C[6]H){1|P<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.2103	0.462	4	120.2103	0.214	4	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]S)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]S)(H){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Fe)(C[6]C[6]H){1|H<1>,1|S<3>,4|C<3>}	H(C[6]C[6]2)	120.6220	0.460	2	120.6220	0.211	2	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]S)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Re)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]S)(H){1|Re<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Re)(C[6]C[6]H){1|S<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.7110	0.000	1	119.7110	0.000	1	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Co)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H){1|Co<6>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Co)(C[6]C[6]H){1|N<2>,1|S<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	121.4433	0.260	3	121.6178	0.167	4	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Co)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H){1|Co<8>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Co)(C[6]C[6]H){1|N<2>,1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	122.1410	0.000	1	121.6178	0.167	4	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H){1|Cu<5>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H){1|N<2>,1|S<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	121.5835	0.095	2	120.9947	0.270	12	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H){2|Cu<4>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H){1|N<3>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	121.1410	0.000	1	120.9947	0.270	12	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H){2|Cu<5>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H){1|N<3>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	120.8477	0.506	9	120.9947	0.270	12	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H){1|Ir<8>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ir)(C[6]C[6]H){1|N<2>,1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	122.1150	0.000	1	121.6010	0.528	2	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H){1|Ir<8>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ir)(C[6]C[6]H){1|N<2>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	121.0870	0.000	1	121.6010	0.528	2	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ni)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H){1|Ni<5>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ni)(C[6]C[6]H){1|C<4>,1|N<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	121.3940	1.031	2	121.3940	1.063	2	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Rh)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H){1|Rh<8>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Rh)(C[6]C[6]H){1|N<2>,1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	121.8880	0.000	1	121.8880	0.000	1	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H){1|Ru<9>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(C[6]C[6]H){1|N<2>,1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	121.8350	0.000	1	121.8350	0.000	1	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Zn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]N[6]H)(H){1|Zn<5>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Zn)(C[6]C[6]H){1|C<4>,1|N<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	121.6105	0.029	2	121.6105	0.001	2	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])2(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Co)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])2(H){2|Co<6>,2|N<3>,3|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Co)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	121.0545	3.449	2	121.0545	11.893	2	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])2(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ni)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])2(H){2|Ni<6>,2|N<3>,3|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ni)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.8080	5.244	2	120.8080	27.499	2	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ag)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Ag<4>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ag)(C[6]C[6]H){1|H<1>,5|C<3>}	H(C[6]C[6]2)	119.9063	0.188	3	119.9063	0.035	3	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Al)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Al<5>,1|C<4>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Al)(C[6]C[6]H){1|C<4>,1|H<1>,4|C<3>}	H(C[6]C[6]2)	119.2180	0.000	1	119.3577	0.046	3	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Al)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Al<5>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Al)(C[6]C[6]H){1|H<1>,5|C<3>}	H(C[6]C[6]2)	119.4275	0.250	2	119.3577	0.046	3	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Au)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Au<4>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Au)(C[6]C[6]H){1|H<1>,5|C<3>}	H(C[6]C[6]2)	119.7315	0.029	2	119.7315	0.001	2	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Cd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Cd<5>,1|H<1>,1|N<2>,1|N<3>,3|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Cd)(C[6]C[6]H){1|H<1>,5|C<3>}	H(C[6]C[6]2)	119.9350	0.014	2	119.9237	0.080	23	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Cd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Cd<5>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Cd)(C[6]C[6]H){1|H<1>,5|C<3>}	H(C[6]C[6]2)	119.8225	0.310	11	119.9237	0.080	23	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Cd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Cd<6>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Cd)(C[6]C[6]H){1|H<1>,5|C<3>}	H(C[6]C[6]2)	120.0328	0.253	10	119.9237	0.080	23	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Co)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Co<4>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Co)(C[6]C[6]H){1|H<1>,5|C<3>}	H(C[6]C[6]2)	119.7525	0.019	2	120.2477	0.108	56	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Co)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Co<6>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Co)(C[6]C[6]H){1|H<1>,1|N<2>,4|C<3>}	H(C[6]C[6]2)	120.2452	0.279	6	120.2477	0.108	56	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Co)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Co<6>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Co)(C[6]C[6]H){1|H<1>,5|C<3>}	H(C[6]C[6]2)	120.2607	0.327	47	120.2477	0.108	56	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Co)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Co<6>,1|N<3>,4|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Co)(C[6]C[6]H){1|C<2>,1|H<1>,4|C<3>}	H(C[6]C[6]2)	120.6440	0.000	1	120.2477	0.108	56	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Cr)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Cr<6>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Cr)(C[6]C[6]H){1|H<1>,5|C<3>}	H(C[6]C[6]2)	119.7917	0.904	3	119.7917	0.818	3	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Cu<4>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H){1|C<4>,1|H<1>,4|C<3>}	H(C[6]C[6]2)	119.9413	0.834	11	120.0949	0.214	57	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Cu<4>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H){1|H<1>,5|C<3>}	H(C[6]C[6]2)	120.1520	0.000	1	120.0949	0.214	57	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Cu<5>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H){1|H<1>,1|N<2>,4|C<3>}	H(C[6]C[6]2)	120.5618	0.224	4	120.0949	0.214	57	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Cu<5>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H){1|H<1>,5|C<3>}	H(C[6]C[6]2)	120.1923	0.382	18	120.0949	0.214	57	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Cu<6>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]C[6]H){1|H<1>,5|C<3>}	H(C[6]C[6]2)	120.0086	0.204	23	120.0949	0.214	57	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Fe<6>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Fe)(C[6]C[6]H){1|H<1>,1|N<2>,4|C<3>}	H(C[6]C[6]2)	120.5960	0.321	4	120.0506	0.247	33	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Fe<6>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Fe)(C[6]C[6]H){1|H<1>,5|C<3>}	H(C[6]C[6]2)	120.0679	0.333	27	120.0506	0.247	33	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Fe<6>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Fe)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	118.7265	0.148	2	120.0506	0.247	33	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Hg)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Hg<4>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Hg)(C[6]C[6]H){1|H<1>,5|C<3>}	H(C[6]C[6]2)	119.5222	0.340	4	119.8202	0.167	10	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Hg)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Hg<5>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Hg)(C[6]C[6]H){1|H<1>,5|C<3>}	H(C[6]C[6]2)	120.0188	0.337	6	119.8202	0.167	10	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Ir<6>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ir)(C[6]C[6]H){1|H<1>,5|C<3>}	H(C[6]C[6]2)	120.1887	0.397	9	119.9128	0.199	18	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Ir<6>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ir)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.6370	0.308	9	119.9128	0.199	18	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Mg)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Mg<5>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Mg)(C[6]C[6]H){1|H<1>,5|C<3>}	H(C[6]C[6]2)	120.0725	0.292	2	120.1628	0.047	4	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Mg)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Mg<6>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Mg)(C[6]C[6]H){1|H<1>,5|C<3>}	H(C[6]C[6]2)	120.2530	0.150	2	120.1628	0.047	4	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Mn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Mn<5>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Mn)(C[6]C[6]H){1|H<1>,5|C<3>}	H(C[6]C[6]2)	120.1340	0.187	2	119.9993	0.217	21	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Mn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Mn<6>,1|H<1>,1|N<2>,1|N<3>,3|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Mn)(C[6]C[6]H){1|H<1>,5|C<3>}	H(C[6]C[6]2)	120.0960	0.215	2	119.9993	0.217	21	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Mn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Mn<6>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Mn)(C[6]C[6]H){1|H<1>,5|C<3>}	H(C[6]C[6]2)	119.9908	0.523	16	119.9993	0.217	21	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Mn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Mn<6>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Mn)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.6730	0.000	1	119.9993	0.217	21	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Mo)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Mo<6>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Mo)(C[6]C[6]H){1|H<1>,5|C<3>}	H(C[6]C[6]2)	118.5930	0.000	1	119.0025	0.335	2	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Mo)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Mo<7>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Mo)(C[6]C[6]H){1|H<1>,5|C<3>}	H(C[6]C[6]2)	119.4120	0.000	1	119.0025	0.335	2	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ni)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Ni<6>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ni)(C[6]C[6]H){1|H<1>,5|C<3>}	H(C[6]C[6]2)	119.9846	0.653	14	119.9846	0.426	14	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Os)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Os<6>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Os)(C[6]C[6]H){1|H<1>,5|C<3>}	H(C[6]C[6]2)	119.6065	0.227	2	119.6065	0.052	2	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Pd<4>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Pd)(C[6]C[6]H){1|H<1>,5|C<3>}	H(C[6]C[6]2)	119.6305	0.013	2	119.6305	0.000	2	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Pt<4>,1|H<1>,1|N<2>,1|N<3>,3|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H){1|H<1>,5|C<3>}	H(C[6]C[6]2)	120.3858	0.121	4	120.1023	0.351	63	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Pt<4>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H){1|H<1>,5|C<3>}	H(C[6]C[6]2)	120.1228	0.621	53	120.1023	0.351	63	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Pt<4>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.7272	0.411	4	120.1023	0.351	63	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Pt<6>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Pt)(C[6]C[6]H){1|H<1>,5|C<3>}	H(C[6]C[6]2)	119.7425	0.046	2	120.1023	0.351	63	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Re)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Re<6>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Re)(C[6]C[6]H){1|H<1>,5|C<3>}	H(C[6]C[6]2)	119.6423	0.377	7	119.5676	0.137	14	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Re)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Re<6>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Re)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.4930	0.376	7	119.5676	0.137	14	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Rh)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Rh<6>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Rh)(C[6]C[6]H){1|H<1>,5|C<3>}	H(C[6]C[6]2)	119.9710	0.000	1	119.9710	0.000	1	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Ru<6>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(C[6]C[6]H){1|H<1>,5|C<3>}	H(C[6]C[6]2)	120.0267	0.221	8	119.9327	0.055	12	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Ru<6>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Ru)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.7448	0.134	4	119.9327	0.055	12	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Sn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Sn<7>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Sn)(C[6]C[6]H){1|H<1>,5|C<3>}	H(C[6]C[6]2)	120.3100	0.016	2	120.3100	0.000	2	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Zn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Zn<4>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Zn)(C[6]C[6]H){1|H<1>,5|C<3>}	H(C[6]C[6]2)	119.5090	0.000	1	120.0532	0.152	82	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Zn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Zn<5>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Zn)(C[6]C[6]H){1|H<1>,5|C<3>}	H(C[6]C[6]2)	119.9696	0.266	56	120.0532	0.152	82	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Zn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Zn<6>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Zn)(C[6]C[6]H){1|H<1>,1|N<2>,4|C<3>}	H(C[6]C[6]2)	120.7270	0.080	3	120.0532	0.152	82	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Zn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Zn<6>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Zn)(C[6]C[6]H){1|H<1>,5|C<3>}	H(C[6]C[6]2)	120.1988	0.531	22	120.0532	0.152	82	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6]C[6]N[6])(N[6]N[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Ru<6>,1|N<2>,1|N<3>,4|C<3>}	C[6](C[6]C[6]N[6])(N[6]N[6]Ru)(C[6]C[6]H){1|H<1>,4|C<3>}	H(C[6]C[6]2)	120.1280	0.000	1	120.0710	0.006	2	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6]C[6]N[6])(N[6]N[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Ru<6>,1|N<3>,2|N<2>,3|C<3>}	C[6](C[6]C[6]N[6])(N[6]N[6]Ru)(C[6]C[6]H){1|H<1>,4|C<3>}	H(C[6]C[6]2)	120.0140	0.000	1	120.0710	0.006	2	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]N[6])(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Zn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]N[6])(H){1|Zn<5>,1|N<2>,1|N<3>,3|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Zn)(C[6]C[6]H){1|H<1>,1|N<2>,4|C<3>}	H(C[6]C[6]2)	120.8210	0.000	1	120.8210	0.000	1	120.2615	0.519	7858	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]N)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]C)(NHH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.4070	0.000	1	119.4070	0.000	1	119.9749	1.298	729	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(NHH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.2342	1.154	46	119.2472	1.281	48	119.9749	1.298	729	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(NHH){1|C<3>,2|C<4>}	H(C[6]C[6]2)	119.5465	0.257	2	119.2472	1.281	48	119.9749	1.298	729	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]B)(NC[6a]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]B)(NC[6a]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8790	0.007	2	119.8790	0.000	2	119.9749	1.298	729	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]B)(NIrC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|B<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]B)(NIrC){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.6290	0.000	1	119.6290	0.000	1	119.9749	1.298	729	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]B)(NMnC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|B<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]B)(NMnC){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9090	0.000	1	119.9090	0.000	1	119.9749	1.298	729	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]B)(NOsC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|B<3>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]B)(NOsC){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7040	0.000	1	119.7040	0.000	1	119.9749	1.298	729	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]B)(NOsH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|B<3>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]B)(NOsH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1670	0.000	1	120.1670	0.000	1	119.9749	1.298	729	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]B)(NRhC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|B<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]B)(NRhC){1|C<3>,2|H<1>}	H(C[6]C[6]2)	117.4420	0.000	1	117.4420	0.000	1	119.9749	1.298	729	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]B)(NRuC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|B<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]B)(NRuC){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.6990	0.000	1	119.6990	0.000	1	119.9749	1.298	729	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]C)(NCC){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1500	0.000	1	120.1500	0.000	1	119.9749	1.298	729	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]C)(NCH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0252	0.204	6	120.0252	0.042	6	119.9749	1.298	729	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(NC[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]C)(NC[6]H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5035	0.070	2	120.5035	0.005	2	119.9749	1.298	729	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(NC[6a]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]C)(NC[6a]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.5270	0.000	1	119.5270	0.000	1	119.9749	1.298	729	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]C)(NHH){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.3265	0.218	2	119.9437	0.092	23	119.9749	1.298	729	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]C)(NHH){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1853	0.154	6	119.9437	0.092	23	119.9749	1.298	729	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]C)(NHH){1|C<3>,1|H<1>,1|S<2>}	H(C[6]C[6]2)	120.1160	0.000	1	119.9437	0.092	23	119.9749	1.298	729	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]C)(NHH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7322	0.240	12	119.9437	0.092	23	119.9749	1.298	729	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,1|C<4>,1|I<1>}	C[6](C[6]C[6]H)(N[6]C[6]C)(NHH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9740	0.000	1	119.9437	0.092	23	119.9749	1.298	729	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,2|C<4>}	C[6](C[6]C[6]H)(N[6]C[6]C)(NHH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0630	0.000	1	119.9437	0.092	23	119.9749	1.298	729	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(NNiC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]C)(NNiC){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.4775	0.152	2	119.4775	0.023	2	119.9749	1.298	729	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(NPdC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]C)(NPdC){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.4520	0.000	1	119.4520	0.000	1	119.9749	1.298	729	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(NBH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(NBH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.9834	0.233	5	119.9834	0.054	5	119.9749	1.298	729	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(NCC){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2020	0.293	2	120.2020	0.086	2	119.9749	1.298	729	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Br<1>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(NCH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0730	0.000	1	119.8520	1.403	71	119.9749	1.298	729	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(NCH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2765	2.664	2	119.8520	1.403	71	119.9749	1.298	729	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(NCH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.9830	0.000	1	119.8520	1.403	71	119.9749	1.298	729	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(NCH){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.9350	0.544	3	119.8520	1.403	71	119.9749	1.298	729	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(NCH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7668	1.161	64	119.8520	1.403	71	119.9749	1.298	729	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(NCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(NCN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4800	0.101	3	120.4800	0.010	3	119.9749	1.298	729	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(NC[5a]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(NC[5a]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3755	0.011	2	120.3755	0.000	2	119.9749	1.298	729	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(NC[6a]2)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(NC[6a]2){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3720	0.000	1	120.3720	0.000	1	119.9749	1.298	729	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(NC[6a]C)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(NC[6a]C){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.6620	0.000	1	120.5300	0.035	2	119.9749	1.298	729	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(NC[6a]C)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(NC[6a]C){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3980	0.000	1	120.5300	0.035	2	119.9749	1.298	729	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(NC[6a]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(NC[6a]H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.7100	0.000	1	119.8147	1.529	28	119.9749	1.298	729	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(NC[6a]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(NC[6a]H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	117.2110	0.000	1	119.8147	1.529	28	119.9749	1.298	729	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(NC[6a]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(NC[6a]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8721	1.182	25	119.8147	1.529	28	119.9749	1.298	729	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(NC[6a]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(NC[6a]H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.0880	0.000	1	119.8147	1.529	28	119.9749	1.298	729	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Br<1>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(NHH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9931	0.246	15	119.8182	1.601	348	119.9749	1.298	729	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<2>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(NHH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	118.2980	2.208	2	119.8182	1.601	348	119.9749	1.298	729	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(NHH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.6533	1.165	38	119.8182	1.601	348	119.9749	1.298	729	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(N[6]C[6]H)(NHH){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1222	0.911	5	119.8182	1.601	348	119.9749	1.298	729	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(N[6]C[6]H)(NHH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3102	1.221	6	119.8182	1.601	348	119.9749	1.298	729	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(NHH){1|Br<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0977	0.170	6	119.8182	1.601	348	119.9749	1.298	729	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(NHH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.3990	0.219	40	119.8182	1.601	348	119.9749	1.298	729	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(NHH){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	119.8429	1.201	11	119.8182	1.601	348	119.9749	1.298	729	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(NHH){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9610	1.475	95	119.8182	1.601	348	119.9749	1.298	729	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(NHH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.5632	1.412	101	119.8182	1.601	348	119.9749	1.298	729	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(NHH){1|Cl<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0860	0.000	1	119.8182	1.601	348	119.9749	1.298	729	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(NHH){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0710	0.000	1	119.8182	1.601	348	119.9749	1.298	729	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cl<1>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(NHH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.3543	1.126	21	119.8182	1.601	348	119.9749	1.298	729	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(N[6]C[6]H)(NHH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.5552	1.217	6	119.8182	1.601	348	119.9749	1.298	729	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(NHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(NHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5415	0.169	2	120.5415	0.029	2	119.9749	1.298	729	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(NHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(NHP){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3495	0.098	2	120.3495	0.010	2	119.9749	1.298	729	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(NHS)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(NHS){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.8095	0.119	4	120.7172	0.034	6	119.9749	1.298	729	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(NHS)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(NHS){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5325	0.163	2	120.7172	0.034	6	119.9749	1.298	729	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(NZnN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(NZnN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8100	0.083	2	119.8100	0.007	2	119.9749	1.298	729	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(N[6]C[6]O)(NCH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	118.3130	0.000	1	119.8575	0.260	13	119.9749	1.298	729	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(N[6]C[6]O)(NCH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9862	0.220	12	119.8575	0.260	13	119.9749	1.298	729	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(NC[6]Ni)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(N[6]C[6]O)(NC[6]Ni){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.0757	0.230	4	119.0757	0.053	4	119.9749	1.298	729	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(NC[6a]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(N[6]C[6]O)(NC[6a]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8210	0.000	1	119.8210	0.000	1	119.9749	1.298	729	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(NPdC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(N[6]C[6]O)(NPdC){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.4437	0.132	4	119.4437	0.017	4	119.9749	1.298	729	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]W)(NCP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,1|H<1>,1|W<7>}	C[6](C[6]C[6]H)(N[6]C[6]W)(NCP){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.9540	0.078	4	120.9540	0.006	4	119.9749	1.298	729	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]W)(NC[6a]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,1|H<1>,1|W<6>}	C[6](C[6]C[6]H)(N[6]C[6]W)(NC[6a]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5530	0.000	1	120.5530	0.000	1	119.9749	1.298	729	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]W)(NC[6a]P)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,1|H<1>,1|W<7>}	C[6](C[6]C[6]H)(N[6]C[6]W)(NC[6a]P){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.1325	0.286	2	121.1325	0.082	2	119.9749	1.298	729	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]W)(NHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,1|H<1>,1|W<6>}	C[6](C[6]C[6]H)(N[6]C[6]W)(NHP){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8205	0.189	2	120.8205	0.036	2	119.9749	1.298	729	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]N[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cl<1>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(N[6]N[6]H)(NHH){1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5620	0.000	1	120.5620	0.000	1	119.9749	1.298	729	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]N)(H){1|C<2>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(NHH){1|C<3>,1|N<3>,1|S<1>}	H(C[6]C[6]2)	119.9665	0.132	2	119.9665	0.017	2	119.9749	1.298	729	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-3:	C[6]-3:	C[6](C[6]N[6]2)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(NHH)	H(C[6]C[6]2)	C[6](C[6]N[6]2)(C[6]N[6]N)(H){1|C<3>,1|O<2>,2|C<4>}	C[6](C[6]C[6]H)(N[6]C[6]O)(NHH){1|N<2>,2|N<3>}	H(C[6]C[6]2)	120.2660	0.000	1	120.2660	0.000	1	119.9749	1.298	729	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-3:	C[6]-3:	C[6](C[6]N[6]Cl)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]N[6]Cl)(C[6]N[6]N)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(NHH){1|Cl<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	121.9960	0.264	4	121.9960	0.070	4	119.9749	1.298	729	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-3:	C[6]-3:	C[6](C[6]N[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]B)(NHH)	H(C[6]C[6]2)	C[6](C[6]N[6]H)(C[6]N[6]N)(H){1|B<4>,1|C<3>,1|C<4>}	C[6](C[6]C[6]H)(N[6]C[6]B)(NHH){1|H<1>,1|N<3>,1|O<1>}	H(C[6]C[6]2)	117.1340	0.000	1	117.1340	0.000	1	119.9749	1.298	729	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-3:	C[6]-3:	C[6](C[6]N[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]N[6]H)(C[6]N[6]N)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(NHH){1|H<1>,1|N<3>,1|O<1>}	H(C[6]C[6]2)	120.7356	0.290	42	120.7717	0.211	91	119.9749	1.298	729	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-3:	C[6]-3:	C[6](C[6]N[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]N[6]H)(C[6]N[6]N)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(NHH){1|H<1>,1|N<2>,1|S<1>}	H(C[6]C[6]2)	119.8690	0.000	1	120.7717	0.211	91	119.9749	1.298	729	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-3:	C[6]-3:	C[6](C[6]N[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]N[6]H)(C[6]N[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(NHH){1|H<1>,1|N<3>,1|O<1>}	H(C[6]C[6]2)	120.8221	0.556	48	120.7717	0.211	91	119.9749	1.298	729	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-3:	C[6]-3:	C[6](C[6]N[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(NRuH)	H(C[6]C[6]2)	C[6](C[6]N[6]H)(C[6]N[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(NRuH){1|H<1>,1|N<3>,1|O<1>}	H(C[6]C[6]2)	120.1760	0.000	1	120.1760	0.000	1	119.9749	1.298	729	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-3:	C[6]-3:	C[6](C[6]N[6]N)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]N[6]N)(C[6]N[6]O)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(NHH){1|O<1>,2|N<3>}	H(C[6]C[6]2)	119.9685	0.098	4	119.9685	0.010	4	119.9749	1.298	729	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-3:	C[6]-3:	C[6](C[6]N[6]N)2(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]N[6]N)2(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(NHH){1|C<4>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	121.2690	0.000	1	120.6540	0.248	26	119.9749	1.298	729	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-3:	C[6]-3:	C[6](C[6]N[6]N)2(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]N[6]N)2(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(NHH){1|N<2>,1|N<3>,1|S<1>}	H(C[6]C[6]2)	120.3732	1.202	4	120.6540	0.248	26	119.9749	1.298	729	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-3:	C[6]-3:	C[6](C[6]N[6]N)2(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]N[6]N)2(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(NHH){1|N<2>,2|N<3>}	H(C[6]C[6]2)	120.8710	0.113	4	120.6540	0.248	26	119.9749	1.298	729	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-3:	C[6]-3:	C[6](C[6]N[6]N)2(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]N[6]N)2(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(NHH){1|N<3>,2|N<2>}	H(C[6]C[6]2)	120.8050	0.000	2	120.6540	0.248	26	119.9749	1.298	729	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-3:	C[6]-3:	C[6](C[6]N[6]N)2(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]N[6]N)2(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(NHH){1|N<2>,2|N<3>}	H(C[6]C[6]2)	120.6660	0.000	1	120.6540	0.248	26	119.9749	1.298	729	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-3:	C[6]-3:	C[6](C[6]N[6]N)2(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]N[6]N)2(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(NHH){3|N<3>}	H(C[6]C[6]2)	120.6059	0.257	14	120.6540	0.248	26	119.9749	1.298	729	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]2)(H)	C[6](C[6]C[6]H)(N[6]C[6]2)(N[6]C[6]C)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]2)(H){1|C<3>,1|H<1>,3|C<4>}	C[6](C[6]C[6]H)(N[6]C[6]2)(N[6]C[6]C){1|C<3>,2|C<4>,6|H<1>}	H(C[6]C[6]2)	119.9545	0.385	2	119.9545	0.149	2	119.8738	0.070	4	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]2)(H)	C[6](C[6]C[6]H)(N[6]C[6]2)(N[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]2)(H){1|C<3>,1|H<1>,1|N<3>,2|C<4>}	C[6](C[6]C[6]H)(N[6]C[6]2)(N[6]C[6]H){1|C<3>,2|C<4>,6|H<1>}	H(C[6]C[6]2)	119.6600	0.000	1	119.6600	0.000	1	119.8738	0.070	4	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]2)(H)	C[6](C[6]C[6]H)(N[6]C[6]2)(N[6]C[6]V)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]2)(H){1|C<3>,1|H<1>,1|V<7>,2|C<4>}	C[6](C[6]C[6]H)(N[6]C[6]2)(N[6]C[6]V){2|C<3>,2|C<4>,5|H<1>}	H(C[6]C[6]2)	119.9260	0.000	1	119.9260	0.000	1	119.8738	0.070	4	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:S-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(SCu2)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(SCu2){1|C<3>,2|H<1>}	H(C[6]C[6]2)	117.9230	2.485	4	117.9230	6.176	4	117.9230	6.176	4	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:P[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]P[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]P[6])(P[6]C[6]Mn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]P[6])(C[6]C[6]C)(H){1|Mn<5>,1|C<4>,1|P<3>,2|C<3>}	C[6](C[6]C[6]P[6])(P[6]C[6]Mn)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	117.2225	0.030	2	117.2225	0.001	2	116.7978	0.465	9	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:P[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]P[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]P[6])(P[6]C[6]Sm)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]P[6])(C[6]C[6]C)(H){1|Sm<12>,1|C<4>,1|P<3>,2|C<3>}	C[6](C[6]C[6]P[6])(P[6]C[6]Sm)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	115.7970	0.000	1	115.9255	0.033	2	116.7978	0.465	9	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:P[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]P[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]P[6])(P[6]C[6]Sm)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]P[6])(C[6]C[6]C)(H){1|Sm<12>,1|P<3>,3|C<3>}	C[6](C[6]C[6]P[6])(P[6]C[6]Sm)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	116.0540	0.000	1	115.9255	0.033	2	116.7978	0.465	9	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:P[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]P[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]P[6])(P[6]C[6]Tm)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]P[6])(C[6]C[6]C)(H){1|Tm<12>,1|C<4>,1|P<3>,2|C<3>}	C[6](C[6]C[6]P[6])(P[6]C[6]Tm)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	116.6000	0.286	2	116.6000	0.082	2	116.7978	0.465	9	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:P[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]P[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]P[6])(P[6]C[6]Yb)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]P[6])(C[6]C[6]C)(H){1|Yb<12>,1|C<4>,1|P<3>,2|C<3>}	C[6](C[6]C[6]P[6])(P[6]C[6]Yb)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	116.8700	0.569	2	116.8700	0.323	2	116.7978	0.465	9	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:P[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]P[6])(H)	C[6](C[6]C[6]N[6])(P[6]C[6]Mo)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]P[6])(H){1|Mo<6>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6]C[6]N[6])(P[6]C[6]Mo)(C[6]C[6]H){1|H<1>,5|C<3>}	H(C[6]C[6]2)	117.9440	0.000	1	117.9440	0.000	1	116.7978	0.465	9	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6,6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6]C[6a])(C[6]C[6]O)(H)	C[6](C[6a]C[6,6a]C[6a])(C[6,6]C[6,6]C[6])(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]C[6a])(C[6]C[6]O)(H){1|C<4>,1|O<1>,3|C<3>}	C[6](C[6a]C[6,6a]C[6a])(C[6,6]C[6,6]C[6])(C[6]C[6]H){1|O<2>,3|C<3>,3|C<4>,3|H<1>}	H(C[6]C[6]2)	120.1350	0.000	1	120.1350	0.000	1	120.1350	0.000	1	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6a]C[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6a]C[6])(H){1|Pt<4>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|H<1>,1|N<3>,2|C<4>,3|C<3>}	H(C[6]C[6]2)	120.1030	0.000	1	119.5487	0.283	3	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6a]C[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6a]C[6])(H){1|Re<6>,1|H<1>,1|N<2>,1|S<2>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.2715	0.323	2	119.5487	0.283	3	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6a]C[6])(H)	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6a]C[6])(H){1|Re<6>,1|H<1>,1|S<2>,2|C<3>,2|N<2>}	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)2{1|H<1>,1|N<3>,4|C<3>}	H(C[6]C[6]2)	119.1770	0.000	1	119.1770	0.000	1	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[5]N[6])(H)	C[6](C[6a]C[6a,6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[5]N[6])(H){1|Pt<4>,1|H<1>,1|N<3>,1|S<2>,3|C<3>}	C[6](C[6a]C[6a,6a]2)(C[6]C[6]H)2{1|N<3>,6|C<3>}	H(C[6]C[6]2)	120.2735	0.203	2	120.2735	0.041	2	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[5]N[6])(H)	C[6](C[6a]C[6a,6a]C[6a])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[5]N[6])(H){1|Cu<5>,1|H<1>,1|N<3>,1|S<2>,3|C<3>}	C[6](C[6a]C[6a,6a]C[6a])(C[6]C[6]H)2{1|H<1>,1|N<3>,5|C<3>}	H(C[6]C[6]2)	120.4695	0.455	2	120.4695	0.207	2	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[5]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]C)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[5]N[6])(H){1|C<2>,1|N<3>,5|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]C)(C[6]C[6]H){2|H<1>,2|N<3>,3|C<3>}	H(C[6]C[6]2)	118.6955	0.531	2	118.6955	0.282	2	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[5]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[5]N[6])(H){1|Co<6>,1|H<1>,1|N<3>,1|O<2>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.5056	0.341	11	120.4352	0.259	17	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[5]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[5]N[6])(H){1|Fe<6>,1|H<1>,1|N<3>,1|O<2>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<2>,1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.7502	0.134	4	120.4352	0.259	17	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[5]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[5]N[6])(H){1|Re<6>,1|H<1>,1|N<3>,1|S<2>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.4175	0.633	2	120.4352	0.259	17	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[5]N[6])(H)	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[5]N[6])(H){1|Re<6>,1|H<1>,1|N<2>,1|N<3>,1|S<2>,2|C<3>}	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)2{1|H<1>,1|N<3>,4|C<3>}	H(C[6]C[6]2)	120.3830	0.000	1	120.3830	0.000	1	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]C)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]C[6]O)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]C)(H){1|H<1>,1|O<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]C[6]O){1|C<4>,1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	118.8430	0.000	1	118.6155	0.104	2	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]C)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]C[6]O)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]C)(H){1|H<1>,1|O<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]C[6]O){2|H<1>,5|C<3>}	H(C[6]C[6]2)	118.3880	0.000	1	118.6155	0.104	2	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]C)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]N)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]C)(H){1|N<2>,2|C<3>,2|N<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]N){1|C<2>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	117.9830	0.000	1	117.9830	0.000	1	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]C)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]C)(H){1|H<1>,1|O<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{2|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	118.6645	0.060	2	118.6686	0.086	10	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]C)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]C)(H){1|H<1>,1|O<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{3|H<1>,4|C<3>}	H(C[6]C[6]2)	118.6670	0.000	1	118.6686	0.086	10	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]C)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]C)(H){1|U<10>,1|H<1>,1|O<2>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{2|C<3>,2|H<1>,3|C<4>}	H(C[6]C[6]2)	118.6700	0.359	7	118.6686	0.086	10	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]F)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]C[6]O)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]F)(H){1|H<1>,1|O<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]C[6]O){1|F<1>,1|H<1>,1|O<2>,4|C<3>}	H(C[6]C[6]2)	120.8795	0.996	2	120.8795	0.993	2	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a,6a]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6a]C[6a,6a]2)(C[6]C[6]H)(C[6]N[6]H){1|Pt<4>,1|H<1>,5|C<3>}	H(C[6]C[6]2)	119.9423	0.587	6	119.9423	0.345	6	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a,6a]C[6a])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,1|O<1>,3|C<3>}	C[6](C[6a]C[6a,6a]C[6a])(C[6]C[6]H)2{1|I<1>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.3450	0.420	2	119.3450	0.176	2	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]C[6]O)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,1|O<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]C[6]O){1|O<2>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	118.4380	0.177	2	118.6007	0.058	6	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]C[6]O)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,1|O<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]C[6]O){1|O<2>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	118.7933	0.125	3	118.6007	0.058	6	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]C[6]O)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,1|O<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]C[6]O){3|H<1>,4|C<3>}	H(C[6]C[6]2)	118.3480	0.000	1	118.6007	0.058	6	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H){1|Mn<6>,1|H<1>,2|C<4>,3|C<3>}	H(C[6]C[6]2)	120.3000	0.526	2	119.8944	0.188	76	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H){1|Ni<6>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.0323	0.092	3	119.8944	0.188	76	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H){1|Ir<8>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.1875	0.112	2	119.8944	0.188	76	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H){1|Cd<6>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.3390	0.000	1	119.8944	0.188	76	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H){1|Co<4>,1|H<1>,2|C<4>,3|C<3>}	H(C[6]C[6]2)	120.3222	0.470	6	119.8944	0.188	76	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H){1|Co<6>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.1390	0.079	2	119.8944	0.188	76	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H){1|Co<6>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.6910	0.000	1	119.8944	0.188	76	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H){1|Cu<4>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.9748	0.281	9	119.8944	0.188	76	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H){1|Fe<6>,1|C<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.4030	0.000	1	119.8944	0.188	76	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H){1|Ir<6>,1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.5722	0.296	6	119.8944	0.188	76	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H){1|Ir<6>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.9147	0.243	3	119.8944	0.188	76	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H){1|Mn<6>,1|O<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.2920	0.000	1	119.8944	0.188	76	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H){1|Mn<6>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.3280	0.000	1	119.8944	0.188	76	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H){1|Mn<6>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.2130	0.000	1	119.8944	0.188	76	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H){1|Ni<6>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.1320	0.000	1	119.8944	0.188	76	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H){1|Ni<6>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.8520	0.000	1	119.8944	0.188	76	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H){1|Pd<4>,1|H<1>,2|C<4>,3|C<3>}	H(C[6]C[6]2)	119.4865	0.067	2	119.8944	0.188	76	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H){1|Pt<4>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.7792	0.379	5	119.8944	0.188	76	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H){1|Ru<6>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.1360	0.286	4	119.8944	0.188	76	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H){1|Ni<6>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.4100	0.241	4	119.8944	0.188	76	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H){3|C<3>,4|H<1>}	H(C[6]C[6]2)	118.9060	0.423	2	119.8944	0.188	76	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H){1|Fe<6>,1|N<2>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	120.3790	0.008	2	119.8944	0.188	76	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H){1|Pd<4>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.8859	0.461	7	119.8944	0.188	76	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H){1|Pt<6>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.9155	0.432	2	119.8944	0.188	76	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H){1|Zn<6>,1|C<3>,2|N<2>,3|H<1>}	H(C[6]C[6]2)	120.0360	0.000	1	119.8944	0.188	76	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H){3|C<3>,4|H<1>}	H(C[6]C[6]2)	119.4670	0.242	6	119.8944	0.188	76	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]N)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]N){1|Pd<4>,1|H<1>,2|C<4>,3|C<3>}	H(C[6]C[6]2)	119.3437	0.287	3	119.3437	0.082	3	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]O[6]N)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|N<2>,1|O<2>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]O[6]N){3|C<3>,3|H<1>}	H(C[6]C[6]2)	118.4030	0.000	1	118.4030	0.000	1	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|C<2>,2|C<3>,2|H<1>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|P<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	121.4970	0.000	1	119.5370	1.522	5	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,3|C<3>,4|H<1>}	H(C[6]C[6]2)	120.0070	0.000	1	119.5370	1.522	5	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,1|O<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{3|C<3>,4|H<1>}	H(C[6]C[6]2)	118.8220	0.040	2	119.5370	1.522	5	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,1|O<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{3|H<1>,4|C<3>}	H(C[6]C[6]2)	118.5370	0.000	1	119.5370	1.522	5	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]Ta)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|Ta<10>,1|C<4>,1|H<1>,2|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]Ta)(C[6]C[6]H){1|C<4>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.2090	0.000	1	119.2090	0.000	1	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)(C[6]N[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.4600	0.000	1	119.9288	0.188	8	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|C<3>,1|N<2>,1|N<3>,2|H<1>}	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)(C[6]N[6]H){1|Co<6>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.3590	0.000	1	119.9288	0.188	8	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|C<3>,1|N<2>,1|N<3>,2|H<1>}	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)(C[6]N[6]H){1|Cu<5>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.4770	0.000	1	119.9288	0.188	8	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|C<3>,1|N<2>,1|N<3>,2|H<1>}	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)(C[6]N[6]H){1|Mn<6>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.4170	0.000	1	119.9288	0.188	8	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|C<3>,1|N<2>,1|N<3>,2|H<1>}	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)(C[6]N[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.6797	0.245	3	119.9288	0.188	8	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)(C[6]N[6]H){1|Pt<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.6780	0.000	1	119.9288	0.188	8	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6a]N[6a]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|N<3>,2|H<1>,2|N<2>}	C[6](C[6a]N[6a]2)(C[6]C[6]H)(C[6]N[6]H){1|Re<6>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.6297	0.474	6	120.6877	0.253	12	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6a]N[6a]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|N<3>,2|H<1>,2|N<2>}	C[6](C[6a]N[6a]2)(C[6]C[6]H)(C[6]N[6]H){1|Ru<9>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.7457	0.568	6	120.6877	0.253	12	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6a]C[6,6a]C[6a])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Pt<4>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6a]C[6,6a]C[6a])(C[6]C[6]H)2{1|H<1>,1|N<3>,1|O<2>,4|C<3>}	H(C[6]C[6]2)	120.5812	0.396	6	120.5812	0.157	6	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6a]C[6a,6a]C[6a])(C[6]C[6]H)(C[6]C[6]O)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|H<1>,1|O<1>,5|C<3>}	C[6](C[6a]C[6a,6a]C[6a])(C[6]C[6]H)(C[6]C[6]O){1|H<1>,1|N<3>,5|C<3>}	H(C[6]C[6]2)	119.8010	0.277	2	119.8010	0.077	2	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6a]C[6a,6a]C[6a])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Au<4>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6a]C[6a,6a]C[6a])(C[6]C[6]H)2{1|H<1>,1|N<3>,5|C<3>}	H(C[6]C[6]2)	119.8515	0.105	2	120.3395	0.292	13	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6a]C[6a,6a]C[6a])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Co<6>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6a]C[6a,6a]C[6a])(C[6]C[6]H)2{1|H<1>,1|N<3>,5|C<3>}	H(C[6]C[6]2)	121.1990	0.673	2	120.3395	0.292	13	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6a]C[6a,6a]C[6a])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Cu<5>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6a]C[6a,6a]C[6a])(C[6]C[6]H)2{1|H<1>,1|N<3>,5|C<3>}	H(C[6]C[6]2)	120.4355	0.153	2	120.3395	0.292	13	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6a]C[6a,6a]C[6a])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Pt<4>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6a]C[6a,6a]C[6a])(C[6]C[6]H)2{1|H<1>,1|N<3>,5|C<3>}	H(C[6]C[6]2)	120.2487	0.410	6	120.3395	0.292	13	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6a]C[6a,6a]C[6a])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Re<6>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6a]C[6a,6a]C[6a])(C[6]C[6]H)2{1|N<3>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.9490	0.000	1	120.3395	0.292	13	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]C[6]O)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|H<1>,1|O<1>,5|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]C[6]O){1|N<3>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.5917	0.150	11	119.5917	0.022	11	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Ag<4>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.9617	0.147	4	120.0345	0.220	407	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Al<5>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.4145	0.023	2	120.0345	0.220	407	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Cd<5>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.7862	0.274	11	120.0345	0.220	407	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Cd<6>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.0128	0.291	10	120.0345	0.220	407	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Co<4>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.7240	0.047	2	120.0345	0.220	407	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Co<6>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|H<1>,1|N<3>,1|O<2>,4|C<3>}	H(C[6]C[6]2)	120.4033	0.106	6	120.0345	0.220	407	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Co<6>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.1889	0.203	45	120.0345	0.220	407	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Cr<6>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.6657	0.709	3	120.0345	0.220	407	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Cu<4>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|C<4>,1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.0969	0.931	12	120.0345	0.220	407	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Cu<4>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.2540	0.000	1	120.0345	0.220	407	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Cu<5>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.2829	0.403	20	120.0345	0.220	407	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Cu<6>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<2>,1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.0535	0.067	4	120.0345	0.220	407	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Cu<6>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.9426	0.212	17	120.0345	0.220	407	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Fe<6>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|C<2>,1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.8550	0.601	2	120.0345	0.220	407	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Fe<6>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<2>,1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.4060	0.290	4	120.0345	0.220	407	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Fe<6>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.1706	0.327	26	120.0345	0.220	407	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|H<1>,1|N<3>,1|W<6>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.3834	0.417	5	120.0345	0.220	407	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Hg<4>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.5100	0.282	4	120.0345	0.220	407	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Hg<5>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.0385	0.384	6	120.0345	0.220	407	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Ir<6>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|H<1>,1|O<1>,2|N<3>,3|C<3>}	H(C[6]C[6]2)	119.7980	0.000	1	120.0345	0.220	407	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Ir<6>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.2122	0.440	8	120.0345	0.220	407	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Ir<6>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.6149	0.294	8	120.0345	0.220	407	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Mg<5>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,2|C<4>,4|C<3>}	H(C[6]C[6]2)	120.0695	0.305	2	120.0345	0.220	407	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Mg<6>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|H<1>,1|N<3>,1|S<4>,4|C<3>}	H(C[6]C[6]2)	120.1550	0.123	2	120.0345	0.220	407	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Mn<5>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.1775	0.207	2	120.0345	0.220	407	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Mn<6>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,1|O<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.6880	0.000	1	120.0345	0.220	407	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Mn<6>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,2|C<4>,4|C<3>}	H(C[6]C[6]2)	120.1977	0.998	4	120.0345	0.220	407	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Mn<6>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.8894	0.263	13	120.0345	0.220	407	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Mo<6>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	121.0600	0.000	1	120.0345	0.220	407	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Mo<7>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.4550	0.069	2	120.0345	0.220	407	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Ni<6>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<2>,1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.8700	0.100	2	120.0345	0.220	407	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Ni<6>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.9859	0.788	11	120.0345	0.220	407	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Os<6>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.5715	0.202	2	120.0345	0.220	407	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Pd<4>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.6065	0.059	2	120.0345	0.220	407	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Pt<4>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|C<4>,1|H<1>,1|N<3>,4|C<3>}	H(C[6]C[6]2)	120.2095	0.006	2	120.0345	0.220	407	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Pt<4>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|Cl<1>,1|H<1>,1|N<3>,4|C<3>}	H(C[6]C[6]2)	120.1176	0.568	14	120.0345	0.220	407	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Pt<4>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|H<1>,1|N<3>,2|C<4>,3|C<3>}	H(C[6]C[6]2)	119.9405	0.105	2	120.0345	0.220	407	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Pt<4>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.0700	0.714	27	120.0345	0.220	407	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Pt<4>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.7315	0.197	2	120.0345	0.220	407	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Pt<6>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.8170	0.038	2	120.0345	0.220	407	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Re<6>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.6604	0.321	7	120.0345	0.220	407	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Re<6>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.4955	0.349	6	120.0345	0.220	407	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Rh<6>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.9140	0.000	1	120.0345	0.220	407	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Ru<6>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.0584	0.272	9	120.0345	0.220	407	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Ru<6>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.7470	0.162	4	120.0345	0.220	407	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Sn<7>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.3210	0.024	2	120.0345	0.220	407	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Zn<4>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.5800	0.000	1	120.0345	0.220	407	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Zn<5>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.9540	0.265	53	120.0345	0.220	407	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Zn<6>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|C<4>,1|H<1>,1|N<3>,4|C<3>}	H(C[6]C[6]2)	120.5920	0.414	4	120.0345	0.220	407	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Zn<6>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.1420	0.587	24	120.0345	0.220	407	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){2|Cu<4>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<4>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.6395	0.124	2	120.0345	0.220	407	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Cd<5>,1|H<1>,1|N<2>,1|N<3>,3|C<3>}	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)2{1|H<1>,1|N<3>,4|C<3>}	H(C[6]C[6]2)	119.8890	0.098	2	120.2195	0.067	8	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Mn<6>,1|H<1>,1|N<2>,1|N<3>,3|C<3>}	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)2{1|H<1>,1|N<3>,4|C<3>}	H(C[6]C[6]2)	120.1890	0.291	2	120.2195	0.067	8	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Pt<4>,1|H<1>,1|N<2>,1|N<3>,3|C<3>}	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)2{1|H<1>,1|N<3>,4|C<3>}	H(C[6]C[6]2)	120.4000	0.089	4	120.2195	0.067	8	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6a]C[6a]N[6a])(C[6]C[6a]N[6])(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Ru<6>,1|N<3>,2|N<2>,3|C<3>}	C[6](C[6a]C[6a]N[6a])(C[6]C[6a]N[6])(C[6]C[6]H){1|H<1>,1|N<2>,1|N<3>,4|C<3>}	H(C[6]C[6]2)	120.1220	0.000	1	120.1220	0.000	1	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]O)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]C[6]O)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]O)(H){1|Br<1>,1|O<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]C[6]O){1|O<1>,1|O<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	118.4600	0.000	1	119.1442	2.057	5	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]O)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]C[6]O)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]O)(H){1|C<2>,1|O<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]C[6]O){1|C<2>,1|H<1>,1|O<1>,1|O<2>,3|C<3>}	H(C[6]C[6]2)	118.4830	0.000	1	119.1442	2.057	5	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]O)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]C[6]O)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]O)(H){1|H<1>,1|O<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]C[6]O){1|O<1>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	118.5365	0.161	2	119.1442	2.057	5	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]O)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]C[6]O)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]O)(H){1|O<1>,1|O<2>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]C[6]O){1|O<2>,2|C<3>,2|H<1>,2|O<1>}	H(C[6]C[6]2)	121.7050	0.000	1	119.1442	2.057	5	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]P[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]P[6])(H){1|H<1>,1|N<3>,1|W<6>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|P<3>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	117.5585	0.250	4	117.6202	0.066	5	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]P[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]P[6])(H){1|Mo<6>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|P<3>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	117.8670	0.000	1	117.6202	0.066	5	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H){1|Au<4>,1|H<1>,5|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|F<1>,1|H<1>,1|N<3>,4|C<3>}	H(C[6]C[6]2)	120.2275	0.039	2	119.3501	0.271	144	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H){1|Au<4>,1|H<1>,5|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.3790	0.486	3	119.3501	0.271	144	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H){1|C<4>,1|H<1>,5|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	118.9895	0.073	2	119.3501	0.271	144	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H){1|C<4>,1|H<1>,5|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,3|H<1>,4|C<3>}	H(C[6]C[6]2)	118.9410	0.000	1	119.3501	0.271	144	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H){1|Cd<6>,1|H<1>,5|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.9050	0.148	2	119.3501	0.271	144	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H){1|Co<6>,1|H<1>,5|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.2225	0.115	2	119.3501	0.271	144	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H){1|Cr<6>,1|H<1>,5|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	121.5740	0.000	1	119.3501	0.271	144	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H){1|Cu<4>,1|H<1>,1|N<2>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.6230	0.000	1	119.3501	0.271	144	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H){1|H<1>,1|N<3>,5|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	118.6085	0.220	2	119.3501	0.271	144	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H){1|H<1>,1|W<6>,5|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.3138	0.252	6	119.3501	0.271	144	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H){1|H<1>,6|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.1084	0.177	23	119.3501	0.271	144	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H){1|Hg<4>,1|H<1>,5|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.4415	0.466	4	119.3501	0.271	144	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H){1|Ir<6>,1|H<1>,1|N<2>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|H<1>,1|O<1>,2|N<3>,3|C<3>}	H(C[6]C[6]2)	119.4250	0.000	1	119.3501	0.271	144	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H){1|Ir<6>,1|H<1>,5|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|C<4>,1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.4235	0.238	4	119.3501	0.271	144	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H){1|Ir<6>,1|H<1>,5|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|H<1>,1|N<3>,2|C<4>,3|C<3>}	H(C[6]C[6]2)	119.2130	0.608	37	119.3501	0.271	144	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H){1|Ir<6>,1|H<1>,5|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.4004	0.465	10	119.3501	0.271	144	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H){1|Mn<6>,1|H<1>,1|N<2>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.4150	0.000	1	119.3501	0.271	144	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H){1|Mo<6>,1|H<1>,5|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.1310	0.000	1	119.3501	0.271	144	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H){1|Os<7>,1|H<1>,5|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	118.7320	0.000	1	119.3501	0.271	144	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H){1|Pt<4>,1|H<1>,1|N<2>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.7300	0.079	2	119.3501	0.271	144	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H){1|Pt<4>,1|H<1>,5|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.5597	0.551	23	119.3501	0.271	144	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H){1|Pt<4>,1|H<1>,5|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.3030	0.000	1	119.3501	0.271	144	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H){1|Pt<6>,1|H<1>,1|N<2>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.2920	0.153	2	119.3501	0.271	144	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H){1|Re<6>,1|H<1>,1|N<2>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.4582	0.426	5	119.3501	0.271	144	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H){1|Rh<6>,1|H<1>,5|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.6260	0.000	1	119.3501	0.271	144	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H){1|Ru<6>,1|H<1>,1|N<2>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.1210	0.000	1	119.3501	0.271	144	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H){1|Zn<4>,1|H<1>,5|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.4470	0.000	1	119.3501	0.271	144	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H){2|H<1>,5|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.5260	0.261	4	119.3501	0.271	144	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H)	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H){1|Mn<6>,1|H<1>,1|N<2>,4|C<3>}	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)2{1|H<1>,1|N<3>,4|C<3>}	H(C[6]C[6]2)	119.9135	0.603	2	119.9135	0.364	2	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6a]O[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]C)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6a]O[6])(H){1|C<4>,5|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]C)(C[6]C[6]H){1|O<2>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.5510	0.144	2	119.5510	0.021	2	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6a]O[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6a]O[6])(H){1|H<1>,1|N<2>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|O<2>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.6610	0.095	2	119.4224	0.133	16	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6a]O[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6a]O[6])(H){1|H<1>,5|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|O<2>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.3884	0.378	14	119.4224	0.133	16	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6a]P[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]C)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6a]P[6])(H){1|Cu<4>,1|C<4>,5|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]C)(C[6]C[6]H){1|P<3>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	116.5660	0.190	3	116.5660	0.036	3	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6a]P[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6a]P[6])(H){1|Au<2>,1|H<1>,5|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|O<1>,1|P<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	116.8560	0.000	1	117.0724	0.263	19	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6a]P[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6a]P[6])(H){1|H<1>,1|W<6>,5|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|P<3>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	116.9667	0.412	10	117.0724	0.263	19	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6a]P[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6a]P[6])(H){1|H<1>,5|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|O<2>,1|P<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	117.7810	0.000	1	117.0724	0.263	19	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6a]P[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6a]P[6])(H){1|H<1>,5|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|P<2>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	117.2235	0.088	2	117.0724	0.263	19	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6a]P[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6a]P[6])(H){1|Ir<8>,1|H<1>,5|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|P<3>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	117.2100	0.969	2	117.0724	0.263	19	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6a]P[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6a]P[6])(H){1|Mo<6>,1|H<1>,5|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|P<3>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	116.6420	0.000	1	117.0724	0.263	19	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6a]P[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6a]P[6])(H){1|Rh<8>,1|H<1>,5|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|P<3>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	117.2810	1.117	2	117.0724	0.263	19	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6a]S[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6a]S[6])(H){1|C<4>,1|H<1>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|C<4>,1|S<2>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	118.1290	0.000	1	118.1290	0.000	1	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[5]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[5]N[6])(H){1|Fe<6>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{2|C<3>,2|H<1>,3|N<3>}	H(C[6]C[6]2)	120.9095	0.415	4	120.9095	0.172	4	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[5]N[6])(H)	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[5]N[6])(H){1|Ru<6>,1|H<1>,1|N<2>,4|C<3>}	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)2{1|H<1>,2|C<3>,3|N<3>}	H(C[6]C[6]2)	120.2957	0.429	4	120.2957	0.184	4	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]C)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]C)(H){1|C<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{2|C<4>,2|O<1>,3|N<3>}	H(C[6]C[6]2)	118.5298	0.091	6	119.5984	0.444	37	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]C)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]C)(H){1|Co<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|C<4>,1|N<3>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	119.9200	0.000	1	119.5984	0.444	37	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]C)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]C)(H){1|Cu<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|C<4>,1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.7563	0.574	11	119.5984	0.444	37	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]C)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]C)(H){1|Cu<5>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,2|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.9355	0.194	2	119.5984	0.444	37	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]C)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]C)(H){1|H<1>,1|O<2>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,2|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.1850	0.038	2	119.5984	0.444	37	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]C)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]C)(H){1|Mn<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.3470	0.000	1	119.5984	0.444	37	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]C)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]C)(H){1|Mo<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,2|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.4110	0.221	5	119.5984	0.444	37	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]C)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]C)(H){1|Ni<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|C<4>,1|N<3>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	119.3640	0.000	1	119.5984	0.444	37	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]C)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]C)(H){1|Ni<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.1900	0.000	1	119.5984	0.444	37	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]C)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]C)(H){1|Zn<5>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|H<1>,1|N<3>,5|C<3>}	H(C[6]C[6]2)	120.3820	0.343	3	119.5984	0.444	37	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]C)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]C)(H){1|Zn<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|C<4>,1|N<3>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	119.8140	0.000	1	119.5984	0.444	37	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]C)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]C)(H){1|Zn<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.4175	0.107	2	119.5984	0.444	37	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]C)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]C)(H){2|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|C<4>,1|F<1>,1|H<1>,1|N<3>,1|O<2>,2|C<3>}	H(C[6]C[6]2)	119.7310	0.000	1	119.5984	0.444	37	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](C[6a]C[6a,6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|C<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a,6a]2)(C[6]C[6]H)2{1|N<3>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.8423	0.046	4	119.8423	0.002	4	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](C[6a]C[6a,6a]C[6a])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|C<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a,6a]C[6a])(C[6]C[6]H)2{1|N<3>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.9188	0.155	14	119.7978	0.142	22	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](C[6a]C[6a,6a]C[6a])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|H<1>,1|O<1>,3|C<3>}	C[6](C[6a]C[6a,6a]C[6a])(C[6]C[6]H)2{1|N<3>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.3083	0.501	4	119.7978	0.142	22	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](C[6a]C[6a,6a]C[6a])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Re<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a,6a]C[6a])(C[6]C[6]H)2{1|N<3>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.1480	0.000	1	119.7978	0.142	22	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](C[6a]C[6a,6a]C[6a])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){2|H<1>,3|C<3>}	C[6](C[6a]C[6a,6a]C[6a])(C[6]C[6]H)2{1|N<3>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.1023	0.160	3	119.7978	0.142	22	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]C)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|H<1>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]C)(C[6]C[6]H){1|N<3>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.9315	0.049	2	119.8127	0.044	3	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]C)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Rh<6>,1|C<4>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]C)(C[6]C[6]H){1|N<3>,2|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.5750	0.000	1	119.8127	0.044	3	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|C<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	119.7294	0.748	144	119.8894	0.658	663	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|C<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	118.7815	0.137	6	119.8894	0.658	663	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Cd<5>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	120.1365	0.067	2	119.8894	0.658	663	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Co<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|C<4>,1|N<3>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	119.4590	0.000	1	119.8894	0.658	663	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Co<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	119.9340	0.225	38	119.8894	0.658	663	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Cu<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	119.8880	0.883	8	119.8894	0.658	663	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Cu<5>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	120.3029	0.304	8	119.8894	0.658	663	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Cu<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	119.8540	0.354	4	119.8894	0.658	663	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Fe<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|C<2>,1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.4700	2.309	2	119.8894	0.658	663	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Fe<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	120.1811	2.495	7	119.8894	0.658	663	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Ga<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	119.8957	0.454	3	119.8894	0.658	663	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|H<1>,1|O<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	119.2541	0.411	48	119.8894	0.658	663	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|H<1>,1|S<2>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	119.5180	0.000	1	119.8894	0.658	663	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|H<1>,1|W<6>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	119.2860	0.000	1	119.8894	0.658	663	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|H<1>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	120.1870	1.230	16	119.8894	0.658	663	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Hg<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	118.4495	0.203	2	119.8894	0.658	663	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Ir<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|C<4>,1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.1312	0.226	4	119.8894	0.658	663	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Ir<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|H<1>,1|N<3>,2|C<4>,3|C<3>}	H(C[6]C[6]2)	120.1326	0.597	37	119.8894	0.658	663	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Ir<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.2826	0.424	8	119.8894	0.658	663	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Ir<8>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	120.4967	0.496	4	119.8894	0.658	663	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Mn<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,1|O<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.9650	0.000	1	119.8894	0.658	663	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Mn<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	120.0307	0.290	24	119.8894	0.658	663	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Mn<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.4830	0.000	1	119.8894	0.658	663	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Ni<5>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	119.8840	0.314	2	119.8894	0.658	663	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Ni<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|C<4>,1|N<3>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	120.0770	0.000	1	119.8894	0.658	663	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Ni<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	119.9800	0.309	24	119.8894	0.658	663	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Ni<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.7850	0.000	1	119.8894	0.658	663	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Os<7>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.6220	0.000	1	119.8894	0.658	663	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Pd<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,1|O<2>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	120.1372	0.604	6	119.8894	0.658	663	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Pd<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	119.8783	0.301	8	119.8894	0.658	663	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Pt<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|H<1>,1|N<3>,2|C<4>,3|C<3>}	H(C[6]C[6]2)	119.7110	0.224	3	119.8894	0.658	663	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Pt<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	120.2242	0.445	4	119.8894	0.658	663	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Pt<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.2100	0.921	3	119.8894	0.658	663	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Re<5>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	119.1475	1.560	6	119.8894	0.658	663	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Re<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	119.9708	0.392	6	119.8894	0.658	663	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Re<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.7735	0.202	6	119.8894	0.658	663	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Rh<8>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	119.6442	1.037	6	119.8894	0.658	663	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Ru<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.5610	0.187	4	119.8894	0.658	663	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Sm<12>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	120.0167	0.118	3	119.8894	0.658	663	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Zn<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	119.9270	0.270	4	119.8894	0.658	663	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Zn<5>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	119.9017	0.848	13	119.8894	0.658	663	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Zn<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|C<4>,1|N<3>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	119.8460	0.000	1	119.8894	0.658	663	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Zn<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	120.1343	0.053	3	119.8894	0.658	663	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Zn<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.1805	0.370	2	119.8894	0.658	663	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){2|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|C<4>,1|F<1>,1|H<1>,1|N<3>,1|O<2>,2|C<3>}	H(C[6]C[6]2)	120.4970	0.000	1	119.8894	0.658	663	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){2|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	120.0193	0.782	181	119.8894	0.658	663	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){2|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.1480	0.072	2	119.8894	0.658	663	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){2|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	124.4930	3.772	2	119.8894	0.658	663	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|C<4>,1|H<1>,1|N<2>,2|C<3>}	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)2{1|C<3>,1|N<2>,1|N<3>,3|H<1>}	H(C[6]C[6]2)	120.0620	0.115	3	120.0595	0.341	86	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|C<4>,1|H<1>,1|N<2>,2|C<3>}	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)2{1|N<3>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	119.8792	0.186	12	120.0595	0.341	86	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Cu<5>,1|H<1>,1|N<2>,2|C<3>}	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)2{1|N<3>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	119.8126	0.579	10	120.0595	0.341	86	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Cu<6>,1|H<1>,1|N<2>,2|C<3>}	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)2{1|N<3>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	120.1300	0.010	2	120.0595	0.341	86	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|N<2>,2|C<3>,2|H<1>}	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)2{1|N<3>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	120.1802	0.799	37	120.0595	0.341	86	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Re<6>,1|H<1>,1|N<2>,2|C<3>}	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)2{1|N<3>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	119.9335	0.129	6	120.0595	0.341	86	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Zn<4>,1|H<1>,1|N<2>,2|C<3>}	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)2{1|N<3>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	120.1162	0.180	4	120.0595	0.341	86	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Zn<5>,1|H<1>,1|N<2>,2|C<3>}	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)2{1|N<3>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	120.0775	0.310	8	120.0595	0.341	86	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Zn<6>,1|H<1>,1|N<2>,2|C<3>}	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)2{1|N<3>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	120.1603	0.118	4	120.0595	0.341	86	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](C[6a]N[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>,2|N<2>}	C[6](C[6a]N[6a]2)(C[6]C[6]H)2{1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1292	0.627	12	120.3635	0.181	180	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](C[6a]N[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>,2|N<2>}	C[6](C[6a]N[6a]2)(C[6]C[6]H)2{1|N<3>,2|H<1>,2|N<2>}	H(C[6]C[6]2)	120.3391	0.175	15	120.3635	0.181	180	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](C[6a]N[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|C<3>,2|H<1>,2|N<2>}	C[6](C[6a]N[6a]2)(C[6]C[6]H)2{1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4122	0.432	90	120.3635	0.181	180	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](C[6a]N[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>,2|N<2>}	C[6](C[6a]N[6a]2)(C[6]C[6]H)2{1|N<3>,2|H<1>,2|N<2>}	H(C[6]C[6]2)	120.3030	0.536	2	120.3635	0.181	180	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](C[6a]N[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|H<1>,2|N<2>}	C[6](C[6a]N[6a]2)(C[6]C[6]H)2{1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3462	0.485	18	120.3635	0.181	180	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](C[6a]N[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>,2|N<2>}	C[6](C[6a]N[6a]2)(C[6]C[6]H)2{1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4970	0.320	2	120.3635	0.181	180	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](C[6a]N[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>,2|N<2>}	C[6](C[6a]N[6a]2)(C[6]C[6]H)2{1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4319	0.427	14	120.3635	0.181	180	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](C[6a]N[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|H<1>,2|N<2>}	C[6](C[6a]N[6a]2)(C[6]C[6]H)2{1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3130	0.642	2	120.3635	0.181	180	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](C[6a]N[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Rh<8>,1|C<3>,1|H<1>,2|N<2>}	C[6](C[6a]N[6a]2)(C[6]C[6]H)2{1|N<3>,2|H<1>,2|N<2>}	H(C[6]C[6]2)	120.3137	0.226	4	120.3635	0.181	180	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H)	C[6](C[6a]N[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(H){1|Ru<9>,1|C<3>,1|H<1>,2|N<2>}	C[6](C[6a]N[6a]2)(C[6]C[6]H)2{1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2825	0.355	21	120.3635	0.181	180	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]O[6]C)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]O[6]C)(H){1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|O<2>,2|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.3620	0.034	2	119.2202	0.033	4	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]O[6]C)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]O[6]C)(H){1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|O<2>,2|C<4>,2|N<3>,2|O<1>}	H(C[6]C[6]2)	119.0785	0.134	2	119.2202	0.033	4	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]O[6]O)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]C)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]O[6]O)(H){1|C<4>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]C)(C[6]C[6]H){1|O<1>,1|O<2>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	118.5225	0.237	2	118.5225	0.056	2	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]O[6]O)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]In)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]O[6]O)(H){1|In<4>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]In)(C[6]C[6]H){2|H<1>,2|O<2>,3|C<3>}	H(C[6]C[6]2)	120.0220	0.000	1	120.0220	0.000	1	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]P[6]C)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]P[6]C)(H){1|Mn<5>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|P<3>,2|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	117.4280	0.112	2	117.4280	0.012	2	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]P[6]O)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]P[6]O)(H){1|Au<2>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|O<1>,1|P<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	116.6580	0.000	1	117.2095	0.608	2	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]P[6]O)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]P[6]O)(H){1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|O<2>,1|P<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	117.7610	0.000	1	117.2095	0.608	2	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])2(H)	C[6](C[6a]C[6a]2)(C[6]C[6]C)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])2(H){1|O<1>,2|C<4>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]C)(C[6]C[6]H){1|C<4>,2|O<2>,5|C<3>}	H(C[6]C[6]2)	117.8560	0.000	1	117.8560	0.000	1	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])2(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]C[6]O)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])2(H){1|O<1>,2|C<4>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]C[6]O){1|C<4>,2|O<2>,5|C<3>}	H(C[6]C[6]2)	117.8260	0.000	1	117.8260	0.000	1	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])2(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])2(H){1|H<1>,2|N<3>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H){3|H<1>,4|C<3>}	H(C[6]C[6]2)	118.3745	0.245	2	118.9507	0.464	4	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])2(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])2(H){1|N<3>,2|H<1>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H){2|C<4>,5|C<3>}	H(C[6]C[6]2)	119.5270	0.047	2	118.9507	0.464	4	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])2(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]N)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])2(H){1|H<1>,2|N<3>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]N){1|N<2>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	118.3910	0.188	2	118.3910	0.035	2	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])2(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]P[6]P)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])2(H){3|P<4>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]P[6]P){1|C<4>,1|U<8>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	117.8440	0.331	4	117.7078	0.142	19	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])2(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]P[6]P)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])2(H){3|P<4>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]P[6]P){1|Mn<6>,1|C<4>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	117.9865	0.008	2	117.7078	0.142	19	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])2(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]P[6]P)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])2(H){3|P<4>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]P[6]P){1|Pd<4>,1|C<4>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	117.6133	0.157	3	117.7078	0.142	19	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])2(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]P[6]P)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])2(H){3|P<4>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]P[6]P){1|Rh<6>,1|C<4>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	117.8498	0.338	6	117.7078	0.142	19	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])2(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]P[6]P)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])2(H){3|P<4>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]P[6]P){1|U<15>,1|C<4>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	116.9330	0.098	2	117.7078	0.142	19	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])2(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]P[6]P)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])2(H){3|P<4>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]P[6]P){1|U<16>,1|C<4>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	117.6475	0.060	2	117.7078	0.142	19	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])2(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])2(H){1|C<4>,2|H<1>,5|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{2|C<4>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	118.1630	0.000	1	118.1630	0.000	1	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])2(H)	C[6](C[6a]C[6a]2)(C[6]C[6]Si)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])2(H){1|Si<4>,1|C<4>,1|H<1>,5|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]Si)(C[6]C[6]H){2|C<4>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	118.8260	0.000	1	118.8260	0.000	1	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])2(H)	C[6](C[6a]C[6a]2)(C[6]P[6]Si)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])2(H){2|Si<4>,1|P<2>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]P[6]Si)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	116.9115	0.040	2	116.9130	0.001	4	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])2(H)	C[6](C[6a]C[6a]2)(C[6]P[6]Si)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])2(H){2|Si<4>,1|P<3>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]P[6]Si)(C[6]C[6]H){1|S<1>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	116.9145	0.015	2	116.9130	0.001	4	119.8362	0.681	1855	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]2)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H){1|H<1>,6|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]2){2|H<1>,7|C<3>}	H(C[6]C[6]2)	119.0941	0.185	15	119.0941	0.034	15	119.8886	1.502	225	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]C)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H){1|C<4>,1|H<1>,5|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]C){2|H<1>,5|C<3>}	H(C[6]C[6]2)	118.9845	0.086	2	118.9957	0.004	3	119.8886	1.502	225	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]C)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H){1|C<4>,1|H<1>,5|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]C){3|H<1>,5|C<3>}	H(C[6]C[6]2)	119.0180	0.000	1	118.9957	0.004	3	119.8886	1.502	225	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H){2|H<1>,5|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]H){1|H<1>,1|O<2>,5|C<3>}	H(C[6]C[6]2)	119.5285	0.197	4	119.5285	0.039	4	119.8886	1.502	225	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]W)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H){1|H<1>,1|W<6>,5|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]W){2|H<1>,5|C<3>}	H(C[6]C[6]2)	119.3355	0.249	6	119.3355	0.062	6	119.8886	1.502	225	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]C)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H){1|C<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]C){1|C<4>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.0010	0.000	1	119.1352	0.072	6	119.8886	1.502	225	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]C)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H){1|C<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]C){1|H<1>,2|C<4>,4|C<3>}	H(C[6]C[6]2)	119.1620	0.290	5	119.1352	0.072	6	119.8886	1.502	225	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H)	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)(N[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H){1|C<4>,1|H<1>,1|N<2>,2|C<3>}	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)(N[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	118.2260	0.000	1	119.4169	0.235	15	119.8886	1.502	225	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H)	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)(N[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H){1|N<2>,2|C<3>,2|H<1>}	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)(N[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.5232	0.369	12	119.4169	0.235	15	119.8886	1.502	225	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H)	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)(N[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H){1|N<2>,2|C<3>,2|H<1>}	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)(N[6]C[6]H){1|H<1>,2|C<4>,3|C<3>}	H(C[6]C[6]2)	119.3745	0.486	2	119.4169	0.235	15	119.8886	1.502	225	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6,6a]C[6a])(C[6]C[6]H)(N[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){2|H<1>,3|C<3>}	C[6](C[6a]C[6,6a]C[6a])(C[6]C[6]H)(N[6]C[6]H){1|N<2>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	116.9270	0.000	1	116.9270	0.000	1	119.8886	1.502	225	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a,6a]C[6a])(C[6]C[6]H)(N[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){2|H<1>,3|C<3>}	C[6](C[6a]C[6a,6a]C[6a])(C[6]C[6]H)(N[6]C[6]H){1|N<2>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	122.5190	0.000	1	122.5190	0.000	1	119.8886	1.502	225	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]B)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|B<3>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]B){1|H<1>,2|C<4>,4|C<3>}	H(C[6]C[6]2)	119.7250	0.211	3	119.7568	0.033	5	119.8886	1.502	225	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]B)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|B<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]B){1|C<4>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.9360	0.000	1	119.7568	0.033	5	119.8886	1.502	225	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]B)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|B<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]B){3|H<1>,4|C<3>}	H(C[6]C[6]2)	119.6730	0.000	1	119.7568	0.033	5	119.8886	1.502	225	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]C)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]C){1|C<4>,1|H<1>,5|C<3>}	H(C[6]C[6]2)	119.8480	0.089	2	119.6439	0.326	7	119.8886	1.502	225	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]C)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]C){1|C<4>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.6080	0.000	1	119.6439	0.326	7	119.8886	1.502	225	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]C)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]C){1|H<1>,2|C<4>,4|C<3>}	H(C[6]C[6]2)	120.0460	0.182	2	119.6439	0.326	7	119.8886	1.502	225	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]C)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]C){3|C<3>,4|H<1>}	H(C[6]C[6]2)	118.4180	0.000	1	119.6439	0.326	7	119.8886	1.502	225	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]C)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|H<1>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]C){3|C<3>,4|H<1>}	H(C[6]C[6]2)	119.6930	0.000	1	119.6439	0.326	7	119.8886	1.502	225	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){2|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]H){1|H<1>,1|N<3>,2|C<4>,3|C<3>}	H(C[6]C[6]2)	120.4090	0.000	1	120.0604	0.121	10	119.8886	1.502	225	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){2|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]H){1|N<3>,1|O<1>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	119.7210	0.000	1	120.0604	0.121	10	119.8886	1.502	225	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){2|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]H){1|O<2>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.7415	0.525	2	120.0604	0.121	10	119.8886	1.502	225	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){2|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]H){1|O<2>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.4240	0.000	1	120.0604	0.121	10	119.8886	1.502	225	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){2|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]H){1|Pt<4>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.0390	0.000	1	120.0604	0.121	10	119.8886	1.502	225	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){2|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]H){3|C<3>,4|H<1>}	H(C[6]C[6]2)	120.0507	0.263	3	120.0604	0.121	10	119.8886	1.502	225	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){2|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]H){3|H<1>,4|C<3>}	H(C[6]C[6]2)	120.3760	0.000	1	120.0604	0.121	10	119.8886	1.502	225	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]O)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|H<1>,1|O<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]O){1|C<4>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.2790	0.000	1	118.3293	3.927	4	119.8886	1.502	225	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]O)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|H<1>,1|O<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]O){1|O<2>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	115.3670	0.000	1	118.3293	3.927	4	119.8886	1.502	225	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]O)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|H<1>,1|O<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]O){3|C<3>,4|H<1>}	H(C[6]C[6]2)	119.1350	0.000	1	118.3293	3.927	4	119.8886	1.502	225	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]O)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|H<1>,1|O<2>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]O){1|O<2>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.5360	0.000	1	118.3293	3.927	4	119.8886	1.502	225	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)(N[6]C[6]B)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|B<4>,1|H<1>,1|N<2>,2|C<3>}	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)(N[6]C[6]B){3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.2790	0.000	1	119.2790	0.000	1	119.8886	1.502	225	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)(N[6]C[6]C)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<2>,2|C<3>}	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)(N[6]C[6]C){1|N<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.4605	0.404	2	117.7545	10.132	4	119.8886	1.502	225	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)(N[6]C[6]C)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<2>,2|C<3>}	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)(N[6]C[6]C){3|C<3>,3|H<1>}	H(C[6]C[6]2)	115.0485	0.971	2	117.7545	10.132	4	119.8886	1.502	225	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)(N[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|C<2>,1|H<1>,1|N<2>,2|C<3>}	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)(N[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	126.6630	0.000	1	120.3565	1.015	119	119.8886	1.502	225	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)(N[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<2>,2|C<3>}	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)(N[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.1200	0.000	1	120.3565	1.015	119	119.8886	1.502	225	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)(N[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)(N[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.6660	0.199	2	120.3565	1.015	119	119.8886	1.502	225	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)(N[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|P<4>,2|C<3>}	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)(N[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.4030	0.000	1	120.3565	1.015	119	119.8886	1.502	225	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)(N[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<2>}	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)(N[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.2300	0.000	1	120.3565	1.015	119	119.8886	1.502	225	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)(N[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|N<2>,2|C<3>,2|H<1>}	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)(N[6]C[6]H){1|Br<1>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.3280	0.000	1	120.3565	1.015	119	119.8886	1.502	225	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)(N[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|N<2>,2|C<3>,2|H<1>}	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)(N[6]C[6]H){1|C<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.3980	0.000	1	120.3565	1.015	119	119.8886	1.502	225	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)(N[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|N<2>,2|C<3>,2|H<1>}	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)(N[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.2081	0.507	8	120.3565	1.015	119	119.8886	1.502	225	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)(N[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|N<2>,2|C<3>,2|H<1>}	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)(N[6]C[6]H){1|Ir<6>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.7180	0.248	4	120.3565	1.015	119	119.8886	1.502	225	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)(N[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|N<2>,2|C<3>,2|H<1>}	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)(N[6]C[6]H){1|N<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.7178	1.521	17	120.3565	1.015	119	119.8886	1.502	225	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)(N[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|N<2>,2|C<3>,2|H<1>}	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)(N[6]C[6]H){1|S<1>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.4027	0.873	3	120.3565	1.015	119	119.8886	1.502	225	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)(N[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|N<2>,2|C<3>,2|H<1>}	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)(N[6]C[6]H){1|S<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.1825	0.078	2	120.3565	1.015	119	119.8886	1.502	225	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)(N[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|N<2>,2|C<3>,2|H<1>}	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)(N[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.1420	0.000	1	120.3565	1.015	119	119.8886	1.502	225	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)(N[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|N<2>,2|C<3>,2|H<1>}	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)(N[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.2433	0.654	76	120.3565	1.015	119	119.8886	1.502	225	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)(N[6]C[6]O)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|O<1>,2|C<3>}	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)(N[6]C[6]O){2|H<1>,4|C<3>}	H(C[6]C[6]2)	114.0760	0.000	1	117.0674	4.980	5	119.8886	1.502	225	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)(N[6]C[6]O)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|O<1>,2|C<3>}	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)(N[6]C[6]O){3|C<3>,3|H<1>}	H(C[6]C[6]2)	117.8153	1.706	4	117.0674	4.980	5	119.8886	1.502	225	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]N[6a]2)(C[6]C[6]H)(N[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|C<3>,2|H<1>,2|N<2>}	C[6](C[6a]N[6a]2)(C[6]C[6]H)(N[6]C[6]H){1|C<3>,2|H<1>,2|N<2>}	H(C[6]C[6]2)	120.4720	0.000	1	120.4495	0.480	15	119.8886	1.502	225	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]N[6a]2)(C[6]C[6]H)(N[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|C<3>,2|H<1>,2|N<2>}	C[6](C[6a]N[6a]2)(C[6]C[6]H)(N[6]C[6]H){1|N<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4210	0.000	1	120.4495	0.480	15	119.8886	1.502	225	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]N[6a]2)(C[6]C[6]H)(N[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|C<3>,2|H<1>,2|N<2>}	C[6](C[6a]N[6a]2)(C[6]C[6]H)(N[6]C[6]H){2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.4499	0.748	13	120.4495	0.480	15	119.8886	1.502	225	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]N)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]C)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]N)(H){1|C<4>,2|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]C){1|C<4>,1|N<2>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	118.7900	0.000	1	118.7900	0.000	1	119.8886	1.502	225	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]S)(H)	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)(N[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]S)(H){1|N<2>,2|C<3>,2|H<1>}	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)(N[6]C[6]H){1|H<1>,1|S<1>,4|C<3>}	H(C[6]C[6]2)	118.9390	0.000	1	118.8045	0.036	2	119.8886	1.502	225	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]S)(H)	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)(N[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]S)(H){1|N<2>,2|C<3>,2|H<1>}	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)(N[6]C[6]H){1|S<1>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	118.6700	0.000	1	118.8045	0.036	2	119.8886	1.502	225	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])2(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])2(H){1|H<1>,5|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]H){1|N<2>,1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.4830	0.000	1	120.4830	0.000	1	119.8886	1.502	225	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:P[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6a]P[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(P[6]C[6]W)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6a]P[6])(H){1|H<1>,1|W<6>,5|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(P[6]C[6]W){2|H<1>,5|C<3>}	H(C[6]C[6]2)	116.9759	0.375	10	116.9759	0.141	10	116.9759	0.141	10	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6a]N[6])(H)	C[6](C[6a]C[6a]N[6a])(N[6]C[6]Re)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6a]N[6])(H){1|Re<6>,1|H<1>,1|N<2>,1|O<2>,3|C<3>}	C[6](C[6a]C[6a]N[6a])(N[6]C[6]Re)(C[6]C[6]H){1|H<1>,5|C<3>}	H(C[6]C[6]2)	119.5840	0.000	1	119.5815	0.000	2	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6a]N[6])(H)	C[6](C[6a]C[6a]N[6a])(N[6]C[6]Re)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6a]N[6])(H){1|Re<6>,1|H<1>,1|N<2>,1|S<2>,3|C<3>}	C[6](C[6a]C[6a]N[6a])(N[6]C[6]Re)(C[6]C[6]H){1|H<1>,5|C<3>}	H(C[6]C[6]2)	119.5790	0.000	1	119.5815	0.000	2	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6]C[6])(C[6]C[6a]N[6])(H)	C[6](C[6a]C[6a]2)(N[6]C[6,6]C)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]C[6])(C[6]C[6a]N[6])(H){1|C<4>,6|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6,6]C)(C[6]C[6]H){1|C<2>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	114.7250	0.000	1	114.7250	0.000	1	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H)	C[6](C[6a]C[6a,6a]C[6a])(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H){1|Ir<6>,1|H<1>,5|C<3>}	C[6](C[6a]C[6a,6a]C[6a])(N[6]C[6]Ir)(C[6]C[6]H){1|H<1>,5|C<3>}	H(C[6]C[6]2)	118.7847	0.364	3	118.7847	0.133	3	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Au)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H){1|Au<4>,1|H<1>,5|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Au)(C[6]C[6]H){1|H<1>,5|C<3>}	H(C[6]C[6]2)	119.7996	0.331	5	119.7996	0.110	5	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Cd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H){1|Cd<6>,1|H<1>,5|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Cd)(C[6]C[6]H){2|H<1>,5|C<3>}	H(C[6]C[6]2)	119.8440	0.025	2	119.8440	0.001	2	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Co)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H){1|Co<6>,1|H<1>,5|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Co)(C[6]C[6]H){2|H<1>,5|C<3>}	H(C[6]C[6]2)	119.2855	0.057	2	119.2855	0.003	2	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Cr)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H){1|Cr<6>,1|H<1>,5|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Cr)(C[6]C[6]H){2|H<1>,5|C<3>}	H(C[6]C[6]2)	117.3680	0.000	1	117.3680	0.000	1	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Hg)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H){1|Hg<4>,1|H<1>,5|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Hg)(C[6]C[6]H){2|H<1>,5|C<3>}	H(C[6]C[6]2)	119.4230	0.510	4	119.4230	0.261	4	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H){1|Ir<6>,1|H<1>,5|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H){1|F<1>,1|H<1>,1|N<2>,3|C<3>}	H(C[6]C[6]2)	119.3395	0.175	2	119.2963	0.295	48	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H){1|Ir<6>,1|H<1>,5|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H){1|F<1>,1|H<1>,4|C<3>}	H(C[6]C[6]2)	119.1952	0.332	11	119.2963	0.295	48	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H){1|Ir<6>,1|H<1>,5|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H){1|H<1>,1|O<2>,5|C<3>}	H(C[6]C[6]2)	119.1415	0.445	4	119.2963	0.295	48	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H){1|Ir<6>,1|H<1>,5|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H){1|H<1>,5|C<3>}	H(C[6]C[6]2)	119.7448	0.277	5	119.2963	0.295	48	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H){1|Ir<6>,1|H<1>,5|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.2739	0.665	25	119.2963	0.295	48	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H){1|Ir<6>,1|H<1>,5|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H){2|H<1>,5|C<3>}	H(C[6]C[6]2)	119.2580	0.000	1	119.2963	0.295	48	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Mn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H){1|Mn<6>,1|H<1>,1|N<2>,4|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Mn)(C[6]C[6]H){1|H<1>,6|C<3>}	H(C[6]C[6]2)	119.3250	0.618	2	119.3250	0.382	2	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Mo)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H){1|Mo<6>,1|H<1>,5|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Mo)(C[6]C[6]H){2|H<1>,5|C<3>}	H(C[6]C[6]2)	119.0730	0.000	1	119.0730	0.000	1	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Os)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H){1|Os<7>,1|H<1>,5|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Os)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	118.8240	0.000	1	118.8240	0.000	1	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H){1|Pt<4>,1|H<1>,5|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Pt)(C[6]C[6]H){1|H<1>,1|O<2>,5|C<3>}	H(C[6]C[6]2)	118.5630	0.000	2	119.5368	0.326	24	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H){1|Pt<4>,1|H<1>,5|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Pt)(C[6]C[6]H){1|H<1>,5|C<3>}	H(C[6]C[6]2)	119.6382	0.517	21	119.5368	0.326	24	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H){1|Pt<4>,1|H<1>,5|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Pt)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.3540	0.000	1	119.5368	0.326	24	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Rh)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H){1|Rh<6>,1|H<1>,5|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Rh)(C[6]C[6]H){2|H<1>,5|C<3>}	H(C[6]C[6]2)	119.6700	0.000	1	119.6700	0.000	1	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Zn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H){1|Zn<4>,1|H<1>,5|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Zn)(C[6]C[6]H){2|H<1>,5|C<3>}	H(C[6]C[6]2)	119.4630	0.000	1	119.4630	0.000	1	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H)	C[6](C[6a]C[6a]N[6a])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H){1|Cu<4>,1|H<1>,1|N<2>,4|C<3>}	C[6](C[6a]C[6a]N[6a])(N[6]C[6]Cu)(C[6]C[6]H){1|H<1>,5|C<3>}	H(C[6]C[6]2)	119.6390	0.000	1	119.6390	0.000	1	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H)	C[6](C[6a]C[6a]N[6a])(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H){1|Ir<6>,1|H<1>,1|N<2>,4|C<3>}	C[6](C[6a]C[6a]N[6a])(N[6]C[6]Ir)(C[6]C[6]H){1|H<1>,5|C<3>}	H(C[6]C[6]2)	119.6925	0.282	2	119.6925	0.080	2	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H)	C[6](C[6a]C[6a]N[6a])(N[6]C[6]Mn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H){1|Mn<6>,1|H<1>,1|N<2>,4|C<3>}	C[6](C[6a]C[6a]N[6a])(N[6]C[6]Mn)(C[6]C[6]H){1|H<1>,5|C<3>}	H(C[6]C[6]2)	119.4180	0.000	1	119.4180	0.000	1	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H)	C[6](C[6a]C[6a]N[6a])(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H){1|Pt<4>,1|H<1>,1|N<2>,4|C<3>}	C[6](C[6a]C[6a]N[6a])(N[6]C[6]Pt)(C[6]C[6]H){1|H<1>,5|C<3>}	H(C[6]C[6]2)	119.7885	0.052	2	119.5943	0.057	4	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H)	C[6](C[6a]C[6a]N[6a])(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H){1|Pt<6>,1|H<1>,1|N<2>,4|C<3>}	C[6](C[6a]C[6a]N[6a])(N[6]C[6]Pt)(C[6]C[6]H){1|H<1>,5|C<3>}	H(C[6]C[6]2)	119.4000	0.129	2	119.5943	0.057	4	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H)	C[6](C[6a]C[6a]N[6a])(N[6]C[6]Re)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H){1|Re<6>,1|H<1>,1|N<2>,4|C<3>}	C[6](C[6a]C[6a]N[6a])(N[6]C[6]Re)(C[6]C[6]H){1|H<1>,5|C<3>}	H(C[6]C[6]2)	119.4862	0.390	5	119.4862	0.152	5	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H)	C[6](C[6a]C[6a]N[6a])(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H){1|Ru<6>,1|H<1>,1|N<2>,4|C<3>}	C[6](C[6a]C[6a]N[6a])(N[6]C[6]Ru)(C[6]C[6]H){1|H<1>,5|C<3>}	H(C[6]C[6]2)	119.0800	0.000	1	119.0800	0.000	1	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]C)(H)	C[6](C[6a]C[6a,6a]C[6a])(N[6]C[6,6a]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]C)(H){1|Ir<6>,4|C<3>}	C[6](C[6a]C[6a,6a]C[6a])(N[6]C[6,6a]Ir)(C[6]C[6]H){1|C<4>,5|C<3>}	H(C[6]C[6]2)	118.6075	0.528	2	118.6075	0.279	2	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]C)(H)	C[6](C[6a]C[6a,6a]C[6a])(N[6]C[6,6a]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]C)(H){1|Pt<4>,4|C<3>}	C[6](C[6a]C[6a,6a]C[6a])(N[6]C[6,6a]Pt)(C[6]C[6]H){1|C<4>,5|C<3>}	H(C[6]C[6]2)	118.6190	0.000	1	118.6190	0.000	1	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H)	C[6](C[6a]C[6a,6a]2)(N[6]C[6,6a]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H){1|Cu<4>,4|C<3>}	C[6](C[6a]C[6a,6a]2)(N[6]C[6,6a]Cu)(C[6]C[6]H){1|H<1>,6|C<3>}	H(C[6]C[6]2)	120.2710	0.068	2	120.2710	0.005	2	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H)	C[6](C[6a]C[6a,6a]C[6a])(N[6]C[6,6a]O)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H){1|O<1>,4|C<3>}	C[6](C[6a]C[6a,6a]C[6a])(N[6]C[6,6a]O)(C[6]C[6]H){2|H<1>,5|C<3>}	H(C[6]C[6]2)	119.5330	0.000	1	119.5330	0.000	1	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H)	C[6](C[6a]C[6a]N[6a])(N[6]C[6,6a]H)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H){1|H<1>,1|N<2>,3|C<3>}	C[6](C[6a]C[6a]N[6a])(N[6]C[6,6a]H)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.3213	0.097	3	120.3213	0.009	3	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H)	C[6](C[6a]C[6a]N[6a])(N[6]C[6,6a]O)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H){1|N<2>,1|O<1>,3|C<3>}	C[6](C[6a]C[6a]N[6a])(N[6]C[6,6a]O)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.3340	0.000	1	119.3340	0.000	1	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H)	C[6](C[6a]C[6a]N[6a])(N[6]C[6,6a]Zn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H){1|Zn<6>,1|N<2>,3|C<3>}	C[6](C[6a]C[6a]N[6a])(N[6]C[6,6a]Zn)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	118.8065	0.175	2	118.8065	0.031	2	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]2)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Os)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]2)(H){1|Os<7>,1|H<1>,5|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Os)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	118.5350	0.000	1	118.5350	0.000	1	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]2)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]2)(H){2|Pt<4>,1|N<3>,4|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Pt)(C[6]C[6]H){1|F<1>,1|H<1>,4|C<3>}	H(C[6]C[6]2)	120.1550	0.000	1	120.1550	0.000	1	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H)	C[6](C[6a]C[6a,6a]C[6a])(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H){1|Ir<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a,6a]C[6a])(N[6]C[6]Ir)(C[6]C[6]H){1|C<4>,1|H<1>,4|C<3>}	H(C[6]C[6]2)	118.8340	0.181	4	118.8340	0.033	4	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H)	C[6](C[6a]C[6a,6a]C[6a])(N[6]C[6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H){1|Pd<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a,6a]C[6a])(N[6]C[6]Pd)(C[6]C[6]H){1|C<4>,1|H<1>,4|C<3>}	H(C[6]C[6]2)	118.9520	0.000	1	118.7350	0.094	2	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H)	C[6](C[6a]C[6a,6a]C[6a])(N[6]C[6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H){1|Pd<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a,6a]C[6a])(N[6]C[6]Pd)(C[6]C[6]H){1|C<4>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	118.5180	0.000	1	118.7350	0.094	2	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H)	C[6](C[6a]C[6a,6a]C[6a])(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H){1|Pt<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a,6a]C[6a])(N[6]C[6]Pt)(C[6]C[6]H){1|C<4>,1|H<1>,4|C<3>}	H(C[6]C[6]2)	118.4650	0.000	1	118.7650	0.180	2	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H)	C[6](C[6a]C[6a,6a]C[6a])(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H){1|Pt<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a,6a]C[6a])(N[6]C[6]Pt)(C[6]C[6]H){1|C<4>,1|H<1>,4|C<3>}	H(C[6]C[6]2)	119.0650	0.000	1	118.7650	0.180	2	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Au)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H){1|Au<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Au)(C[6]C[6]H){1|C<4>,1|H<1>,4|C<3>}	H(C[6]C[6]2)	120.0245	0.347	2	120.0245	0.121	2	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H){1|Ir<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H){1|C<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.8450	0.000	1	119.2293	1.048	67	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H){1|Ir<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H){1|C<3>,1|C<4>,1|H<1>,1|O<2>,2|N<2>}	H(C[6]C[6]2)	119.4617	0.480	3	119.2293	1.048	67	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H){1|Ir<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H){1|C<4>,1|F<1>,1|H<1>,1|N<2>,2|C<3>}	H(C[6]C[6]2)	119.7398	0.868	4	119.2293	1.048	67	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H){1|Ir<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H){1|C<4>,1|F<1>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.4093	0.305	13	119.2293	1.048	67	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H){1|Ir<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H){1|C<4>,1|H<1>,1|N<2>,1|O<2>,2|C<3>}	H(C[6]C[6]2)	119.4502	0.353	5	119.2293	1.048	67	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H){1|Ir<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H){1|C<4>,1|H<1>,1|O<2>,4|C<3>}	H(C[6]C[6]2)	118.4027	1.013	10	119.2293	1.048	67	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H){1|Ir<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H){1|C<4>,1|H<1>,4|C<3>}	H(C[6]C[6]2)	120.6330	0.000	1	119.2293	1.048	67	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H){1|Ir<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.8635	0.505	15	119.2293	1.048	67	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H){1|Ir<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H){1|C<4>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.6580	0.440	2	119.2293	1.048	67	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H){1|Ir<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H){1|H<1>,2|C<4>,3|C<3>}	H(C[6]C[6]2)	119.1395	0.124	2	119.2293	1.048	67	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H){1|Ir<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.2117	0.787	4	119.2293	1.048	67	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H){1|Ir<6>,4|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.9470	0.000	1	119.2293	1.048	67	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H){1|Ir<7>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H){1|C<4>,1|H<1>,4|C<3>}	H(C[6]C[6]2)	119.0220	0.127	2	119.2293	1.048	67	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H){1|Ir<8>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H){1|C<4>,1|H<1>,1|O<2>,4|C<3>}	H(C[6]C[6]2)	116.6395	1.300	4	119.2293	1.048	67	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H){1|Pd<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Pd)(C[6]C[6]H){1|C<4>,1|H<1>,4|C<3>}	H(C[6]C[6]2)	119.8810	0.000	1	119.5355	0.239	2	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H){1|Pd<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Pd)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.1900	0.000	1	119.5355	0.239	2	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H){1|Pt<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Pt)(C[6]C[6]H){1|C<4>,1|H<1>,4|C<3>}	H(C[6]C[6]2)	119.6590	0.198	8	119.9349	0.288	26	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H){1|Pt<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Pt)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.1333	0.381	4	119.9349	0.288	26	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H){1|Pt<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Pt)(C[6]C[6]H){1|H<1>,5|C<3>}	H(C[6]C[6]2)	120.3216	0.307	14	119.9349	0.288	26	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H){1|Ru<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Ru)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.3808	0.288	4	119.4960	0.128	5	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H){1|Ru<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Ru)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.9570	0.000	1	119.4960	0.128	5	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H)	C[6](C[6a]C[6a]N[6a])(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H){1|Ru<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6a]C[6a]N[6a])(N[6]C[6]Ru)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	117.8470	0.000	1	117.8470	0.000	1	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]Cl)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]Cl)(H){1|Ru<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Ru)(C[6]C[6]H){1|Cl<1>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.9470	0.000	1	120.9470	0.000	1	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]Cl)(H)	C[6](C[6a]C[6a]N[6a])(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]Cl)(H){1|Ru<6>,1|H<1>,1|N<2>,2|C<3>}	C[6](C[6a]C[6a]N[6a])(N[6]C[6]Ru)(C[6]C[6]H){1|Cl<1>,1|H<1>,4|C<3>}	H(C[6]C[6]2)	120.7700	0.000	1	120.7700	0.000	1	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[5,6a]C[6a])(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[5,6a]C[6a])(N[6]C[6]Pt)(C[6]C[6]H){1|S<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.8870	0.000	1	119.8870	0.000	1	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[5,6a]C[6a])(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ru<9>,1|H<1>,3|C<3>}	C[6](C[6a]C[5,6a]C[6a])(N[6]C[6]Ru)(C[6]C[6]H){1|S<3>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.0105	0.125	2	120.0105	0.016	2	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[5a,6a]C[6a])(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[5a,6a]C[6a])(N[6]C[6]Ir)(C[6]C[6]H){1|O<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.1850	0.158	2	119.1850	0.025	2	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[5a,6a]C[6a])(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[5a,6a]C[6a])(N[6]C[6]Pt)(C[6]C[6]H){1|O<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.1283	1.164	3	119.5384	0.646	7	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[5a,6a]C[6a])(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[5a,6a]C[6a])(N[6]C[6]Pt)(C[6]C[6]H){1|S<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.8460	0.308	4	119.5384	0.646	7	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[5a,6a]C[6a])(N[6]C[6]Rh)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Rh<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[5a,6a]C[6a])(N[6]C[6]Rh)(C[6]C[6]H){1|S<2>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.9960	0.000	1	119.9960	0.000	1	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6,6a]C[6a])(N[6]C[6]Cr)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Cr<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6,6a]C[6a])(N[6]C[6]Cr)(C[6]C[6]H){1|N<3>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.0379	0.136	11	120.0379	0.018	11	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6,6a]C[6a])(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6,6a]C[6a])(N[6]C[6]Fe)(C[6]C[6]H){1|N<3>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.1840	0.071	2	120.1840	0.005	2	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6,6a]C[6a])(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6,6a]C[6a])(N[6]C[6]Ru)(C[6]C[6]H){1|N<3>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.8685	0.187	4	120.0152	0.084	6	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6,6a]C[6a])(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6,6a]C[6a])(N[6]C[6]Ru)(C[6]C[6]H){2|H<1>,2|N<3>,3|C<3>}	H(C[6]C[6]2)	120.3085	0.238	2	120.0152	0.084	6	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a,6a]C[6a])(N[6]C[6]Al)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Al<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a,6a]C[6a])(N[6]C[6]Al)(C[6]C[6]H){1|H<1>,1|O<2>,5|C<3>}	H(C[6]C[6]2)	120.0450	0.000	1	120.0450	0.000	1	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a,6a]C[6a])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a,6a]C[6a])(N[6]C[6]Cu)(C[6]C[6]H){2|H<1>,5|C<3>}	H(C[6]C[6]2)	119.9890	0.000	1	119.9890	0.000	1	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a,6a]C[6a])(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a,6a]C[6a])(N[6]C[6]Ir)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.7603	0.147	3	119.7603	0.022	3	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a,6a]C[6a])(N[6]C[6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a,6a]C[6a])(N[6]C[6]Pd)(C[6]C[6]H){1|C<4>,1|H<1>,4|C<3>}	H(C[6]C[6]2)	122.7440	0.000	2	120.3243	4.436	12	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a,6a]C[6a])(N[6]C[6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a,6a]C[6a])(N[6]C[6]Pd)(C[6]C[6]H){1|C<4>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.7330	0.000	2	120.3243	4.436	12	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a,6a]C[6a])(N[6]C[6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a,6a]C[6a])(N[6]C[6]Pd)(C[6]C[6]H){1|H<1>,5|C<3>}	H(C[6]C[6]2)	125.0020	0.000	1	120.3243	4.436	12	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a,6a]C[6a])(N[6]C[6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a,6a]C[6a])(N[6]C[6]Pd)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.0210	0.000	1	120.3243	4.436	12	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a,6a]C[6a])(N[6]C[6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a,6a]C[6a])(N[6]C[6]Pd)(C[6]C[6]H){2|H<1>,5|C<3>}	H(C[6]C[6]2)	118.9858	0.856	6	120.3243	4.436	12	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a,6a]C[6a])(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a,6a]C[6a])(N[6]C[6]Pt)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.6671	0.596	7	119.6605	0.224	12	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a,6a]C[6a])(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pt<4>,4|C<3>}	C[6](C[6a]C[6a,6a]C[6a])(N[6]C[6]Pt)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.4140	0.000	1	119.6605	0.224	12	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a,6a]C[6a])(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pt<5>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a,6a]C[6a])(N[6]C[6]Pt)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.7105	0.297	4	119.6605	0.224	12	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a,6a]C[6a])(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a,6a]C[6a])(N[6]C[6]Ru)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.6410	0.000	1	119.6080	0.002	2	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a,6a]C[6a])(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ru<9>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a,6a]C[6a])(N[6]C[6]Ru)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.5750	0.000	1	119.6080	0.002	2	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Ag)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ag<2>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Ag)(C[6]C[6]H){1|H<1>,2|C<4>,4|C<3>}	H(C[6]C[6]2)	120.0153	0.322	3	120.0153	0.103	3	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Al)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Al<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Al)(C[6]C[6]H){1|H<1>,2|C<4>,4|C<3>}	H(C[6]C[6]2)	119.7132	0.866	6	119.8192	0.331	16	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Al)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Al<5>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Al)(C[6]C[6]H){1|C<4>,1|O<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.0633	0.200	6	119.8192	0.331	16	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Al)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Al<5>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Al)(C[6]C[6]H){1|C<4>,1|O<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.0100	0.000	1	119.8192	0.331	16	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Al)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Al<5>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Al)(C[6]C[6]H){1|O<2>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.4793	0.328	3	119.8192	0.331	16	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Au)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Au<4>,1|C<4>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Au)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.4795	0.104	2	120.2655	0.294	57	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Au)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Au<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Au)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.3300	0.331	2	120.2655	0.294	57	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Au)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Au<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Au)(C[6]C[6]H){1|C<4>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.7580	0.000	1	120.2655	0.294	57	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Au)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Au<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Au)(C[6]C[6]H){1|F<1>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.2880	0.000	1	120.2655	0.294	57	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Au)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Au<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Au)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.5430	0.503	27	120.2655	0.294	57	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Au)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Au<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Au)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.9571	0.297	19	120.2655	0.294	57	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Au)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Au<5>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Au)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.7168	0.501	4	120.2655	0.294	57	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Au)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Au<5>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Au)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.7550	0.000	1	120.2655	0.294	57	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Cd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Cd<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Cd)(C[6]C[6]H){1|H<1>,2|O<2>,4|C<3>}	H(C[6]C[6]2)	120.2155	0.054	2	120.2155	0.003	2	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Co)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Co<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Co)(C[6]C[6]H){1|H<1>,2|C<4>,4|C<3>}	H(C[6]C[6]2)	120.0100	0.243	3	119.6360	0.397	17	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Co)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Co<4>,4|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Co)(C[6]C[6]H){2|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.5322	0.442	6	119.6360	0.397	17	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Co)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Co<5>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Co)(C[6]C[6]H){1|C<4>,1|O<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.2000	0.000	1	119.6360	0.397	17	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Co)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Co<5>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Co)(C[6]C[6]H){1|C<4>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	118.3780	0.808	2	119.6360	0.397	17	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Co)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Co<5>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Co)(C[6]C[6]H){1|O<2>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.8200	0.016	2	119.6360	0.397	17	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Co)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Co<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Co)(C[6]C[6]H){3|H<1>,4|C<3>}	H(C[6]C[6]2)	119.8485	0.200	2	119.6360	0.397	17	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Co)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Co<8>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Co)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.2960	0.000	1	119.6360	0.397	17	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Cr)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Cr<5>,1|C<4>,1|H<1>,2|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Cr)(C[6]C[6]H){1|H<1>,1|N<3>,2|C<4>,3|C<3>}	H(C[6]C[6]2)	120.2085	0.063	2	120.0843	0.059	9	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Cr)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Cr<6>,1|C<4>,1|H<1>,2|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Cr)(C[6]C[6]H){1|H<1>,1|N<3>,2|C<4>,3|C<3>}	H(C[6]C[6]2)	120.1760	0.194	3	120.0843	0.059	9	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Cr)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Cr<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Cr)(C[6]C[6]H){1|O<2>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.7100	0.173	2	120.0843	0.059	9	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Cr)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Cr<7>,1|C<4>,1|H<1>,2|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Cr)(C[6]C[6]H){1|H<1>,1|N<3>,2|C<4>,3|C<3>}	H(C[6]C[6]2)	120.1970	0.010	2	120.0843	0.059	9	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|C<4>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Cu)(C[6]C[6]H){2|H<1>,5|C<3>}	H(C[6]C[6]2)	120.3840	0.105	2	120.1165	0.219	51	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Cu)(C[6]C[6]H){1|H<1>,2|C<4>,4|C<3>}	H(C[6]C[6]2)	120.2942	0.326	24	120.1165	0.219	51	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Cu)(C[6]C[6]H){1|O<2>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.1450	0.000	1	120.1165	0.219	51	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Cu)(C[6]C[6]H){1|P<4>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.9462	0.265	4	120.1165	0.219	51	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Cu)(C[6]C[6]H){3|H<1>,4|C<3>}	H(C[6]C[6]2)	119.9430	0.758	6	120.1165	0.219	51	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Cu<5>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Cu)(C[6]C[6]H){1|C<4>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.8429	0.411	8	120.1165	0.219	51	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Cu<5>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Cu)(C[6]C[6]H){1|H<1>,2|C<4>,4|C<3>}	H(C[6]C[6]2)	120.0507	0.685	4	120.1165	0.219	51	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Cu<5>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Cu)(C[6]C[6]H){3|H<1>,4|C<3>}	H(C[6]C[6]2)	120.2890	0.103	2	120.1165	0.219	51	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Fe<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Fe)(C[6]C[6]H){1|H<1>,2|C<4>,4|C<3>}	H(C[6]C[6]2)	120.1500	0.006	2	119.4274	1.662	34	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Fe<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Fe)(C[6]C[6]H){1|N<3>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.2163	1.394	10	119.4274	1.662	34	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Fe<5>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Fe)(C[6]C[6]H){1|C<4>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.5062	1.619	4	119.4274	1.662	34	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Fe<5>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Fe)(C[6]C[6]H){1|H<1>,2|C<4>,4|C<3>}	H(C[6]C[6]2)	120.0010	0.000	1	119.4274	1.662	34	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Fe<5>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Fe)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	121.0590	0.000	1	119.4274	1.662	34	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Fe<5>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Fe)(C[6]C[6]H){3|H<1>,4|C<3>}	H(C[6]C[6]2)	119.9360	0.072	2	119.4274	1.662	34	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Fe)(C[6]C[6]H){1|C<4>,1|O<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.3465	0.779	2	119.4274	1.662	34	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Fe)(C[6]C[6]H){1|C<4>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.8810	0.000	1	119.4274	1.662	34	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Fe)(C[6]C[6]H){1|N<3>,1|S<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.0883	0.147	3	119.4274	1.662	34	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Fe)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.2880	1.838	2	119.4274	1.662	34	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Fe)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	118.3280	1.357	4	119.4274	1.662	34	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|N<3>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Fe)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	118.1920	1.939	2	119.4274	1.662	34	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Ga)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ga<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Ga)(C[6]C[6]H){1|H<1>,2|C<4>,4|C<3>}	H(C[6]C[6]2)	119.1390	0.437	2	119.1390	0.191	2	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Br<1>,1|Ir<6>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.3220	1.105	2	119.8438	0.238	898	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ir<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.4150	0.000	1	119.8438	0.238	898	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ir<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H){1|H<1>,3|C<3>,3|C<4>}	H(C[6]C[6]2)	118.9610	0.000	1	119.8438	0.238	898	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ir<5>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H){1|F<1>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.2070	0.000	1	119.8438	0.238	898	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|B<3>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.9520	0.000	1	119.8438	0.238	898	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|C<4>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H){1|F<1>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.6605	0.596	8	119.8438	0.238	898	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|C<4>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.0518	0.311	17	119.8438	0.238	898	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H){1|C<3>,2|N<2>,3|H<1>}	H(C[6]C[6]2)	120.3780	0.168	2	119.8438	0.238	898	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H){1|C<4>,1|N<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.4440	0.000	1	119.8438	0.238	898	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.5528	0.241	14	119.8438	0.238	898	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H){1|Cl<1>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.6370	0.472	6	119.8438	0.238	898	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H){1|F<1>,1|N<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.6811	0.597	9	119.8438	0.238	898	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H){1|F<1>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.8709	0.423	224	119.8438	0.238	898	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H){1|N<2>,1|O<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7607	0.259	3	119.8438	0.238	898	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H){1|O<1>,1|O<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5990	0.141	2	119.8438	0.238	898	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H){1|S<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.9710	0.000	1	119.8438	0.238	898	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.6605	0.241	2	119.8438	0.238	898	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.8504	0.509	505	119.8438	0.238	898	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H){3|H<1>,4|C<3>}	H(C[6]C[6]2)	119.4527	1.215	4	119.8438	0.238	898	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|N<3>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	118.8280	0.037	2	119.8438	0.238	898	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|O<2>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.2290	0.000	1	119.8438	0.238	898	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ir<6>,4|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H){1|F<1>,1|N<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9490	0.162	3	119.8438	0.238	898	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ir<6>,4|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H){1|N<2>,1|O<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9060	0.327	3	119.8438	0.238	898	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ir<7>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H){1|F<1>,1|N<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6940	0.816	2	119.8438	0.238	898	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ir<7>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H){1|F<1>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.9252	0.146	6	119.8438	0.238	898	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ir<7>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.7460	0.499	41	119.8438	0.238	898	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ir<8>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H){1|F<1>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.3880	0.000	1	119.8438	0.238	898	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ir<8>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H){1|F<1>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.3150	0.000	1	119.8438	0.238	898	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ir<8>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H){1|O<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.1700	0.305	2	119.8438	0.238	898	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ir<8>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H){1|O<2>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.5000	0.000	1	119.8438	0.238	898	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ir<8>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.1700	0.042	2	119.8438	0.238	898	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ir<8>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.9419	0.265	22	119.8438	0.238	898	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ir<8>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H){3|H<1>,4|C<3>}	H(C[6]C[6]2)	119.4886	0.141	5	119.8438	0.238	898	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ir<9>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.1670	0.966	2	119.8438	0.238	898	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Li)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Li<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Li)(C[6]C[6]H){1|N<3>,1|O<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.7180	0.000	1	120.4757	0.048	3	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Li)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Li<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Li)(C[6]C[6]H){1|N<3>,1|O<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.2950	0.000	1	120.4757	0.048	3	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Li)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Li<5>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Li)(C[6]C[6]H){1|N<3>,1|O<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.4140	0.000	1	120.4757	0.048	3	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Mg)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Mg<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Mg)(C[6]C[6]H){1|F<1>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.2260	0.000	1	120.2260	0.000	1	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Mn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Mn<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Mn)(C[6]C[6]H){1|C<4>,1|O<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.6650	0.000	1	119.6438	0.648	16	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Mn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Mn<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Mn)(C[6]C[6]H){1|C<4>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.8438	0.191	4	119.6438	0.648	16	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Mn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Mn<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Mn)(C[6]C[6]H){1|C<4>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	117.6900	0.068	2	119.6438	0.648	16	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Mn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Mn<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Mn)(C[6]C[6]H){1|H<1>,2|C<4>,4|C<3>}	H(C[6]C[6]2)	119.8885	0.023	2	119.6438	0.648	16	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Mn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Mn<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Mn)(C[6]C[6]H){1|N<3>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.6810	0.000	1	119.6438	0.648	16	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Mn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Mn<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Mn)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.9876	0.091	5	119.6438	0.648	16	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Mn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Mn<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Mn)(C[6]C[6]H){3|H<1>,4|C<3>}	H(C[6]C[6]2)	119.4850	0.000	1	119.6438	0.648	16	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Mo)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Mo<5>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Mo)(C[6]C[6]H){1|O<2>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.9205	0.090	2	119.9925	0.010	4	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Mo)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Mo<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Mo)(C[6]C[6]H){1|O<2>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.0645	0.025	2	119.9925	0.010	4	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Ni)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ni<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Ni)(C[6]C[6]H){1|C<4>,1|O<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.1500	0.000	1	119.4523	1.768	38	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Ni)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ni<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Ni)(C[6]C[6]H){1|C<4>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.5920	0.000	1	119.4523	1.768	38	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Ni)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ni<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Ni)(C[6]C[6]H){1|H<1>,2|C<4>,4|C<3>}	H(C[6]C[6]2)	119.8955	0.011	2	119.4523	1.768	38	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Ni)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ni<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Ni)(C[6]C[6]H){1|O<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.9450	0.092	2	119.4523	1.768	38	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Ni)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ni<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Ni)(C[6]C[6]H){1|O<2>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	118.3660	0.000	1	119.4523	1.768	38	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Ni)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ni<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Ni)(C[6]C[6]H){1|O<2>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.2335	0.192	2	119.4523	1.768	38	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Ni)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ni<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Ni)(C[6]C[6]H){1|P<4>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.7560	0.000	1	119.4523	1.768	38	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Ni)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ni<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Ni)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.0853	0.041	4	119.4523	1.768	38	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Ni)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ni<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Ni)(C[6]C[6]H){3|C<3>,4|H<1>}	H(C[6]C[6]2)	119.9710	0.000	1	119.4523	1.768	38	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Ni)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ni<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Ni)(C[6]C[6]H){3|H<1>,4|C<3>}	H(C[6]C[6]2)	120.0165	0.223	2	119.4523	1.768	38	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Ni)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ni<5>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Ni)(C[6]C[6]H){1|C<4>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.1545	0.634	8	119.4523	1.768	38	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Ni)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ni<5>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Ni)(C[6]C[6]H){1|O<3>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.4110	0.252	2	119.4523	1.768	38	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Ni)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Ni)(C[6]C[6]H){1|C<4>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	118.1598	2.312	8	119.4523	1.768	38	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Ni)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Ni)(C[6]C[6]H){1|H<1>,2|C<4>,4|C<3>}	H(C[6]C[6]2)	119.2150	0.000	1	119.4523	1.768	38	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Ni)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ni<7>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Ni)(C[6]C[6]H){1|C<4>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	118.6395	0.583	2	119.4523	1.768	38	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Os)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Os<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Os)(C[6]C[6]H){1|F<1>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.9715	0.283	8	119.8104	0.098	31	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Os)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Os<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Os)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.7083	0.315	18	119.8104	0.098	31	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Os)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Os<7>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Os)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.1700	0.000	1	119.8104	0.098	31	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Os)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Os<9>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Os)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.8575	0.239	4	119.8104	0.098	31	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Pd)(C[6]C[6]H){1|C<4>,1|O<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.7125	0.425	2	119.9476	1.744	116	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Pd)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.0590	0.000	1	119.9476	1.744	116	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Pd)(C[6]C[6]H){1|C<4>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.6430	0.000	1	119.9476	1.744	116	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Pd)(C[6]C[6]H){1|C<4>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.0650	0.160	2	119.9476	1.744	116	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Pd)(C[6]C[6]H){1|F<1>,1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.7467	0.185	4	119.9476	1.744	116	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Pd)(C[6]C[6]H){1|H<1>,1|N<3>,2|C<4>,3|C<3>}	H(C[6]C[6]2)	120.2290	0.000	1	119.9476	1.744	116	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Pd)(C[6]C[6]H){1|H<1>,3|C<3>,3|C<4>}	H(C[6]C[6]2)	119.6810	0.000	1	119.9476	1.744	116	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Pd)(C[6]C[6]H){1|N<3>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	121.0390	2.522	3	119.9476	1.744	116	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Pd)(C[6]C[6]H){1|O<2>,1|S<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.3000	0.000	1	119.9476	1.744	116	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Pd)(C[6]C[6]H){1|O<2>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	118.9930	0.748	2	119.9476	1.744	116	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Pd)(C[6]C[6]H){2|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.4330	0.000	2	119.9476	1.744	116	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Pd)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.2836	0.399	15	119.9476	1.744	116	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Pd)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.7955	1.646	57	119.9476	1.744	116	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Pd)(C[6]C[6]H){3|C<3>,4|H<1>}	H(C[6]C[6]2)	119.8487	0.441	4	119.9476	1.744	116	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Pd)(C[6]C[6]H){3|H<1>,4|C<3>}	H(C[6]C[6]2)	119.9414	0.913	8	119.9476	1.744	116	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pd<4>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Pd)(C[6]C[6]H){1|C<2>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	116.3170	0.000	1	119.9476	1.744	116	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pd<4>,4|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Pd)(C[6]C[6]H){2|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.9595	0.293	2	119.9476	1.744	116	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pd<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Pd)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.2892	0.217	5	119.9476	1.744	116	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pd<7>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Pd)(C[6]C[6]H){3|H<1>,4|C<3>}	H(C[6]C[6]2)	120.0725	0.416	4	119.9476	1.744	116	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|C<4>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Pt)(C[6]C[6]H){1|F<1>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.8023	0.193	4	120.0879	0.206	429	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|C<4>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Pt)(C[6]C[6]H){1|O<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.7990	0.000	1	120.0879	0.206	429	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|C<4>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Pt)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.6639	0.334	15	120.0879	0.206	429	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|C<4>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Pt)(C[6]C[6]H){3|C<3>,4|H<1>}	H(C[6]C[6]2)	119.6280	0.000	1	120.0879	0.206	429	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Pt)(C[6]C[6]H){1|C<4>,1|H<1>,4|C<3>}	H(C[6]C[6]2)	119.6920	0.000	1	120.0879	0.206	429	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Pt)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.4050	0.310	2	120.0879	0.206	429	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Pt)(C[6]C[6]H){1|C<4>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.4905	0.189	2	120.0879	0.206	429	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Pt)(C[6]C[6]H){1|C<4>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.9550	0.000	1	120.0879	0.206	429	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Pt)(C[6]C[6]H){1|F<1>,1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.7451	0.209	7	120.0879	0.206	429	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Pt)(C[6]C[6]H){1|F<1>,1|H<1>,4|C<3>}	H(C[6]C[6]2)	120.3330	0.000	1	120.0879	0.206	429	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Pt)(C[6]C[6]H){1|F<1>,1|N<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0950	0.000	1	120.0879	0.206	429	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Pt)(C[6]C[6]H){1|F<1>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.0155	0.344	21	120.0879	0.206	429	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Pt)(C[6]C[6]H){1|H<1>,2|C<4>,4|C<3>}	H(C[6]C[6]2)	119.9660	0.000	1	120.0879	0.206	429	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Pt)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.4836	0.072	8	120.0879	0.206	429	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Pt)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.3209	0.509	86	120.0879	0.206	429	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Pt)(C[6]C[6]H){2|H<1>,5|C<3>}	H(C[6]C[6]2)	119.9760	0.000	1	120.0879	0.206	429	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Pt)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.0024	0.432	201	120.0879	0.206	429	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Pt)(C[6]C[6]H){3|C<3>,4|H<1>}	H(C[6]C[6]2)	119.7432	0.325	9	120.0879	0.206	429	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Pt)(C[6]C[6]H){3|H<1>,4|C<3>}	H(C[6]C[6]2)	119.8135	0.270	6	120.0879	0.206	429	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|N<3>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Pt)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.2565	0.141	2	120.0879	0.206	429	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pt<4>,4|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Pt)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.8860	0.125	3	120.0879	0.206	429	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pt<5>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Pt)(C[6]C[6]H){1|F<1>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.1610	0.000	1	120.0879	0.206	429	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pt<5>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Pt)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.5100	0.000	1	120.0879	0.206	429	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pt<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Pt)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.4620	0.000	1	120.0879	0.206	429	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pt<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Pt)(C[6]C[6]H){1|F<1>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.0620	0.082	3	120.0879	0.206	429	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pt<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Pt)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.3165	0.348	17	120.0879	0.206	429	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pt<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Pt)(C[6]C[6]H){2|H<1>,5|C<3>}	H(C[6]C[6]2)	119.5870	0.000	1	120.0879	0.206	429	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pt<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Pt)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.1384	0.251	26	120.0879	0.206	429	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pt<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Pt)(C[6]C[6]H){3|H<1>,4|C<3>}	H(C[6]C[6]2)	119.6352	0.379	5	120.0879	0.206	429	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Re)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Re<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Re)(C[6]C[6]H){1|O<2>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.2175	0.013	2	119.9693	0.185	3	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Re)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Re<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Re)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.4730	0.000	1	119.9693	0.185	3	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Rh)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Rh<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Rh)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.0325	0.309	8	119.9618	0.119	63	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Rh)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Rh<8>,1|C<4>,1|H<1>,2|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Rh)(C[6]C[6]H){1|H<1>,1|N<3>,2|C<4>,3|C<3>}	H(C[6]C[6]2)	119.9600	0.151	2	119.9618	0.119	63	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Rh)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Rh<8>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Rh)(C[6]C[6]H){1|C<4>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.8353	0.107	3	119.9618	0.119	63	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Rh)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Rh<8>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Rh)(C[6]C[6]H){1|H<1>,1|N<3>,2|C<4>,3|C<3>}	H(C[6]C[6]2)	119.8700	0.000	1	119.9618	0.119	63	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Rh)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Rh<8>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Rh)(C[6]C[6]H){1|N<3>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.6093	0.208	3	119.9618	0.119	63	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Rh)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Rh<8>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Rh)(C[6]C[6]H){1|O<3>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.6170	0.000	1	119.9618	0.119	63	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Rh)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Rh<8>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Rh)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.0964	0.277	31	119.9618	0.119	63	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Rh)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Rh<8>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Rh)(C[6]C[6]H){3|C<3>,4|H<1>}	H(C[6]C[6]2)	119.6810	0.000	1	119.9618	0.119	63	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Rh)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Rh<8>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Rh)(C[6]C[6]H){3|H<1>,4|C<3>}	H(C[6]C[6]2)	119.4703	0.138	6	119.9618	0.119	63	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Rh)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Rh<9>,1|C<4>,1|H<1>,2|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Rh)(C[6]C[6]H){1|H<1>,1|N<3>,2|C<4>,3|C<3>}	H(C[6]C[6]2)	120.4507	0.394	3	119.9618	0.119	63	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Rh)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Rh<9>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Rh)(C[6]C[6]H){1|C<4>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.6877	0.223	4	119.9618	0.119	63	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ru<5>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Ru)(C[6]C[6]H){1|N<5>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.2030	0.000	1	119.9539	0.117	41	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Ru)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.3678	0.240	4	119.9539	0.117	41	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Ru)(C[6]C[6]H){1|H<1>,2|C<4>,4|C<3>}	H(C[6]C[6]2)	119.9495	0.084	2	119.9539	0.117	41	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Ru)(C[6]C[6]H){1|N<3>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.6370	0.000	1	119.9539	0.117	41	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Ru)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.9865	0.401	2	119.9539	0.117	41	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Ru)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.8499	0.374	21	119.9539	0.117	41	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ru<7>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Ru)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.0515	0.086	2	119.9539	0.117	41	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ru<9>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Ru)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.7220	0.000	1	119.9539	0.117	41	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ru<9>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Ru)(C[6]C[6]H){1|N<3>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.7030	0.000	1	119.9539	0.117	41	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ru<9>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Ru)(C[6]C[6]H){1|S<3>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.0770	0.000	1	119.9539	0.117	41	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ru<9>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Ru)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.0948	0.236	5	119.9539	0.117	41	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Te)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Te<5>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Te)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	121.2080	0.000	1	120.7353	0.219	3	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Te)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Te<7>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Te)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.4990	0.320	2	120.7353	0.219	3	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Ti)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ti<7>,1|C<4>,1|H<1>,2|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Ti)(C[6]C[6]H){1|H<1>,1|N<3>,2|C<4>,3|C<3>}	H(C[6]C[6]2)	120.1355	0.199	4	120.1355	0.040	4	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Zn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Zn<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Zn)(C[6]C[6]H){1|H<1>,2|C<4>,4|C<3>}	H(C[6]C[6]2)	120.1937	0.192	3	120.0105	0.468	18	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Zn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Zn<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Zn)(C[6]C[6]H){3|C<3>,4|H<1>}	H(C[6]C[6]2)	119.9360	0.000	1	120.0105	0.468	18	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Zn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Zn<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Zn)(C[6]C[6]H){3|H<1>,4|C<3>}	H(C[6]C[6]2)	120.0815	0.064	2	120.0105	0.468	18	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Zn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Zn<5>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Zn)(C[6]C[6]H){1|C<4>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.9472	1.031	8	120.0105	0.468	18	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Zn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Zn<5>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Zn)(C[6]C[6]H){1|O<3>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.9828	0.306	4	120.0105	0.468	18	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Zr)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Zr<11>,1|C<4>,1|H<1>,2|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Zr)(C[6]C[6]H){1|B<3>,1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.2605	0.158	2	120.2605	0.025	2	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]N[6a])(N[6]C[6]As)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|As<2>,1|H<1>,1|N<2>,2|C<3>}	C[6](C[6a]C[6a]N[6a])(N[6]C[6]As)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.3010	0.000	1	120.3010	0.000	1	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]N[6a])(N[6]C[6]Co)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Co<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6a]C[6a]N[6a])(N[6]C[6]Co)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.1633	1.460	16	120.1633	2.131	16	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]N[6a])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|H<1>,1|N<2>,2|C<3>}	C[6](C[6a]C[6a]N[6a])(N[6]C[6]Cu)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.0900	0.000	1	120.3705	0.064	8	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]N[6a])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6a]C[6a]N[6a])(N[6]C[6]Cu)(C[6]C[6]H){1|O<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.7620	0.000	1	120.3705	0.064	8	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]N[6a])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Cu<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6a]C[6a]N[6a])(N[6]C[6]Cu)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.3520	0.208	6	120.3705	0.064	8	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]N[6a])(N[6]C[6]In)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|In<5>,1|H<1>,1|N<2>,2|C<3>}	C[6](C[6a]C[6a]N[6a])(N[6]C[6]In)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.1450	0.000	1	120.1450	0.000	1	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]N[6a])(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|H<1>,1|N<2>,2|C<3>}	C[6](C[6a]C[6a]N[6a])(N[6]C[6]Ir)(C[6]C[6]H){2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.6284	0.422	5	120.4523	0.223	7	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]N[6a])(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|H<1>,1|N<2>,2|C<3>}	C[6](C[6a]C[6a]N[6a])(N[6]C[6]Ir)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.0120	0.290	2	120.4523	0.223	7	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]N[6a])(N[6]C[6]Mn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Mn<6>,1|H<1>,1|N<2>,2|C<3>}	C[6](C[6a]C[6a]N[6a])(N[6]C[6]Mn)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.8590	0.000	1	119.8590	0.000	1	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]N[6a])(N[6]C[6]Ni)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ni<4>,1|H<1>,1|N<2>,2|C<3>}	C[6](C[6a]C[6a]N[6a])(N[6]C[6]Ni)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	116.3790	0.000	1	116.3790	0.000	1	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]N[6a])(N[6]C[6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,1|N<2>,2|C<3>}	C[6](C[6a]C[6a]N[6a])(N[6]C[6]Pd)(C[6]C[6]H){1|N<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.1484	0.194	9	120.0795	0.097	11	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]N[6a])(N[6]C[6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,1|N<2>,2|C<3>}	C[6](C[6a]C[6a]N[6a])(N[6]C[6]Pd)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.3020	0.000	1	120.0795	0.097	11	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]N[6a])(N[6]C[6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6a]C[6a]N[6a])(N[6]C[6]Pd)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.2360	0.000	1	120.0795	0.097	11	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]N[6a])(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,1|N<2>,2|C<3>}	C[6](C[6a]C[6a]N[6a])(N[6]C[6]Pt)(C[6]C[6]H){1|N<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.0475	0.109	6	120.1819	0.069	9	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]N[6a])(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,1|N<2>,2|C<3>}	C[6](C[6a]C[6a]N[6a])(N[6]C[6]Pt)(C[6]C[6]H){2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.5955	0.211	2	120.1819	0.069	9	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]N[6a])(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Pt<6>,1|H<1>,1|N<2>,2|C<3>}	C[6](C[6a]C[6a]N[6a])(N[6]C[6]Pt)(C[6]C[6]H){2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.1610	0.000	1	120.1819	0.069	9	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]N[6a])(N[6]C[6]Re)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Re<6>,1|H<1>,1|N<2>,2|C<3>}	C[6](C[6a]C[6a]N[6a])(N[6]C[6]Re)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.9417	0.384	7	119.5460	1.379	8	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]N[6a])(N[6]C[6]Re)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Re<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6a]C[6a]N[6a])(N[6]C[6]Re)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	116.7760	0.000	1	119.5460	1.379	8	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]N[6a])(N[6]C[6]Rh)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Rh<5>,1|H<1>,1|N<2>,2|C<3>}	C[6](C[6a]C[6a]N[6a])(N[6]C[6]Rh)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.4620	1.013	2	119.5888	0.417	4	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]N[6a])(N[6]C[6]Rh)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Rh<8>,1|H<1>,1|N<2>,2|C<3>}	C[6](C[6a]C[6a]N[6a])(N[6]C[6]Rh)(C[6]C[6]H){2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.0000	0.000	1	119.5888	0.417	4	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]N[6a])(N[6]C[6]Rh)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Rh<8>,1|H<1>,1|N<2>,2|C<3>}	C[6](C[6a]C[6a]N[6a])(N[6]C[6]Rh)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.4310	0.000	1	119.5888	0.417	4	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]N[6a])(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|H<1>,1|N<2>,2|C<3>}	C[6](C[6a]C[6a]N[6a])(N[6]C[6]Ru)(C[6]C[6]H){1|C<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.5770	0.000	1	120.1260	0.407	2	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]N[6a])(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|H<1>,1|N<2>,2|C<3>}	C[6](C[6a]C[6a]N[6a])(N[6]C[6]Ru)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.6750	0.000	1	120.1260	0.407	2	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]N[6a])(N[6]C[6]Zn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Zn<4>,1|H<1>,1|N<2>,2|C<3>}	C[6](C[6a]C[6a]N[6a])(N[6]C[6]Zn)(C[6]C[6]H){1|N<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.4570	0.199	5	120.4570	0.040	5	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]N[6a]2)(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>,2|N<3>}	C[6](C[6a]N[6a]2)(N[6]C[6]Cu)(C[6]C[6]H){1|C<3>,2|N<3>,3|H<1>}	H(C[6]C[6]2)	120.9020	0.000	1	120.9020	0.000	1	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6a]N[6a]2)(N[6]C[6]Eu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|Eu<11>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[6a]N[6a]2)(N[6]C[6]Eu)(C[6]C[6]H){2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.6010	0.000	1	120.6010	0.000	1	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]I)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]I)(H){1|Pt<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Pt)(C[6]C[6]H){1|H<1>,1|I<1>,4|C<3>}	H(C[6]C[6]2)	120.6020	0.518	2	120.6020	0.268	2	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]N)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]N)(H){1|Cu<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Cu)(C[6]C[6]H){1|N<3>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.4305	0.073	2	119.2168	0.060	5	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]N)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]N)(H){1|Cu<5>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Cu)(C[6]C[6]H){1|H<1>,1|N<3>,1|O<2>,4|C<3>}	H(C[6]C[6]2)	119.0743	0.202	3	119.2168	0.060	5	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]N)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]N)(H){1|Fe<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Fe)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	118.3610	0.000	1	118.3610	0.000	1	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]N)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]N)(H){1|Ir<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H){1|F<1>,1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	119.4009	0.257	10	119.4009	0.066	10	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]N)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]N)(H){1|Pt<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Pt)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.6390	0.000	1	119.6390	0.000	1	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]N)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]N)(H){1|Ru<9>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Ru)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.7810	0.000	1	119.7810	0.000	1	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]N)(H)	C[6](C[6a]C[6a]N[6a])(N[6]C[6]Re)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]N)(H){1|Re<6>,1|H<1>,1|N<2>,2|C<3>}	C[6](C[6a]C[6a]N[6a])(N[6]C[6]Re)(C[6]C[6]H){1|H<1>,1|N<3>,4|C<3>}	H(C[6]C[6]2)	119.7200	0.000	1	119.7200	0.000	1	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]O)(H)	C[6](C[6a]C[6,6a]C[6a])(N[6]C[6]Cr)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]O)(H){1|Cr<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6,6a]C[6a])(N[6]C[6]Cr)(C[6]C[6]H){1|H<1>,1|N<3>,1|O<2>,4|C<3>}	H(C[6]C[6]2)	120.2200	0.107	2	120.2200	0.012	2	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]O)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]O)(H){1|Ir<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H){1|F<1>,1|H<1>,1|N<2>,1|O<2>,2|C<3>}	H(C[6]C[6]2)	120.0190	0.000	1	120.3238	0.225	6	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]O)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]O)(H){1|Ir<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H){1|F<1>,1|H<1>,1|O<2>,3|C<3>}	H(C[6]C[6]2)	120.3848	0.503	5	120.3238	0.225	6	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]O)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Re)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]O)(H){1|Re<6>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Re)(C[6]C[6]H){1|O<2>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.9690	0.000	1	119.9690	0.000	1	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]O)(H)	C[6](C[6a]C[6a]N[6a])(N[6]C[6]Re)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]O)(H){1|Re<6>,1|H<1>,1|N<2>,2|C<3>}	C[6](C[6a]C[6a]N[6a])(N[6]C[6]Re)(C[6]C[6]H){1|H<1>,1|O<2>,4|C<3>}	H(C[6]C[6]2)	120.5210	0.068	2	120.5210	0.005	2	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]Pt)(H)	C[6](C[6a]C[6a,6a]C[6a])(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]Pt)(H){1|Pt<4>,4|C<3>}	C[6](C[6a]C[6a,6a]C[6a])(N[6]C[6]Pt)(C[6]C[6]H){1|Pt<4>,1|H<1>,4|C<3>}	H(C[6]C[6]2)	118.6100	0.000	1	118.6100	0.000	1	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]Pt)(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]Pt)(H){1|Pt<4>,4|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Pt)(C[6]C[6]H){1|Pt<4>,1|F<1>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.8880	0.000	1	119.8880	0.000	1	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])2(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])2(H){1|Ir<6>,5|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Ir)(C[6]C[6]H){1|N<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.9675	0.104	2	119.9675	0.011	2	119.8662	0.490	2275	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:P[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6a]P[6])(H)	C[6](C[6a]C[6a]2)(P[6]C[6]Au)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6a]P[6])(H){1|Au<2>,1|H<1>,5|C<3>}	C[6](C[6a]C[6a]2)(P[6]C[6]Au)(C[6]C[6]H){1|O<1>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	117.0090	0.000	1	117.0090	0.000	1	116.9076	0.392	10	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:P[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6a]P[6])(H)	C[6](C[6a]C[6a]2)(P[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6a]P[6])(H){1|Cu<4>,1|C<4>,5|C<3>}	C[6](C[6a]C[6a]2)(P[6]C[6]Cu)(C[6]C[6]H){2|H<1>,5|C<3>}	H(C[6]C[6]2)	116.6003	0.079	4	116.6003	0.006	4	116.9076	0.392	10	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:P[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6a]P[6])(H)	C[6](C[6a]C[6a]2)(P[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6a]P[6])(H){1|Ir<8>,1|H<1>,5|C<3>}	C[6](C[6a]C[6a]2)(P[6]C[6]Ir)(C[6]C[6]H){1|H<1>,5|C<3>}	H(C[6]C[6]2)	117.9230	0.000	1	117.1795	1.106	2	116.9076	0.392	10	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:P[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6a]P[6])(H)	C[6](C[6a]C[6a]2)(P[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6a]P[6])(H){1|Ir<8>,1|H<1>,5|C<3>}	C[6](C[6a]C[6a]2)(P[6]C[6]Ir)(C[6]C[6]H){2|H<1>,5|C<3>}	H(C[6]C[6]2)	116.4360	0.000	1	117.1795	1.106	2	116.9076	0.392	10	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:P[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6a]P[6])(H)	C[6](C[6a]C[6a]2)(P[6]C[6]Mo)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6a]P[6])(H){1|Mo<6>,1|H<1>,5|C<3>}	C[6](C[6a]C[6a]2)(P[6]C[6]Mo)(C[6]C[6]H){2|H<1>,5|C<3>}	H(C[6]C[6]2)	116.5680	0.000	1	116.5680	0.000	1	116.9076	0.392	10	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:P[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6a]P[6])(H)	C[6](C[6a]C[6a]2)(P[6]C[6]Rh)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6a]P[6])(H){1|Rh<8>,1|H<1>,5|C<3>}	C[6](C[6a]C[6a]2)(P[6]C[6]Rh)(C[6]C[6]H){1|H<1>,5|C<3>}	H(C[6]C[6]2)	118.1830	0.000	1	117.3695	1.324	2	116.9076	0.392	10	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:P[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6a]P[6])(H)	C[6](C[6a]C[6a]2)(P[6]C[6]Rh)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6a]P[6])(H){1|Rh<8>,1|H<1>,5|C<3>}	C[6](C[6a]C[6a]2)(P[6]C[6]Rh)(C[6]C[6]H){2|H<1>,5|C<3>}	H(C[6]C[6]2)	116.5560	0.000	1	117.3695	1.324	2	116.9076	0.392	10	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	Ga-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]Ga)(C[6]C[6]H)(H)	C[6](GaC[6a]N[5])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]Ga)(C[6]C[6]H)(H){1|C<2>,2|H<1>}	C[6](GaC[6a]N[5])(C[6]C[6]H)2{1|C<3>,1|H<1>}	H(C[6]C[6]2)	115.4520	0.000	1	115.4520	0.000	1	115.4520	0.000	1	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]H)(H)	C[6](NC[6a]C[6])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](NC[6a]C[6])(C[6]C[6]H)2{1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.3392	0.374	4	120.3392	0.140	4	120.3392	0.140	4	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](NC[6a]C[6])(N[6]C[6]Co)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](NC[6a]C[6])(N[6]C[6]Co)(C[6]C[6]H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5167	0.527	3	120.6747	0.084	10	120.4950	0.130	105	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](NC[6a]C[6])(N[6]C[6]Co)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](NC[6a]C[6])(N[6]C[6]Co)(C[6]C[6]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.7424	0.125	7	120.6747	0.084	10	120.4950	0.130	105	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](NC[6a]C[6])(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](NC[6a]C[6])(N[6]C[6]Fe)(C[6]C[6]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6272	0.318	41	120.6272	0.101	41	120.4950	0.130	105	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](NC[6a]C[6])(N[6]C[6]Ni)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](NC[6a]C[6])(N[6]C[6]Ni)(C[6]C[6]H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7952	0.365	4	120.7952	0.133	4	120.4950	0.130	105	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](NC[6a]C[6])(N[6]C[6]Os)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Os<6>,1|C<3>,1|H<1>}	C[6](NC[6a]C[6])(N[6]C[6]Os)(C[6]C[6]H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.0735	0.166	2	120.0735	0.028	2	120.4950	0.130	105	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](NC[6a]C[6])(N[6]C[6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](NC[6a]C[6])(N[6]C[6]Pd)(C[6]C[6]H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3020	0.049	3	120.3020	0.002	3	120.4950	0.130	105	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](NC[6a]C[6])(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](NC[6a]C[6])(N[6]C[6]Pt)(C[6]C[6]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3120	0.438	4	120.1872	0.135	20	120.4950	0.130	105	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](NC[6a]C[6])(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](NC[6a]C[6])(N[6]C[6]Pt)(C[6]C[6]H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.1559	0.358	16	120.1872	0.135	20	120.4950	0.130	105	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](NC[6a]C[6])(N[6]C[6]Re)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](NC[6a]C[6])(N[6]C[6]Re)(C[6]C[6]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4065	0.265	17	120.4065	0.070	17	120.4950	0.130	105	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](NC[6a]C[6])(N[6]C[6]Zn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](NC[6a]C[6])(N[6]C[6]Zn)(C[6]C[6]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6625	0.286	6	120.5784	0.097	8	120.4950	0.130	105	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](NC[6a]C[6])(N[6]C[6]Zn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Zn<6>,1|C<3>,1|H<1>}	C[6](NC[6a]C[6])(N[6]C[6]Zn)(C[6]C[6]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3260	0.320	2	120.5784	0.097	8	120.4950	0.130	105	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[3x6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]N[3x6]C)(C[6]C[6]H)(H)	C[6](N[3x6]Ge[3x6]C[3x6])(C[6]C[6]H)(CHP)	H(C[6]C[6]2)	C[6](C[6]N[3x6]C)(C[6]C[6]H)(H){1|Ge<3>,1|C<3>,1|H<1>}	C[6](N[3x6]Ge[3x6]C[3x6])(C[6]C[6]H)(CHP){1|C<3>,1|H<1>,1|N<3>,2|C<4>}	H(C[6]C[6]2)	119.9250	0.000	1	119.9250	0.000	1	119.9250	0.000	1	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[4,6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]N[4,6]N)(C[6]C[6]H)(H)	C[6](N[4,6]C[4,6]B[4])(C[6]C[6]H)(NB[4]Si)	H(C[6]C[6]2)	C[6](C[6]N[4,6]N)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](N[4,6]C[4,6]B[4])(C[6]C[6]H)(NB[4]Si){1|Cl<1>,1|C<3>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.1537	0.199	3	120.1537	0.039	3	120.1537	0.039	3	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]N[5,6]C)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]In[5])(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]N[5,6]C)(C[6]C[6]H)(H){1|In<4>,1|C<3>,1|H<1>}	C[6](N[5,6]C[5,6]In[5])(C[6]C[6]H)(CCN){1|Cl<1>,1|H<1>,1|N<3>,1|S<2>,2|C<3>}	H(C[6]C[6]2)	120.4860	0.000	1	120.4860	0.000	1	120.4079	0.194	8	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]N[5,6]C)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]P[5])(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]N[5,6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<2>}	C[6](N[5,6]C[5,6]P[5])(C[6]C[6]H)(CHN){1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.8345	0.537	2	119.8345	0.288	2	120.4079	0.194	8	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]N[5,6]C)(C[6]C[6]H)(H)	C[6](N[5,6]In[3x5]C[5,6])(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]N[5,6]C)(C[6]C[6]H)(H){1|In<6>,1|C<3>,1|H<1>}	C[6](N[5,6]In[3x5]C[5,6])(C[6]C[6]H)(COO){1|H<1>,2|C<3>,2|N<3>,3|O<2>}	H(C[6]C[6]2)	120.7180	0.231	3	120.7180	0.053	3	120.4079	0.194	8	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]N[5,6]C)(C[6]C[6]H)(H)	C[6](N[5,6]In[5,5]C[5,6])(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]N[5,6]C)(C[6]C[6]H)(H){1|In<6>,1|C<3>,1|H<1>}	C[6](N[5,6]In[5,5]C[5,6])(C[6]C[6]H)(CCN){2|Cl<1>,1|H<1>,1|N<3>,2|C<3>,2|S<2>}	H(C[6]C[6]2)	120.4770	0.027	2	120.4770	0.001	2	120.4079	0.194	8	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5,6]C[6])(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]N[6])(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]C[6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<2>}	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]N[6])(C[6]C[6]H){1|Br<1>,1|H<1>,1|N<3>,4|C<3>}	H(C[6]C[6]2)	119.3470	0.000	1	119.3470	0.000	1	119.4405	0.017	2	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5,6]C[6])(C[6]N[6]H)(H)	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]N[6])(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]C[6])(C[6]N[6]H)(H){2|C<3>,2|N<3>}	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]N[6])(C[6]C[6]H){1|Pd<4>,1|N<2>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.5340	0.000	1	119.5340	0.000	1	119.4405	0.017	2	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]N[5,6]N)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]B[5])(C[6]C[6]H)(NSiH)	H(C[6]C[6]2)	C[6](C[6]N[5,6]N)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](N[5,6]C[5,6]B[5])(C[6]C[6]H)(NSiH){1|H<1>,2|C<4>,3|C<3>}	H(C[6]C[6]2)	119.8000	0.000	1	119.8000	0.000	1	119.3542	2.415	5	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]N[5,6]N)(C[6]N[6]H)(H)	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]N[5,6]N)(C[6]N[6]H)(H){1|C<3>,1|N<2>}	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(NHH){1|C<3>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.0915	0.206	2	119.2428	3.137	4	119.3542	2.415	5	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]N[5,6]N)(C[6]N[6]H)(H)	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]N[5,6]N)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|N<2>}	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(NHH){1|C<3>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	118.3940	2.547	2	119.2428	3.137	4	119.3542	2.415	5	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:P-3:	C[6]-3:	C[6](C[6]N[5,6]P)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]Ga[5])(C[6]C[6]H)(PC[6a]2)	H(C[6]C[6]2)	C[6](C[6]N[5,6]P)(C[6]C[6]H)(H){1|Ga<4>,1|C<3>,1|H<1>}	C[6](N[5,6]C[5,6]Ga[5])(C[6]C[6]H)(PC[6a]2){2|Cl<1>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.4615	0.114	2	120.4615	0.013	2	120.2798	0.071	4	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:P-3:	C[6]-3:	C[6](C[6]N[5,6]P)(C[6]C[6]H)(H)	C[6](N[5,6]In[5,5]C[5,6])(C[6]C[6]H)(PC[6a]2)	H(C[6]C[6]2)	C[6](C[6]N[5,6]P)(C[6]C[6]H)(H){1|In<5>,1|C<3>,1|H<1>}	C[6](N[5,6]In[5,5]C[5,6])(C[6]C[6]H)(PC[6a]2){2|Cl<1>,1|H<1>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	120.0980	0.262	2	120.0980	0.068	2	120.2798	0.071	4	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5,6]C[6a])(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]Ga[5])(C[6a]C[6a]N[6a])(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]C[6a])(C[6]C[6]H)(H){1|Ga<4>,1|H<1>,1|N<2>,2|C<3>}	C[6](N[5,6]C[5,6]Ga[5])(C[6a]C[6a]N[6a])(C[6]C[6]H){2|Cl<1>,1|N<3>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.6715	0.141	2	120.6715	0.020	2	119.7000	0.602	6	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5,6]C[6a])(C[6]C[6]O)(H)	C[6](N[5,6]C[5,6]C[5])(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]C[6a])(C[6]C[6]O)(H){2|C<3>,2|C<4>,2|H<1>}	C[6](N[5,6]C[5,6]C[5])(C[6a]C[6a]2)(C[6]C[6]H){1|O<1>,2|C<3>,3|C<4>,5|H<1>}	H(C[6]C[6]2)	119.1437	0.222	3	119.2142	0.053	4	119.7000	0.602	6	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5,6]C[6a])(C[6]C[6]O)(H)	C[6](N[5,6]C[5,6]C[5])(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]C[6a])(C[6]C[6]O)(H){2|C<3>,2|C<4>,2|H<1>}	C[6](N[5,6]C[5,6]C[5])(C[6a]C[6a]2)(C[6]C[6]H){1|O<1>,2|C<3>,4|C<4>,4|H<1>}	H(C[6]C[6]2)	119.4260	0.000	1	119.2142	0.053	4	119.7000	0.602	6	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[5])(C[6]C[6]C)(H)	C[6](N[5]C[5]N[5])(C[6]C[6]H)(C[6]C[6]O)	H(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]C[6]C)(H){1|H<1>,1|N<2>,1|O<1>,2|C<3>}	C[6](N[5]C[5]N[5])(C[6]C[6]H)(C[6]C[6]O){1|H<1>,1|N<3>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	120.2010	0.000	1	120.2010	0.000	1	116.1065	33.530	2	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[5])(C[6]C[6]H)(H)	C[6](N[5]C[5]N[5])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|H<1>,1|N<2>,1|O<2>}	C[6](N[5]C[5]N[5])(C[6]C[6]H)2{1|C<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	112.0120	0.000	1	112.0120	0.000	1	116.1065	33.530	2	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5,6a]In[5,5])(C[6]C[6]H)(N[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|In<6>,2|C<3>,2|H<1>}	C[6](N[5]C[5,6a]In[5,5])(C[6]C[6]H)(N[6]C[6]H){3|Cl<1>,2|H<1>,2|N<3>,3|C<3>}	H(C[6]C[6]2)	119.8280	0.000	1	119.8280	0.000	1	119.8280	0.000	1	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]N[5]N[6])(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]N[5]N[6])(H){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>,2|C<4>}	C[6](N[5]C[5]N[5])(N[6]C[6]Fe)(C[6]C[6]H){1|H<1>,2|N<3>,3|C<3>}	H(C[6]C[6]2)	120.9282	0.278	4	120.9282	0.077	4	121.3498	0.283	367	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[5]N[6])(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[5]N[6])(H){1|Fe<6>,1|H<1>,1|N<3>,4|C<3>}	C[6](N[5]C[5]N[5])(N[6]C[6]Fe)(C[6]C[6]H){1|H<1>,1|N<3>,4|C<3>}	H(C[6]C[6]2)	120.9818	0.404	4	120.9818	0.163	4	121.3498	0.283	367	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6,6]H)(H)	C[6](N[5]C[5]N[5])(N[6]C[6,6]Ni)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6,6]H)(H){1|Ni<6>,1|N<3>,3|C<3>}	C[6](N[5]C[5]N[5])(N[6]C[6,6]Ni)(C[6]C[6]H){1|C<4>,1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.7230	0.275	3	120.7230	0.075	3	121.3498	0.283	367	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]C)(H)	C[6](N[5]C[5,6a]C[5])(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]C)(H){1|Ir<6>,1|H<1>,3|C<3>}	C[6](N[5]C[5,6a]C[5])(N[6]C[6]Ir)(C[6]C[6]H){1|C<4>,1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.4245	0.006	2	120.4245	0.000	2	121.3498	0.283	367	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]C)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Co)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]C)(H){1|Co<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](N[5]C[5]N[5])(N[6]C[6]Co)(C[6]C[6]H){1|C<2>,1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	121.6175	0.006	2	121.6175	0.000	2	121.3498	0.283	367	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]C)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]C)(H){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](N[5]C[5]N[5])(N[6]C[6]Fe)(C[6]C[6]H){1|C<2>,1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	121.3266	0.587	15	121.2526	0.229	145	121.3498	0.283	367	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]C)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]C)(H){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](N[5]C[5]N[5])(N[6]C[6]Fe)(C[6]C[6]H){1|C<4>,1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	121.3499	0.331	17	121.2526	0.229	145	121.3498	0.283	367	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]C)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]C)(H){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](N[5]C[5]N[5])(N[6]C[6]Fe)(C[6]C[6]H){1|H<1>,1|N<3>,4|C<3>}	H(C[6]C[6]2)	121.2452	0.413	109	121.2526	0.229	145	121.3498	0.283	367	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]C)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]C)(H){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](N[5]C[5]N[5])(N[6]C[6]Fe)(C[6]C[6]H){1|H<1>,5|C<3>}	H(C[6]C[6]2)	120.7645	1.497	4	121.2526	0.229	145	121.3498	0.283	367	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]C)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Mn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]C)(H){1|Mn<8>,1|H<1>,1|N<3>,2|C<3>}	C[6](N[5]C[5]N[5])(N[6]C[6]Mn)(C[6]C[6]H){1|H<1>,1|N<3>,4|C<3>}	H(C[6]C[6]2)	121.4160	0.000	1	121.4160	0.000	1	121.3498	0.283	367	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]C)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Zn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]C)(H){1|Zn<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](N[5]C[5]N[5])(N[6]C[6]Zn)(C[6]C[6]H){1|H<1>,5|C<3>}	H(C[6]C[6]2)	121.7935	0.135	2	121.7935	0.018	2	121.3498	0.283	367	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]B[5]C[5])(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ir<8>,1|B<3>,1|C<3>,1|C<4>,1|H<1>}	C[6](N[5]B[5]C[5])(N[6]C[6]Ir)(C[6]C[6]H){1|C<3>,1|O<2>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	120.0150	0.000	1	120.0150	0.000	1	121.3498	0.283	367	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5,6a]B[5])(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ir<8>,1|B<3>,1|H<1>,2|C<3>}	C[6](N[5]C[5,6a]B[5])(N[6]C[6]Ir)(C[6]C[6]H){1|N<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.4040	0.000	1	120.4040	0.000	1	121.3498	0.283	367	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5,6a]C[5])(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|H<1>,3|C<3>}	C[6](N[5]C[5,6a]C[5])(N[6]C[6]Fe)(C[6]C[6]H){1|H<1>,2|N<3>,3|C<3>}	H(C[6]C[6]2)	121.0210	1.824	2	120.9413	1.683	3	121.3498	0.283	367	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5,6a]C[5])(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|H<1>,3|C<3>}	C[6](N[5]C[5,6a]C[5])(N[6]C[6]Fe)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.7820	0.000	1	120.9413	1.683	3	121.3498	0.283	367	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5,6a]C[5])(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|H<1>,3|C<3>}	C[6](N[5]C[5,6a]C[5])(N[6]C[6]Ir)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.4530	0.000	1	120.4530	0.000	1	121.3498	0.283	367	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5,6a]C[5])(N[6]C[6]Mn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Mn<6>,1|H<1>,3|C<3>}	C[6](N[5]C[5,6a]C[5])(N[6]C[6]Mn)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	121.1000	0.000	1	121.1000	0.000	1	121.3498	0.283	367	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5,6a]C[5])(N[6]C[6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,3|C<3>}	C[6](N[5]C[5,6a]C[5])(N[6]C[6]Pd)(C[6]C[6]H){1|H<1>,2|N<3>,3|C<3>}	H(C[6]C[6]2)	121.0225	0.104	2	121.0924	0.041	7	121.3498	0.283	367	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5,6a]C[5])(N[6]C[6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,3|C<3>}	C[6](N[5]C[5,6a]C[5])(N[6]C[6]Pd)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.7020	0.000	1	121.0924	0.041	7	121.3498	0.283	367	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5,6a]C[5])(N[6]C[6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Pd<6>,1|H<1>,3|C<3>}	C[6](N[5]C[5,6a]C[5])(N[6]C[6]Pd)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	121.2250	0.024	4	121.0924	0.041	7	121.3498	0.283	367	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5,6a]C[5])(N[6]C[6]Re)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Re<6>,1|H<1>,3|C<3>}	C[6](N[5]C[5,6a]C[5])(N[6]C[6]Re)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.7033	0.193	3	120.7033	0.037	3	121.3498	0.283	367	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5,6a]C[5])(N[6]C[6]Rh)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Rh<8>,1|C<4>,1|H<1>,2|C<3>}	C[6](N[5]C[5,6a]C[5])(N[6]C[6]Rh)(C[6]C[6]H){1|C<4>,3|C<3>,4|H<1>}	H(C[6]C[6]2)	120.0790	0.103	2	120.0790	0.011	2	121.3498	0.283	367	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5,6a]C[5])(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|H<1>,3|C<3>}	C[6](N[5]C[5,6a]C[5])(N[6]C[6]Ru)(C[6]C[6]H){1|C<4>,1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.5965	0.633	2	120.9499	0.135	8	121.3498	0.283	367	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5,6a]C[5])(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|H<1>,3|C<3>}	C[6](N[5]C[5,6a]C[5])(N[6]C[6]Ru)(C[6]C[6]H){1|H<1>,2|N<3>,3|C<3>}	H(C[6]C[6]2)	121.2875	0.062	2	120.9499	0.135	8	121.3498	0.283	367	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5,6a]C[5])(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|H<1>,3|C<3>}	C[6](N[5]C[5,6a]C[5])(N[6]C[6]Ru)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.8640	0.000	1	120.9499	0.135	8	121.3498	0.283	367	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5,6a]C[5])(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ru<8>,1|H<1>,3|C<3>}	C[6](N[5]C[5,6a]C[5])(N[6]C[6]Ru)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.9890	0.156	3	120.9499	0.135	8	121.3498	0.283	367	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5,6a]N[5])(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](N[5]C[5,6a]N[5])(N[6]C[6]Fe)(C[6]C[6]H){1|H<1>,1|N<3>,4|C<3>}	H(C[6]C[6]2)	121.5370	0.051	3	121.5370	0.003	3	121.3498	0.283	367	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5,6a]N[5])(N[6]C[6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](N[5]C[5,6a]N[5])(N[6]C[6]Pd)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	121.1680	0.000	1	121.1680	0.000	1	121.3498	0.283	367	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5,6a]N[5])(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](N[5]C[5,6a]N[5])(N[6]C[6]Ru)(C[6]C[6]H){1|H<1>,1|N<2>,4|C<3>}	H(C[6]C[6]2)	121.8200	0.000	1	121.8200	0.000	1	121.3498	0.283	367	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Al)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Al<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](N[5]C[5]N[5])(N[6]C[6]Al)(C[6]C[6]H){1|C<4>,1|H<1>,4|C<3>}	H(C[6]C[6]2)	120.8530	0.000	1	120.8530	0.000	1	121.3498	0.283	367	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Cd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Cd<6>,1|Cl<1>,1|N<3>,2|C<3>}	C[6](N[5]C[5]N[5])(N[6]C[6]Cd)(C[6]C[6]H){1|C<4>,1|H<1>,4|C<3>}	H(C[6]C[6]2)	121.3590	0.221	2	121.3590	0.049	2	121.3498	0.283	367	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Co)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Co<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](N[5]C[5]N[5])(N[6]C[6]Co)(C[6]C[6]H){1|C<4>,1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	121.5067	0.192	6	121.5242	0.037	8	121.3498	0.283	367	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Co)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Co<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](N[5]C[5]N[5])(N[6]C[6]Co)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	121.5770	0.262	2	121.5242	0.037	8	121.3498	0.283	367	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Cr)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Cr<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](N[5]C[5]N[5])(N[6]C[6]Cr)(C[6]C[6]H){1|C<4>,1|H<1>,4|C<3>}	H(C[6]C[6]2)	121.1645	0.050	2	121.1645	0.003	2	121.3498	0.283	367	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Cl<1>,1|Cu<6>,1|N<3>,2|C<3>}	C[6](N[5]C[5]N[5])(N[6]C[6]Cu)(C[6]C[6]H){1|C<4>,1|H<1>,4|C<3>}	H(C[6]C[6]2)	121.2745	0.057	2	121.3173	0.048	10	121.3498	0.283	367	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](N[5]C[5]N[5])(N[6]C[6]Cu)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	121.3950	0.092	2	121.3173	0.048	10	121.3498	0.283	367	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](N[5]C[5]N[5])(N[6]C[6]Cu)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	121.3800	0.000	1	121.3173	0.048	10	121.3498	0.283	367	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Cu<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](N[5]C[5]N[5])(N[6]C[6]Cu)(C[6]C[6]H){1|C<4>,1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.9635	0.093	2	121.3173	0.048	10	121.3498	0.283	367	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Cu<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](N[5]C[5]N[5])(N[6]C[6]Cu)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	121.5090	0.132	3	121.3173	0.048	10	121.3498	0.283	367	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](N[5]C[5]N[5])(N[6]C[6]Fe)(C[6]C[6]H){1|C<4>,1|H<1>,4|C<3>}	H(C[6]C[6]2)	121.3175	0.121	2	121.6916	0.384	55	121.3498	0.283	367	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](N[5]C[5]N[5])(N[6]C[6]Fe)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	121.6222	0.215	41	121.6916	0.384	55	121.3498	0.283	367	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](N[5]C[5]N[5])(N[6]C[6]Fe)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	121.9912	1.255	12	121.6916	0.384	55	121.3498	0.283	367	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](N[5]C[5]N[5])(N[6]C[6]Ir)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	121.6130	0.000	1	121.2452	0.099	5	121.3498	0.283	367	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ir<8>,1|H<1>,1|N<2>,2|C<3>}	C[6](N[5]C[5]N[5])(N[6]C[6]Ir)(C[6]C[6]H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	121.1240	0.470	2	121.2452	0.099	5	121.3498	0.283	367	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ir<8>,1|H<1>,1|N<3>,2|C<3>}	C[6](N[5]C[5]N[5])(N[6]C[6]Ir)(C[6]C[6]H){1|Ir<8>,1|N<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	121.2060	0.000	1	121.2452	0.099	5	121.3498	0.283	367	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ir<8>,1|H<1>,1|N<3>,2|C<3>}	C[6](N[5]C[5]N[5])(N[6]C[6]Ir)(C[6]C[6]H){1|N<2>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	121.1590	0.000	1	121.2452	0.099	5	121.3498	0.283	367	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Mn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Mn<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](N[5]C[5]N[5])(N[6]C[6]Mn)(C[6]C[6]H){1|C<4>,1|H<1>,4|C<3>}	H(C[6]C[6]2)	121.2030	0.042	2	121.2030	0.002	2	121.3498	0.283	367	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Ni)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Cl<1>,1|Ni<6>,1|N<3>,2|C<3>}	C[6](N[5]C[5]N[5])(N[6]C[6]Ni)(C[6]C[6]H){1|C<4>,1|H<1>,4|C<3>}	H(C[6]C[6]2)	121.4215	0.156	2	121.4867	0.132	12	121.3498	0.283	367	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Ni)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](N[5]C[5]N[5])(N[6]C[6]Ni)(C[6]C[6]H){1|C<4>,1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	121.6340	0.177	4	121.4867	0.132	12	121.3498	0.283	367	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Ni)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](N[5]C[5]N[5])(N[6]C[6]Ni)(C[6]C[6]H){1|C<4>,1|H<1>,4|C<3>}	H(C[6]C[6]2)	121.0113	0.349	3	121.4867	0.132	12	121.3498	0.283	367	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Ni)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](N[5]C[5]N[5])(N[6]C[6]Ni)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	121.8090	0.024	3	121.4867	0.132	12	121.3498	0.283	367	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](N[5]C[5]N[5])(N[6]C[6]Pd)(C[6]C[6]H){1|N<2>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	121.4770	0.166	5	121.4940	0.024	6	121.3498	0.283	367	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](N[5]C[5]N[5])(N[6]C[6]Pd)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	121.5790	0.000	1	121.4940	0.024	6	121.3498	0.283	367	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Re)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Re<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](N[5]C[5]N[5])(N[6]C[6]Re)(C[6]C[6]H){1|N<2>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	121.3750	0.000	1	121.3750	0.000	1	121.3498	0.283	367	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ru<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](N[5]C[5]N[5])(N[6]C[6]Ru)(C[6]C[6]H){1|C<4>,1|H<1>,4|C<3>}	H(C[6]C[6]2)	121.1740	0.000	1	121.2649	0.166	15	121.3498	0.283	367	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](N[5]C[5]N[5])(N[6]C[6]Ru)(C[6]C[6]H){1|C<4>,1|H<1>,4|C<3>}	H(C[6]C[6]2)	121.2840	0.557	7	121.2649	0.166	15	121.3498	0.283	367	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](N[5]C[5]N[5])(N[6]C[6]Ru)(C[6]C[6]H){1|N<2>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	121.3570	0.031	2	121.2649	0.166	15	121.3498	0.283	367	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ru<8>,1|H<1>,1|N<3>,2|C<3>}	C[6](N[5]C[5]N[5])(N[6]C[6]Ru)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.8640	0.000	1	121.2649	0.166	15	121.3498	0.283	367	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ru<9>,1|H<1>,1|N<2>,2|C<3>}	C[6](N[5]C[5]N[5])(N[6]C[6]Ru)(C[6]C[6]H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	121.3083	0.296	4	121.2649	0.166	15	121.3498	0.283	367	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Sm)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Sm<14>,1|H<1>,1|N<3>,2|C<3>}	C[6](N[5]C[5]N[5])(N[6]C[6]Sm)(C[6]C[6]H){1|C<4>,1|H<1>,4|C<3>}	H(C[6]C[6]2)	121.0880	0.000	1	121.0880	0.000	1	121.3498	0.283	367	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Zn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Zn<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](N[5]C[5]N[5])(N[6]C[6]Zn)(C[6]C[6]H){1|C<4>,1|H<1>,4|C<3>}	H(C[6]C[6]2)	121.4705	0.063	2	121.5351	0.060	13	121.3498	0.283	367	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Zn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Zn<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](N[5]C[5]N[5])(N[6]C[6]Zn)(C[6]C[6]H){1|Zn<5>,1|C<4>,1|H<1>,4|C<3>}	H(C[6]C[6]2)	121.1610	0.000	1	121.5351	0.060	13	121.3498	0.283	367	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Zn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Zn<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](N[5]C[5]N[5])(N[6]C[6]Zn)(C[6]C[6]H){1|C<4>,1|H<1>,4|C<3>}	H(C[6]C[6]2)	121.5480	0.000	1	121.5351	0.060	13	121.3498	0.283	367	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Zn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Zn<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](N[5]C[5]N[5])(N[6]C[6]Zn)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	121.4480	0.170	2	121.5351	0.060	13	121.3498	0.283	367	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Zn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Zn<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](N[5]C[5]N[5])(N[6]C[6]Zn)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	121.6777	0.107	3	121.5351	0.060	13	121.3498	0.283	367	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Zn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Zn<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](N[5]C[5]N[5])(N[6]C[6]Zn)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	121.5943	0.376	4	121.5351	0.060	13	121.3498	0.283	367	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]N)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]N)(H){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](N[5]C[5]N[5])(N[6]C[6]Fe)(C[6]C[6]H){1|H<1>,1|N<3>,4|C<3>}	H(C[6]C[6]2)	121.1870	0.375	2	121.1870	0.140	2	121.3498	0.283	367	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]O)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]O)(H){1|Ir<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](N[5]C[5]N[5])(N[6]C[6]Ir)(C[6]C[6]H){1|O<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	121.3650	0.000	1	121.3650	0.000	1	121.3498	0.283	367	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]S)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]S)(H){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](N[5]C[5]N[5])(N[6]C[6]Fe)(C[6]C[6]H){1|H<1>,1|N<3>,1|S<2>,3|C<3>}	H(C[6]C[6]2)	121.4211	0.163	29	121.4211	0.027	29	121.3498	0.283	367	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5a]N[6])(C[6]N[5]N[6])(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[5a]N[6])(C[6]N[5]N[6])(H){1|Fe<6>,1|N<2>,1|N<3>,3|C<3>}	C[6](N[5]C[5]N[5])(N[6]C[6]Fe)(C[6]C[6]H){1|C<4>,1|H<1>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	122.7035	0.166	2	122.6403	0.025	6	121.3498	0.283	367	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5a]N[6])(C[6]N[5]N[6])(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[5a]N[6])(C[6]N[5]N[6])(H){1|Fe<6>,1|N<2>,1|N<3>,3|C<3>}	C[6](N[5]C[5]N[5])(N[6]C[6]Fe)(C[6]C[6]H){1|N<2>,1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	122.6088	0.171	4	122.6403	0.025	6	121.3498	0.283	367	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5a]N[6])(C[6]N[5]N[6])(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[5a]N[6])(C[6]N[5]N[6])(H){1|Pd<4>,1|N<2>,1|N<3>,3|C<3>}	C[6](N[5]C[5]N[5])(N[6]C[6]Pd)(C[6]C[6]H){1|N<2>,1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	123.0020	0.000	1	123.0020	0.000	1	121.3498	0.283	367	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5a,6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]N[5a,6]N)(C[6]N[6]H)(H)	C[6](N[5a,6]C[5a,6]N[5a])(C[6]C[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]N[5a,6]N)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](N[5a,6]C[5a,6]N[5a])(C[6]C[6]H)(NHH){1|C<3>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	119.8410	0.000	1	119.8410	0.000	1	119.8410	0.000	1	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5a,6]-3:C[6]-3:S-3:	C[6]-3:	C[6](C[6]N[5a,6]S)(C[6]C[6]C)(H)	C[6](N[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(SC[6a]Rh)	H(C[6]C[6]2)	C[6](C[6]N[5a,6]S)(C[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](N[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(SC[6a]Rh){1|C<4>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.5090	0.000	1	119.5090	0.000	1	119.5090	0.000	1	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5a,6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5a,6]C[6a])(C[6]C[6]H)(H)	C[6](N[5a,6]C[5a,6]C[5a])(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[5a,6]C[6a])(C[6]C[6]H)(H){1|H<1>,4|C<3>}	C[6](N[5a,6]C[5a,6]C[5a])(C[6a]C[6a]2)(C[6]C[6]H){1|N<3>,4|C<3>,4|H<1>}	H(C[6]C[6]2)	117.3780	0.000	1	117.3780	0.000	1	119.1243	2.345	3	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5a,6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5a,6]C[6a])(C[6]C[6a]N[6])(H)	C[6](N[5a,6]C[5a,6]N[5a])(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[5a,6]C[6a])(C[6]C[6a]N[6])(H){1|N<2>,5|C<3>}	C[6](N[5a,6]C[5a,6]N[5a])(C[6a]C[6a]2)(C[6]C[6]H){1|N<2>,1|N<3>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.9975	0.340	2	119.9975	0.116	2	119.1243	2.345	3	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5a]C[6])(C[6]C[6]H)(H)	C[6](N[5a]C[5a,6a]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]2)	C[6](C[6]N[5a]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](N[5a]C[5a,6a]2)(C[6]C[6]H)(C[6]N[6]H){1|Re<6>,1|H<1>,5|C<3>}	H(C[6]C[6]2)	120.8075	0.114	2	120.8075	0.013	2	120.3856	0.965	25	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5a]C[6])(C[6]C[6]H)(H)	C[6](N[5a]C[5a]2)(C[6]C[6]H)(C[6]C[6]O)	H(C[6]C[6]2)	C[6](C[6]N[5a]C[6])(C[6]C[6]H)(H){1|O<2>,3|C<3>}	C[6](N[5a]C[5a]2)(C[6]C[6]H)(C[6]C[6]O){1|C<2>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.0400	0.000	1	120.0400	0.000	1	120.3856	0.965	25	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5a]C[6])(C[6]C[6]H)(H)	C[6](N[5a]C[5a]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]2)	C[6](C[6]N[5a]C[6])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](N[5a]C[5a]2)(C[6]C[6]H)(C[6]N[6]H){1|Mn<6>,1|C<3>,2|N<2>,3|H<1>}	H(C[6]C[6]2)	121.1100	0.291	2	121.1100	0.085	2	120.3856	0.965	25	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5a]C[6])(C[6]C[6]H)(H)	C[6](N[5a]C[5a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]N[5a]C[6])(C[6]C[6]H)(H){1|C<2>,2|C<3>,2|H<1>}	C[6](N[5a]C[5a]2)(C[6]C[6]H)2{1|H<1>,5|C<3>}	H(C[6]C[6]2)	117.5770	0.000	1	117.5770	0.000	1	120.3856	0.965	25	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5a]C[6])(C[6]C[6]H)(H)	C[6](N[5a]C[5a]N[5a])(C[6]C[6]H)(C[6]C[6]O)	H(C[6]C[6]2)	C[6](C[6]N[5a]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|O<1>,2|C<3>}	C[6](N[5a]C[5a]N[5a])(C[6]C[6]H)(C[6]C[6]O){1|N<2>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	119.8330	0.000	1	119.8330	0.000	1	120.3856	0.965	25	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5a]C[6])(C[6]C[6]O)(H)	C[6](N[5a]C[5a]N[5a])(C[6]C[6]H)(C[6]C[6]O)	H(C[6]C[6]2)	C[6](C[6]N[5a]C[6])(C[6]C[6]O)(H){1|N<2>,1|N<3>,1|O<1>,2|C<3>}	C[6](N[5a]C[5a]N[5a])(C[6]C[6]H)(C[6]C[6]O){1|O<1>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	118.3830	0.000	1	118.8460	0.168	3	120.3856	0.965	25	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5a]C[6])(C[6]C[6]O)(H)	C[6](N[5a]C[5a]N[5a])(C[6]C[6]H)(C[6]C[6]O)	H(C[6]C[6]2)	C[6](C[6]N[5a]C[6])(C[6]C[6]O)(H){1|N<2>,1|N<3>,1|O<1>,2|C<3>}	C[6](N[5a]C[5a]N[5a])(C[6]C[6]H)(C[6]C[6]O){1|Ru<6>,1|H<1>,1|O<1>,3|C<3>}	H(C[6]C[6]2)	119.0775	0.117	2	118.8460	0.168	3	120.3856	0.965	25	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5a]C[6])(C[6]N[6]H)(H)	C[6](N[5a]C[5a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]N[5a]C[6])(C[6]N[6]H)(H){1|Cd<4>,1|H<1>,3|C<3>}	C[6](N[5a]C[5a]2)(C[6]C[6]H)2{1|N<3>,2|C<3>,2|H<1>,2|N<2>}	H(C[6]C[6]2)	121.5525	0.743	2	121.1547	0.323	6	120.3856	0.965	25	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5a]C[6])(C[6]N[6]H)(H)	C[6](N[5a]C[5a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]N[5a]C[6])(C[6]N[6]H)(H){1|Cd<6>,1|H<1>,3|C<3>}	C[6](N[5a]C[5a]2)(C[6]C[6]H)2{1|N<3>,2|C<3>,2|H<1>,2|N<2>}	H(C[6]C[6]2)	121.3035	0.204	2	121.1547	0.323	6	120.3856	0.965	25	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5a]C[6])(C[6]N[6]H)(H)	C[6](N[5a]C[5a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]N[5a]C[6])(C[6]N[6]H)(H){1|Zn<4>,1|H<1>,3|C<3>}	C[6](N[5a]C[5a]2)(C[6]C[6]H)2{1|N<3>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	120.6080	0.252	2	121.1547	0.323	6	120.3856	0.965	25	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5a]C[6])(C[6]N[6]H)(H)	C[6](N[5a]C[5a]N[5a])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]N[5a]C[6])(C[6]N[6]H)(H){1|Ru<9>,1|H<1>,1|N<2>,2|C<3>}	C[6](N[5a]C[5a]N[5a])(C[6]C[6]H)2{1|C<3>,1|N<2>,1|N<3>,3|H<1>}	H(C[6]C[6]2)	120.5145	0.366	4	120.5145	0.134	4	120.3856	0.965	25	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5a]C[6])2(H)	C[6](N[5a]C[5a,6a]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]2)	C[6](C[6]N[5a]C[6])2(H){1|N<3>,2|H<1>,4|C<3>}	C[6](N[5a]C[5a,6a]2)(C[6]C[6]H)(C[6]N[6]H){1|Cu<4>,1|N<3>,5|C<3>}	H(C[6]C[6]2)	120.5662	0.168	5	120.5662	0.028	5	120.3856	0.965	25	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5a]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]N[5a]N[6])(C[6]C[6]H)(H)	C[6](N[5a]C[5a]2)(C[6]C[6]H)(N[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[5a]N[6])(C[6]C[6]H)(H){2|H<1>,3|C<3>}	C[6](N[5a]C[5a]2)(C[6]C[6]H)(N[6]C[6]H){1|N<2>,1|N<3>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	122.1160	0.000	1	122.1160	0.000	1	122.1160	0.000	1	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5a]N[6])(C[6]C[6]H)(H)	C[6](N[5a]C[5a,6]C[5a])(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[5a]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,3|C<3>}	C[6](N[5a]C[5a,6]C[5a])(N[6]C[6]Pt)(C[6]C[6]H){1|N<3>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.4170	0.000	1	120.4170	0.000	1	120.4927	0.240	18	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5a]N[6])(C[6]C[6]H)(H)	C[6](N[5a]C[5a,6a]2)(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[5a]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|H<1>,3|C<3>}	C[6](N[5a]C[5a,6a]2)(N[6]C[6]Cu)(C[6]C[6]H){1|H<1>,1|N<3>,5|C<3>}	H(C[6]C[6]2)	120.8240	0.337	2	120.8240	0.113	2	120.4927	0.240	18	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5a]N[6])(C[6]C[6]H)(H)	C[6](N[5a]C[5a,6a]2)(N[6]C[6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[5a]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,3|C<3>}	C[6](N[5a]C[5a,6a]2)(N[6]C[6]Pd)(C[6]C[6]H){2|H<1>,5|C<3>}	H(C[6]C[6]2)	120.5070	0.246	6	120.5070	0.060	6	120.4927	0.240	18	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5a]N[6])(C[6]C[6]H)(H)	C[6](N[5a]C[5a,6a]2)(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[5a]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,3|C<3>}	C[6](N[5a]C[5a,6a]2)(N[6]C[6]Pt)(C[6]C[6]H){2|H<1>,5|C<3>}	H(C[6]C[6]2)	119.9278	0.243	5	119.9278	0.059	5	120.4927	0.240	18	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5a]N[6])(C[6]C[6]H)(H)	C[6](N[5a]C[5a,6a]C[5a])(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[5a]N[6])(C[6]C[6]H)(H){1|Ru<8>,1|H<1>,3|C<3>}	C[6](N[5a]C[5a,6a]C[5a])(N[6]C[6]Ru)(C[6]C[6]H){1|N<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	121.1270	0.000	1	121.1270	0.000	1	120.4927	0.240	18	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5a]N[6])(C[6]C[6]H)(H)	C[6](N[5a]C[5a]2)(N[6]C[6]Re)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[5a]N[6])(C[6]C[6]H)(H){1|Re<6>,1|H<1>,3|C<3>}	C[6](N[5a]C[5a]2)(N[6]C[6]Re)(C[6]C[6]H){1|N<3>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	121.2640	0.082	2	121.2640	0.007	2	120.4927	0.240	18	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[5a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5a]N[6])(C[6]C[6]H)(H)	C[6](N[5a]C[5a]N[5a])(N[6]C[6]Mn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[5a]N[6])(C[6]C[6]H)(H){1|Mn<6>,1|H<1>,1|N<2>,2|C<3>}	C[6](N[5a]C[5a]N[5a])(N[6]C[6]Mn)(C[6]C[6]H){1|C<4>,1|H<1>,4|C<3>}	H(C[6]C[6]2)	120.4680	0.000	1	120.4680	0.000	1	120.4927	0.240	18	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]N[6,6]C)(C[6]C[6]H)(H)	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(CCH)	H(C[6]C[6]2)	C[6](C[6]N[6,6]C)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(CCH){1|C<4>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	119.8277	0.237	3	119.8277	0.056	3	119.8277	0.056	3	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[6,6]C[6])(C[6]C[6]H)(H)	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(C[6]N[6]2)	H(C[6]C[6]2)	C[6](C[6]N[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,2|N<2>}	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]H)(C[6]N[6]2){1|C<4>,3|H<1>,4|C<3>}	H(C[6]C[6]2)	119.8200	0.000	1	119.8200	0.000	1	119.8200	0.000	1	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6,6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[6,6]C[6a])(C[6]N[6]O)(H)	C[6](N[6,6]C[6,6]C[6])(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]C[6a])(C[6]N[6]O)(H){1|C<4>,1|H<1>,3|C<3>}	C[6](N[6,6]C[6,6]C[6])(C[6a]C[6a]2)(C[6]C[6]H){1|N<3>,1|O<1>,4|C<3>,4|H<1>}	H(C[6]C[6]2)	119.4930	0.000	1	119.4930	0.000	1	119.4930	0.000	1	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Re)(CC[5]C[6])(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Re)(CC[5]C[6])(C[6]C[6]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7480	0.122	2	119.7480	0.015	2	119.7480	0.015	2	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6,6]H)(H)	C[6](N[6]C[6,6]Ru)(C[5]C[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6,6]H)(H){1|Ru<5>,1|C<4>,3|C<3>}	C[6](N[6]C[6,6]Ru)(C[5]C[5]2)(C[6]C[6]H){1|C<4>,1|N<3>,1|O<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2940	0.000	1	120.2940	0.000	1	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H)	C[6](N[6]C[6,6a]Co)(C[5]N[5]O[5])(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H){1|Co<4>,1|N<3>,1|O<2>,2|C<3>}	C[6](N[6]C[6,6a]Co)(C[5]N[5]O[5])(C[6]C[6]H){1|H<1>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	121.1320	0.058	2	121.1320	0.003	2	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H)	C[6](N[6]C[6,6a]Cr)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H){1|Cr<6>,2|C<3>,2|N<3>}	C[6](N[6]C[6,6a]Cr)(C[5]N[5]2)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.8440	0.000	1	120.8440	0.000	1	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H)	C[6](N[6]C[6,6a]Cr)(C[5]N[5]O[5])(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H){1|Cr<6>,1|N<3>,1|O<2>,2|C<3>}	C[6](N[6]C[6,6a]Cr)(C[5]N[5]O[5])(C[6]C[6]H){1|H<1>,4|C<3>}	H(C[6]C[6]2)	120.7470	0.000	1	120.7470	0.000	1	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H)	C[6](N[6]C[6,6a]Cu)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H){1|Cu<4>,1|N<2>,1|N<3>,2|C<3>}	C[6](N[6]C[6,6a]Cu)(C[5]N[5]2)(C[6]C[6]H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	121.0257	0.520	3	120.9320	0.215	4	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H)	C[6](N[6]C[6,6a]Cu)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H){1|Cu<4>,2|C<3>,2|N<3>}	C[6](N[6]C[6,6a]Cu)(C[5]N[5]2)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.6510	0.000	1	120.9320	0.215	4	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H)	C[6](N[6]C[6,6a]Cu)(C[5]N[5]O[5])(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H){1|Cu<4>,1|N<3>,1|O<2>,2|C<3>}	C[6](N[6]C[6,6a]Cu)(C[5]N[5]O[5])(C[6]C[6]H){1|H<1>,4|C<3>}	H(C[6]C[6]2)	120.7445	0.226	2	120.7445	0.051	2	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H)	C[6](N[6]C[6,6a]Fe)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H){1|Fe<6>,1|N<2>,1|N<3>,2|C<3>}	C[6](N[6]C[6,6a]Fe)(C[5]N[5]2)(C[6]C[6]H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.5510	0.325	2	120.5087	0.058	3	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H)	C[6](N[6]C[6,6a]Fe)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H){1|Fe<6>,2|C<3>,2|N<3>}	C[6](N[6]C[6,6a]Fe)(C[5]N[5]2)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.4240	0.000	1	120.5087	0.058	3	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H)	C[6](N[6]C[6,6a]Ir)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H){1|Ir<6>,2|C<3>,2|N<3>}	C[6](N[6]C[6,6a]Ir)(C[5]N[5]2)(C[6]C[6]H){1|C<4>,1|H<1>,4|C<3>}	H(C[6]C[6]2)	119.9740	0.000	1	120.2870	0.196	2	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H)	C[6](N[6]C[6,6a]Ir)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H){1|Ir<6>,2|C<3>,2|N<3>}	C[6](N[6]C[6,6a]Ir)(C[5]N[5]2)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.6000	0.000	1	120.2870	0.196	2	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H)	C[6](N[6]C[6,6a]Ir)(C[5]N[5]O[5])(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H){1|Ir<8>,1|N<3>,1|O<2>,2|C<3>}	C[6](N[6]C[6,6a]Ir)(C[5]N[5]O[5])(C[6]C[6]H){1|C<3>,1|H<1>,1|N<2>,2|C<4>}	H(C[6]C[6]2)	121.1525	0.927	2	121.1525	0.859	2	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H)	C[6](N[6]C[6,6a]Mn)(C[5]N[5]O[5])(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H){1|Mn<6>,1|N<3>,1|O<2>,2|C<3>}	C[6](N[6]C[6,6a]Mn)(C[5]N[5]O[5])(C[6]C[6]H){1|H<1>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	120.7210	0.000	1	120.7210	0.000	1	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H)	C[6](N[6]C[6,6a]Ni)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H){1|Ni<6>,2|C<3>,2|N<3>}	C[6](N[6]C[6,6a]Ni)(C[5]N[5]2)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.8145	0.640	2	120.8145	0.410	2	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H)	C[6](N[6]C[6,6a]Pd)(C[5]C[5]N[5])(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H){1|Pd<4>,1|C<4>,1|N<3>,2|C<3>}	C[6](N[6]C[6,6a]Pd)(C[5]C[5]N[5])(C[6]C[6]H){1|Pd<4>,1|C<4>,1|H<1>,1|N<2>,3|C<3>}	H(C[6]C[6]2)	119.9050	0.000	1	119.9050	0.000	1	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H)	C[6](N[6]C[6,6a]Pd)(C[5]N[5]O[5])(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H){1|Pd<4>,1|N<3>,1|O<2>,2|C<3>}	C[6](N[6]C[6,6a]Pd)(C[5]N[5]O[5])(C[6]C[6]H){1|H<1>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	120.9240	0.000	1	120.9240	0.000	1	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H)	C[6](N[6]C[6,6a]Zn)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H){1|Zn<5>,2|C<3>,2|N<3>}	C[6](N[6]C[6,6a]Zn)(C[5]N[5]2)(C[6]C[6]H){1|Zn<5>,1|C<4>,1|H<1>,4|C<3>}	H(C[6]C[6]2)	120.8675	0.763	2	120.6615	0.252	4	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H)	C[6](N[6]C[6,6a]Zn)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H){1|Zn<6>,2|C<3>,2|N<3>}	C[6](N[6]C[6,6a]Zn)(C[5]N[5]2)(C[6]C[6]H){1|C<4>,1|H<1>,4|C<3>}	H(C[6]C[6]2)	120.4555	0.057	2	120.6615	0.252	4	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H)	C[6](N[6]C[6,6a]Zn)(C[5]N[5]S[5])(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H){1|Zn<4>,1|N<3>,1|S<2>,2|C<3>}	C[6](N[6]C[6,6a]Zn)(C[5]N[5]S[5])(C[6]C[6]H){1|H<1>,4|C<3>}	H(C[6]C[6]2)	120.4830	0.000	1	120.4830	0.000	1	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]C)(H)	C[6](N[6]C[6]Mn)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]C)(H){1|Mn<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](N[6]C[6]Mn)(C[5]N[5]2)(C[6]C[6]H){1|C<2>,1|C<3>,1|H<1>,2|S<2>}	H(C[6]C[6]2)	121.1790	0.000	1	121.1790	0.000	1	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]C)(H)	C[6](N[6]C[6]Re)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]C)(H){1|Re<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Re)(C[5]N[5]2)(C[6]C[6]H){1|H<1>,2|C<4>,3|C<3>}	H(C[6]C[6]2)	119.6460	0.000	1	119.6460	0.000	1	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Ag)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ag<4>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Ag)(C[5]N[5]2)(C[6]C[6]H){2|C<3>,2|H<1>,2|N<3>}	H(C[6]C[6]2)	120.4155	0.023	2	120.4155	0.001	2	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Al)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Al<4>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Al)(C[5]N[5]2)(C[6]C[6]H){1|Al<4>,1|C<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.9440	0.000	1	120.7930	0.046	2	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Al)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Al<5>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Al)(C[5]N[5]2)(C[6]C[6]H){1|Al<4>,1|C<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.6420	0.000	1	120.7930	0.046	2	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Cd)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cd<5>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](N[6]C[6]Cd)(C[5]N[5]2)(C[6]C[6]H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.7950	0.000	1	120.8520	0.096	12	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Cd)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cd<5>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Cd)(C[5]N[5]2)(C[6]C[6]H){1|C<4>,1|H<1>,1|O<2>,3|C<3>}	H(C[6]C[6]2)	120.7780	0.000	1	120.8520	0.096	12	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Cd)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cd<5>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Cd)(C[5]N[5]2)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.0860	0.000	1	120.8520	0.096	12	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Cd)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cd<5>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Cd)(C[5]N[5]2)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.9230	0.000	1	120.8520	0.096	12	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Cd)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cd<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](N[6]C[6]Cd)(C[5]N[5]2)(C[6]C[6]H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.9580	0.000	1	120.8520	0.096	12	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Cd)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cd<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Cd)(C[5]N[5]2)(C[6]C[6]H){1|N<2>,1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.8005	0.002	2	120.8520	0.096	12	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Cd)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cd<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Cd)(C[5]N[5]2)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	121.1382	0.042	4	120.8520	0.096	12	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Cd)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cd<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Cd)(C[5]N[5]2)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.5300	0.000	1	120.8520	0.096	12	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Co)(C[5]C[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Co<4>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Co)(C[5]C[5]2)(C[6]C[6]H){2|H<1>,5|C<3>}	H(C[6]C[6]2)	120.3645	0.047	2	120.3645	0.002	2	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Co)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Co<4>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Co)(C[5]N[5]2)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	121.3710	0.000	1	120.8245	0.058	47	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Co)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Co<5>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Co)(C[5]N[5]2)(C[6]C[6]H){1|C<4>,1|H<1>,4|C<3>}	H(C[6]C[6]2)	120.5787	0.060	3	120.8245	0.058	47	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Co)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Co<5>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Co)(C[5]N[5]2)(C[6]C[6]H){1|H<1>,2|C<4>,3|C<3>}	H(C[6]C[6]2)	120.8450	0.381	3	120.8245	0.058	47	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Co)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Co<5>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Co)(C[5]N[5]2)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	121.1003	0.083	3	120.8245	0.058	47	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Co)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Co<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](N[6]C[6]Co)(C[5]N[5]2)(C[6]C[6]H){1|C<3>,2|H<1>,2|S<2>}	H(C[6]C[6]2)	120.2090	0.000	1	120.8245	0.058	47	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Co)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Co<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](N[6]C[6]Co)(C[5]N[5]2)(C[6]C[6]H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.6687	0.161	3	120.8245	0.058	47	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Co)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Co<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](N[6]C[6]Co)(C[5]N[5]2)(C[6]C[6]H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.7570	0.168	6	120.8245	0.058	47	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Co)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Co<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Co)(C[5]N[5]2)(C[6]C[6]H){1|C<3>,1|O<1>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	120.7830	0.000	1	120.8245	0.058	47	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Co)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Co<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Co)(C[5]N[5]2)(C[6]C[6]H){1|H<1>,1|O<1>,1|O<2>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	120.8190	0.000	1	120.8245	0.058	47	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Co)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Co<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Co)(C[5]N[5]2)(C[6]C[6]H){1|N<2>,1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.8107	0.090	15	120.8245	0.058	47	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Co)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Co<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Co)(C[5]N[5]2)(C[6]C[6]H){1|N<2>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	120.7793	0.124	3	120.8245	0.058	47	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Co)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Co<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Co)(C[5]N[5]2)(C[6]C[6]H){1|N<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	121.1060	0.233	2	120.8245	0.058	47	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Co)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Co<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Co)(C[5]N[5]2)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	121.1720	0.064	3	120.8245	0.058	47	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Co)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Co<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Co)(C[5]N[5]2)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.8980	0.000	1	120.8245	0.058	47	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Co)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Co<6>,2|C<3>,2|N<3>}	C[6](N[6]C[6]Co)(C[5]N[5]2)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.3270	0.000	1	120.8245	0.058	47	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Cr)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cr<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Cr)(C[5]N[5]2)(C[6]C[6]H){1|C<4>,1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	121.3470	0.000	1	121.0943	0.112	6	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Cr)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cr<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Cr)(C[5]N[5]2)(C[6]C[6]H){1|C<4>,1|H<1>,4|C<3>}	H(C[6]C[6]2)	120.9453	0.310	4	121.0943	0.112	6	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Cr)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cr<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Cr)(C[5]N[5]2)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	121.4380	0.000	1	121.0943	0.112	6	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Cu)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|C<3>,1|C<4>,2|N<3>}	C[6](N[6]C[6]Cu)(C[5]N[5]2)(C[6]C[6]H){1|N<2>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	120.5555	0.022	2	120.7865	0.102	63	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Cu)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](N[6]C[6]Cu)(C[5]N[5]2)(C[6]C[6]H){1|C<3>,1|N<2>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.8735	0.132	4	120.7865	0.102	63	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Cu)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](N[6]C[6]Cu)(C[5]N[5]2)(C[6]C[6]H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6847	0.166	7	120.7865	0.102	63	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Cu)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Cu)(C[5]N[5]2)(C[6]C[6]H){1|C<3>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	120.5920	0.000	1	120.7865	0.102	63	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Cu)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Cu)(C[5]N[5]2)(C[6]C[6]H){1|C<3>,2|N<2>,3|H<1>}	H(C[6]C[6]2)	120.9023	0.268	3	120.7865	0.102	63	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Cu)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Cu)(C[5]N[5]2)(C[6]C[6]H){1|C<4>,1|H<1>,1|N<2>,3|C<3>}	H(C[6]C[6]2)	120.9920	0.000	1	120.7865	0.102	63	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Cu)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Cu)(C[5]N[5]2)(C[6]C[6]H){1|C<4>,1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.6875	0.067	2	120.7865	0.102	63	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Cu)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Cu)(C[5]N[5]2)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.8330	0.000	1	120.7865	0.102	63	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Cu)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Cu)(C[5]N[5]2)(C[6]C[6]H){1|Cu<4>,1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.6230	0.000	2	120.7865	0.102	63	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Cu)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Cu)(C[5]N[5]2)(C[6]C[6]H){1|N<2>,1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.8550	0.000	1	120.7865	0.102	63	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Cu)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Cu)(C[5]N[5]2)(C[6]C[6]H){1|N<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.4977	0.222	4	120.7865	0.102	63	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Cu)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Cu)(C[5]N[5]2)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.7690	0.000	1	120.7865	0.102	63	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Cu)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Cu)(C[5]N[5]2)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.5517	0.722	3	120.7865	0.102	63	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Cu)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<5>,1|C<3>,1|C<4>,1|N<2>,1|N<3>}	C[6](N[6]C[6]Cu)(C[5]N[5]2)(C[6]C[6]H){1|C<4>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.8450	0.000	1	120.7865	0.102	63	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Cu)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](N[6]C[6]Cu)(C[5]N[5]2)(C[6]C[6]H){1|C<3>,1|N<2>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.9660	0.000	1	120.7865	0.102	63	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Cu)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](N[6]C[6]Cu)(C[5]N[5]2)(C[6]C[6]H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.8270	0.359	8	120.7865	0.102	63	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Cu)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Cu)(C[5]N[5]2)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.9465	0.230	2	120.7865	0.102	63	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Cu)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Cu)(C[5]N[5]2)(C[6]C[6]H){1|H<1>,2|C<4>,3|C<3>}	H(C[6]C[6]2)	120.8822	0.316	4	120.7865	0.102	63	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Cu)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Cu)(C[5]N[5]2)(C[6]C[6]H){1|N<3>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	120.9868	0.633	4	120.7865	0.102	63	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Cu)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Cu)(C[5]N[5]2)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.5095	0.095	2	120.7865	0.102	63	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Cu)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Cu)(C[5]N[5]2)(C[6]C[6]H){2|C<3>,2|H<1>,2|N<3>}	H(C[6]C[6]2)	121.2900	0.000	1	120.7865	0.102	63	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Cu)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Cu)(C[5]N[5]2)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.9750	0.000	1	120.7865	0.102	63	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Cu)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Cu)(C[5]N[5]2)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	121.1710	0.450	2	120.7865	0.102	63	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Cu)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](N[6]C[6]Cu)(C[5]N[5]2)(C[6]C[6]H){1|C<3>,1|N<2>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.6365	0.066	2	120.7865	0.102	63	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Cu)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](N[6]C[6]Cu)(C[5]N[5]2)(C[6]C[6]H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.7760	0.000	1	120.7865	0.102	63	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Cu)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Cu)(C[5]N[5]2)(C[6]C[6]H){1|Cu<4>,1|N<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	121.0860	0.000	1	120.7865	0.102	63	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Cu)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Cu)(C[5]N[5]2)(C[6]C[6]H){1|N<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.5790	0.000	1	120.7865	0.102	63	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Fe)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<5>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Fe)(C[5]N[5]2)(C[6]C[6]H){1|C<4>,1|H<1>,4|C<3>}	H(C[6]C[6]2)	120.2340	0.000	1	120.7035	0.351	102	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Fe)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<5>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Fe)(C[5]N[5]2)(C[6]C[6]H){1|H<1>,2|C<4>,3|C<3>}	H(C[6]C[6]2)	120.9670	0.000	1	120.7035	0.351	102	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Fe)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<5>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Fe)(C[5]N[5]2)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.9850	0.000	1	120.7035	0.351	102	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Fe)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](N[6]C[6]Fe)(C[5]N[5]2)(C[6]C[6]H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6838	0.139	4	120.7035	0.351	102	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Fe)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Fe)(C[5]N[5]2)(C[6]C[6]H){1|C<4>,1|H<1>,4|C<3>}	H(C[6]C[6]2)	120.5630	0.234	4	120.7035	0.351	102	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Fe)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Fe)(C[5]N[5]2)(C[6]C[6]H){1|N<2>,1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6906	0.708	67	120.7035	0.351	102	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Fe)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Fe)(C[5]N[5]2)(C[6]C[6]H){1|N<2>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	120.4180	0.000	1	120.7035	0.351	102	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Fe)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Fe)(C[5]N[5]2)(C[6]C[6]H){1|N<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.5987	0.375	6	120.7035	0.351	102	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Fe)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Fe)(C[5]N[5]2)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.9080	0.126	2	120.7035	0.351	102	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Fe)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Fe)(C[5]N[5]2)(C[6]C[6]H){2|C<3>,2|H<1>,2|N<2>}	H(C[6]C[6]2)	120.7903	0.110	6	120.7035	0.351	102	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Fe)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Fe)(C[5]N[5]2)(C[6]C[6]H){2|C<3>,2|H<1>,2|N<3>}	H(C[6]C[6]2)	121.0152	0.069	4	120.7035	0.351	102	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Fe)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Fe)(C[5]N[5]2)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.8143	0.199	4	120.7035	0.351	102	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Fe)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Fe)(C[5]N[5]2)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.4360	0.000	1	120.7035	0.351	102	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Hg)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Hg<4>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Hg)(C[5]N[5]2)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.4520	0.000	1	120.5195	0.009	2	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Hg)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Hg<5>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Hg)(C[5]N[5]2)(C[6]C[6]H){1|N<2>,1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5870	0.000	1	120.5195	0.009	2	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Ir)(C[5]C[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|C<4>,1|H<1>,2|C<3>}	C[6](N[6]C[6]Ir)(C[5]C[5]2)(C[6]C[6]H){2|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.0980	0.000	1	120.1457	0.010	3	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Ir)(C[5]C[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ir<7>,1|C<4>,1|H<1>,2|C<3>}	C[6](N[6]C[6]Ir)(C[5]C[5]2)(C[6]C[6]H){2|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.1695	0.129	2	120.1457	0.010	3	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Ir)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](N[6]C[6]Ir)(C[5]N[5]2)(C[6]C[6]H){1|C<3>,1|N<2>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.5100	0.000	1	120.5096	0.114	24	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Ir)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](N[6]C[6]Ir)(C[5]N[5]2)(C[6]C[6]H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5910	0.000	1	120.5096	0.114	24	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Ir)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Ir)(C[5]N[5]2)(C[6]C[6]H){1|C<3>,1|C<4>,2|H<1>,2|N<2>}	H(C[6]C[6]2)	121.0000	0.000	1	120.5096	0.114	24	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Ir)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Ir)(C[5]N[5]2)(C[6]C[6]H){1|C<4>,1|H<1>,4|C<3>}	H(C[6]C[6]2)	120.3950	0.395	5	120.5096	0.114	24	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Ir)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Ir)(C[5]N[5]2)(C[6]C[6]H){1|C<4>,1|N<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2810	0.168	2	120.5096	0.114	24	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Ir)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Ir)(C[5]N[5]2)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.1950	0.135	3	120.5096	0.114	24	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Ir)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Ir)(C[5]N[5]2)(C[6]C[6]H){1|N<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.7215	0.410	4	120.5096	0.114	24	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Ir)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Ir)(C[5]N[5]2)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.5722	0.381	4	120.5096	0.114	24	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Ir)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Ir)(C[5]N[5]2)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.5080	0.048	2	120.5096	0.114	24	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Ir)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ir<8>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Ir)(C[5]N[5]2)(C[6]C[6]H){1|C<3>,1|O<2>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	120.8160	0.000	1	120.5096	0.114	24	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Mn)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Mn<5>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Mn)(C[5]N[5]2)(C[6]C[6]H){2|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	120.9790	0.310	2	120.6857	0.124	37	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Mn)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Mn<5>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Mn)(C[5]N[5]2)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.7650	0.000	1	120.6857	0.124	37	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Mn)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](N[6]C[6]Mn)(C[5]N[5]2)(C[6]C[6]H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6644	0.390	11	120.6857	0.124	37	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Mn)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Mn)(C[5]N[5]2)(C[6]C[6]H){1|C<3>,1|O<1>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	120.9400	0.000	1	120.6857	0.124	37	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Mn)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Mn)(C[5]N[5]2)(C[6]C[6]H){1|C<3>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	120.8275	0.016	2	120.6857	0.124	37	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Mn)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Mn)(C[5]N[5]2)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.3740	0.206	2	120.6857	0.124	37	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Mn)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Mn)(C[5]N[5]2)(C[6]C[6]H){1|H<1>,1|O<1>,1|O<2>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	120.8670	0.000	1	120.6857	0.124	37	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Mn)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Mn)(C[5]N[5]2)(C[6]C[6]H){1|N<2>,1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.9525	0.196	2	120.6857	0.124	37	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Mn)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Mn)(C[5]N[5]2)(C[6]C[6]H){1|N<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.3260	0.000	1	120.6857	0.124	37	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Mn)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Mn)(C[5]N[5]2)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.4580	0.000	1	120.6857	0.124	37	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Mn)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Mn)(C[5]N[5]2)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.7176	0.493	7	120.6857	0.124	37	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Mn)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Mn)(C[5]N[5]2)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.4805	0.240	4	120.6857	0.124	37	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Mn)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Mn<8>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](N[6]C[6]Mn)(C[5]N[5]2)(C[6]C[6]H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.9690	0.000	1	120.6857	0.124	37	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Mn)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Mn<8>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Mn)(C[5]N[5]2)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.5270	0.000	1	120.6857	0.124	37	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Ni)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ni<5>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Ni)(C[5]N[5]2)(C[6]C[6]H){1|C<3>,1|H<1>,1|O<1>,3|C<4>}	H(C[6]C[6]2)	121.0880	0.000	1	120.8450	0.981	36	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Ni)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ni<5>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Ni)(C[5]N[5]2)(C[6]C[6]H){1|C<4>,1|H<1>,4|C<3>}	H(C[6]C[6]2)	120.6567	0.060	3	120.8450	0.981	36	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Ni)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|C<2>,1|C<3>,1|N<2>,1|N<3>}	C[6](N[6]C[6]Ni)(C[5]N[5]2)(C[6]C[6]H){1|C<3>,2|H<1>,2|S<2>}	H(C[6]C[6]2)	120.7410	0.000	1	120.8450	0.981	36	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Ni)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](N[6]C[6]Ni)(C[5]N[5]2)(C[6]C[6]H){1|C<3>,1|N<2>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	121.0335	0.078	2	120.8450	0.981	36	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Ni)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](N[6]C[6]Ni)(C[5]N[5]2)(C[6]C[6]H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6663	0.121	3	120.8450	0.981	36	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Ni)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Ni)(C[5]N[5]2)(C[6]C[6]H){1|C<3>,1|H<1>,1|O<1>,3|C<4>}	H(C[6]C[6]2)	120.8920	0.208	2	120.8450	0.981	36	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Ni)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Ni)(C[5]N[5]2)(C[6]C[6]H){1|C<3>,1|O<1>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	120.7500	0.000	1	120.8450	0.981	36	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Ni)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Ni)(C[5]N[5]2)(C[6]C[6]H){1|C<4>,1|H<1>,4|C<3>}	H(C[6]C[6]2)	120.8543	0.147	3	120.8450	0.981	36	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Ni)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Ni)(C[5]N[5]2)(C[6]C[6]H){1|H<1>,1|O<1>,1|O<2>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	120.8070	0.000	1	120.8450	0.981	36	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Ni)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Ni)(C[5]N[5]2)(C[6]C[6]H){1|H<1>,1|O<1>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	121.1005	0.094	4	120.8450	0.981	36	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Ni)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Ni)(C[5]N[5]2)(C[6]C[6]H){1|H<1>,2|C<4>,3|C<3>}	H(C[6]C[6]2)	120.6700	0.000	1	120.8450	0.981	36	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Ni)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Ni)(C[5]N[5]2)(C[6]C[6]H){1|N<2>,1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5060	0.000	1	120.8450	0.981	36	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Ni)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Ni)(C[5]N[5]2)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	121.6423	1.245	9	120.8450	0.981	36	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Ni)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ni<7>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Ni)(C[5]N[5]2)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.0730	0.956	4	120.8450	0.981	36	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Os)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Os<6>,1|C<3>,1|C<4>,2|N<3>}	C[6](N[6]C[6]Os)(C[5]N[5]2)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.9607	0.753	9	120.2375	0.780	15	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Os)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Os<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Os)(C[5]N[5]2)(C[6]C[6]H){1|C<4>,1|H<1>,4|C<3>}	H(C[6]C[6]2)	120.6527	0.965	6	120.2375	0.780	15	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Pd)(C[5]C[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Pd)(C[5]C[5]2)(C[6]C[6]H){1|N<2>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.7250	0.000	1	119.7250	0.000	1	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Pd)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Pd)(C[5]N[5]2)(C[6]C[6]H){1|C<3>,1|O<1>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	120.3970	0.355	2	120.3708	0.060	6	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Pd)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Pd)(C[5]N[5]2)(C[6]C[6]H){1|C<3>,1|S<4>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	120.1280	0.000	1	120.3708	0.060	6	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Pd)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Pd)(C[5]N[5]2)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.1780	0.000	1	120.3708	0.060	6	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Pd)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Pd)(C[5]N[5]2)(C[6]C[6]H){1|H<1>,5|C<3>}	H(C[6]C[6]2)	120.6000	0.000	1	120.3708	0.060	6	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Pd)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Pd)(C[5]N[5]2)(C[6]C[6]H){2|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.5250	0.000	1	120.3708	0.060	6	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Pt)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Pt)(C[5]N[5]2)(C[6]C[6]H){1|C<3>,1|O<1>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	121.3410	0.000	1	120.6980	0.440	8	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Pt)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Pt)(C[5]N[5]2)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.0027	0.391	3	120.6980	0.440	8	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Pt)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Pt)(C[5]N[5]2)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	121.0588	0.359	4	120.6980	0.440	8	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Re)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Re<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](N[6]C[6]Re)(C[5]N[5]2)(C[6]C[6]H){1|C<3>,1|N<2>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.6020	0.000	1	120.0125	2.307	13	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Re)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Re<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](N[6]C[6]Re)(C[5]N[5]2)(C[6]C[6]H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.7355	0.203	2	120.0125	2.307	13	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Re)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Re<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Re)(C[5]N[5]2)(C[6]C[6]H){1|Au<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.1170	0.000	1	120.0125	2.307	13	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Re)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Re<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Re)(C[5]N[5]2)(C[6]C[6]H){1|C<4>,1|H<1>,4|C<3>}	H(C[6]C[6]2)	120.4940	0.354	2	120.0125	2.307	13	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Re)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Re<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Re)(C[5]N[5]2)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.1654	2.313	5	120.0125	2.307	13	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Re)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Re<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Re)(C[5]N[5]2)(C[6]C[6]H){1|N<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.6670	0.000	1	120.0125	2.307	13	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Re)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Re<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Re)(C[5]N[5]2)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.4900	0.000	1	120.0125	2.307	13	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Ru)(C[5]C[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|C<4>,1|H<1>,2|C<3>}	C[6](N[6]C[6]Ru)(C[5]C[5]2)(C[6]C[6]H){3|C<3>,4|H<1>}	H(C[6]C[6]2)	120.0015	0.104	2	120.0015	0.011	2	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Ru)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Ru)(C[5]N[5]2)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.6490	0.000	1	120.6710	0.342	8	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Ru)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Ru)(C[5]N[5]2)(C[6]C[6]H){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	121.8940	0.000	1	120.6710	0.342	8	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Ru)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Ru)(C[5]N[5]2)(C[6]C[6]H){1|O<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.7590	0.000	1	120.6710	0.342	8	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Ru)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ru<9>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Ru)(C[5]N[5]2)(C[6]C[6]H){1|C<3>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	120.4600	0.000	1	120.6710	0.342	8	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Ru)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ru<9>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Ru)(C[5]N[5]2)(C[6]C[6]H){1|C<3>,2|H<1>,3|C<4>}	H(C[6]C[6]2)	119.8210	0.000	1	120.6710	0.342	8	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Ru)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ru<9>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Ru)(C[5]N[5]2)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.3970	0.000	1	120.6710	0.342	8	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Ru)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ru<9>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Ru)(C[5]N[5]2)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.6940	0.223	2	120.6710	0.342	8	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Sn)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Sn<4>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Sn)(C[5]N[5]2)(C[6]C[6]H){1|C<4>,1|H<1>,4|C<3>}	H(C[6]C[6]2)	120.6205	0.016	2	120.6205	0.000	2	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Zn)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Zn<4>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](N[6]C[6]Zn)(C[5]N[5]2)(C[6]C[6]H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.9020	0.102	3	120.8125	0.275	36	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Zn)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Zn<4>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Zn)(C[5]N[5]2)(C[6]C[6]H){1|C<4>,1|H<1>,1|O<2>,3|C<3>}	H(C[6]C[6]2)	120.9220	0.000	1	120.8125	0.275	36	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Zn)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Zn<4>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Zn)(C[5]N[5]2)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.4515	0.466	2	120.8125	0.275	36	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Zn)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Zn<4>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Zn)(C[5]N[5]2)(C[6]C[6]H){1|N<2>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	120.7590	0.000	1	120.8125	0.275	36	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Zn)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Zn<4>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Zn)(C[5]N[5]2)(C[6]C[6]H){1|O<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.6570	0.000	1	120.8125	0.275	36	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Zn)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Zn<5>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Zn)(C[5]N[5]2)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	121.0620	0.000	1	120.8125	0.275	36	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Zn)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Zn<5>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Zn)(C[5]N[5]2)(C[6]C[6]H){1|H<1>,1|O<1>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	120.8190	0.040	8	120.8125	0.275	36	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Zn)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Zn<5>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Zn)(C[5]N[5]2)(C[6]C[6]H){1|H<1>,5|C<3>}	H(C[6]C[6]2)	121.2205	0.077	2	120.8125	0.275	36	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Zn)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Zn<5>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Zn)(C[5]N[5]2)(C[6]C[6]H){1|N<2>,1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.8020	0.000	1	120.8125	0.275	36	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Zn)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Zn<5>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Zn)(C[5]N[5]2)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	118.3130	0.000	1	120.8125	0.275	36	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Zn)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Zn<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](N[6]C[6]Zn)(C[5]N[5]2)(C[6]C[6]H){1|C<3>,1|N<2>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.9400	0.000	1	120.8125	0.275	36	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Zn)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Zn<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](N[6]C[6]Zn)(C[5]N[5]2)(C[6]C[6]H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5690	0.000	1	120.8125	0.275	36	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Zn)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Zn<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Zn)(C[5]N[5]2)(C[6]C[6]H){1|C<3>,1|O<1>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	120.8060	0.000	1	120.8125	0.275	36	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Zn)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Zn<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Zn)(C[5]N[5]2)(C[6]C[6]H){1|C<4>,1|H<1>,4|C<3>}	H(C[6]C[6]2)	121.0630	0.024	2	120.8125	0.275	36	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Zn)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Zn<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Zn)(C[5]N[5]2)(C[6]C[6]H){1|N<2>,1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.8290	0.000	1	120.8125	0.275	36	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Zn)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Zn<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Zn)(C[5]N[5]2)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	121.1418	0.061	8	120.8125	0.275	36	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Zn)(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Zn<6>,1|N<2>,1|N<3>,2|C<3>}	C[6](N[6]C[6]Zn)(C[5]N[5]2)(C[6]C[6]H){1|C<3>,1|N<2>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.7300	0.000	1	120.8125	0.275	36	120.6918	0.363	459	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6,6]H)(H)	C[6](N[6]C[6,6]Ru)(C[5a]C[5a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6,6]H)(H){1|Ru<5>,4|C<3>}	C[6](N[6]C[6,6]Ru)(C[5a]C[5a]2)(C[6]C[6]H){1|C<4>,1|H<1>,1|N<3>,1|O<2>,2|C<3>}	H(C[6]C[6]2)	120.1330	0.000	1	120.1330	0.000	1	120.2239	0.075	10	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6,6a]H)(H)	C[6](N[6]C[6,6a]Cu)(C[5a]N[5a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6,6a]H)(H){1|Cu<4>,1|N<2>,1|N<3>,2|C<3>}	C[6](N[6]C[6,6a]Cu)(C[5a]N[5a]2)(C[6]C[6]H){1|H<1>,4|C<3>}	H(C[6]C[6]2)	120.4993	0.290	3	120.4993	0.084	3	120.2239	0.075	10	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6,6a]H)(H)	C[6](N[6]C[6,6a]Fe)(C[5a]N[5a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6,6a]H)(H){1|Fe<6>,1|N<2>,1|N<3>,2|C<3>}	C[6](N[6]C[6,6a]Fe)(C[5a]N[5a]2)(C[6]C[6]H){1|H<1>,2|C<3>,2|N<2>}	H(C[6]C[6]2)	120.0965	0.226	4	120.0748	0.041	5	120.2239	0.075	10	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6,6a]H)(H)	C[6](N[6]C[6,6a]Fe)(C[5a]N[5a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6,6a]H)(H){1|Fe<6>,1|N<2>,1|N<3>,2|C<3>}	C[6](N[6]C[6,6a]Fe)(C[5a]N[5a]2)(C[6]C[6]H){1|H<1>,4|C<3>}	H(C[6]C[6]2)	119.9880	0.000	1	120.0748	0.041	5	120.2239	0.075	10	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6,6a]H)(H)	C[6](N[6]C[6,6a]Ir)(C[5a]N[5a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6,6a]H)(H){1|Ir<6>,1|N<2>,1|N<3>,2|C<3>}	C[6](N[6]C[6,6a]Ir)(C[5a]N[5a]2)(C[6]C[6]H){1|H<1>,4|C<3>}	H(C[6]C[6]2)	120.2340	0.000	1	120.2340	0.000	1	120.2239	0.075	10	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[3x6]N[6])(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[3x6]N[6])(C[6]N[6]C)(H){1|Fe<8>,1|C<3>,3|C<4>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CCN){1|C<3>,1|C<4>,1|N<2>}	H(C[6]C[6]2)	119.6560	0.000	1	119.6560	0.000	1	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]N[6]C)(H)	C[6](N[6]C[5,6]Co)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]N[6]C)(H){1|Co<5>,1|C<3>,1|C<4>}	C[6](N[6]C[5,6]Co)(C[6]C[6]H)(CCN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3560	0.000	1	120.3560	0.000	1	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6]Co)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|Co<4>,2|C<3>}	C[6](N[6]C[6,6]Co)(C[6]C[6]H)(CCN){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0000	0.000	1	120.2370	0.122	6	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6]Co)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|Co<5>,1|C<3>,1|C<4>}	C[6](N[6]C[6,6]Co)(C[6]C[6]H)(CCN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.7820	0.000	1	120.2370	0.122	6	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6]Co)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|Co<5>,2|C<3>}	C[6](N[6]C[6,6]Co)(C[6]C[6]H)(CCN){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3235	0.336	2	120.2370	0.122	6	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6]Co)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|Co<6>,2|C<3>}	C[6](N[6]C[6,6]Co)(C[6]C[6]H)(CCN){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9965	0.111	2	120.2370	0.122	6	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6]Fe)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|Fe<5>,1|C<3>,1|C<4>}	C[6](N[6]C[6,6]Fe)(C[6]C[6]H)(CCN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.6690	0.000	1	120.6690	0.000	1	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6]Ni)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|Ni<3>,1|C<3>,1|C<4>}	C[6](N[6]C[6,6]Ni)(C[6]C[6]H)(CCN){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4990	0.000	1	119.9188	0.081	20	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6]Ni)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|Ni<3>,2|C<3>}	C[6](N[6]C[6,6]Ni)(C[6]C[6]H)(CCN){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8117	0.123	4	119.9188	0.081	20	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6]Ni)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|Ni<4>,2|C<3>}	C[6](N[6]C[6,6]Ni)(C[6]C[6]H)(CCN){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9454	0.301	11	119.9188	0.081	20	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6]Ni)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|Ni<5>,2|C<3>}	C[6](N[6]C[6,6]Ni)(C[6]C[6]H)(CCN){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7060	0.122	3	119.9188	0.081	20	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6]Ni)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|Ni<6>,2|C<3>}	C[6](N[6]C[6,6]Ni)(C[6]C[6]H)(CCN){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1130	0.000	1	119.9188	0.081	20	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6]Rh)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|Rh<5>,2|C<3>}	C[6](N[6]C[6,6]Rh)(C[6]C[6]H)(COO){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0980	0.000	1	120.0980	0.000	1	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6]Ru)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|Ru<7>,1|C<3>,1|C<4>}	C[6](N[6]C[6,6]Ru)(C[6]C[6]H)(CHN){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1850	0.000	1	120.1850	0.000	1	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6]Ti)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|Ti<12>,1|C<3>,1|C<4>}	C[6](N[6]C[6,6]Ti)(C[6]C[6]H)(CCN){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.1415	0.240	4	120.1415	0.058	4	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6]Ti)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|Ti<12>,1|C<3>,1|C<4>}	C[6](N[6]C[6,6]Ti)(C[6]C[6]H)(CHN){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.4260	0.000	1	120.3365	0.016	2	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6]Ti)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|Ti<8>,1|C<3>,1|C<4>}	C[6](N[6]C[6,6]Ti)(C[6]C[6]H)(CHN){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.2470	0.000	1	120.3365	0.016	2	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]C)(C[6]C[6]H)(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]N[6]C)(H){1|C<4>,2|C<3>}	C[6](N[6]C[6,6a]C)(C[6]C[6]H)(CCH){3|C<3>}	H(C[6]C[6]2)	117.8890	0.197	2	117.8890	0.039	2	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]C)(C[6]C[6]H)(CC[4a]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]N[6]C)(H){1|C<4>,2|C<3>}	C[6](N[6]C[6,6a]C)(C[6]C[6]H)(CC[4a]H){1|C<4>,2|C<3>}	H(C[6]C[6]2)	118.3980	0.000	1	118.3980	0.000	1	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Re)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]N[6]C)(H){1|Re<6>,2|C<3>}	C[6](N[6]C[6,6a]Re)(C[6]C[6]H)(COO){3|C<3>}	H(C[6]C[6]2)	120.0483	0.035	3	120.0483	0.001	3	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]Cl)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]H)(C[6]C[6]H)(CCC)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]Cl)(C[6]N[6]C)(H){1|H<1>,2|C<3>}	C[6](N[6]C[6,6a]H)(C[6]C[6]H)(CCC){1|Cl<1>,2|C<3>}	H(C[6]C[6]2)	120.4840	0.000	1	120.4840	0.000	1	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Ag)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Ag<6>,2|C<3>}	C[6](N[6]C[6,6a]Ag)(C[6]C[6]H)(CHN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.0745	0.482	2	120.0745	0.232	2	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Ag)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Ag<3>,2|C<3>}	C[6](N[6]C[6,6a]Ag)(C[6]C[6]H)(COO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.1220	0.000	1	120.1220	0.000	1	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Al)(C[6]C[6]H)(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Al<4>,2|C<3>}	C[6](N[6]C[6,6a]Al)(C[6]C[6]H)(CCH){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.4386	0.097	7	119.4459	0.008	8	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Al)(C[6]C[6]H)(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Al<5>,2|C<3>}	C[6](N[6]C[6,6a]Al)(C[6]C[6]H)(CCH){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.4970	0.000	1	119.4459	0.008	8	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Al)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Al<5>,2|C<3>}	C[6](N[6]C[6,6a]Al)(C[6]C[6]H)(CCN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.9220	0.000	1	119.9220	0.000	1	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Bi)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Bi<5>,2|C<3>}	C[6](N[6]C[6,6a]Bi)(C[6]C[6]H)(COO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.4065	0.042	2	120.4065	0.002	2	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]C)(C[6]C[6]H)(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|C<4>,2|C<3>}	C[6](N[6]C[6,6a]C)(C[6]C[6]H)(CCH){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.6084	0.368	23	119.6084	0.135	23	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]C)(C[6]C[6]H)(CC[5]Br)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|C<4>,2|C<3>}	C[6](N[6]C[6,6a]C)(C[6]C[6]H)(CC[5]Br){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.7590	0.000	1	120.7590	0.000	1	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]C)(C[6]C[6]H)(CC[5]C)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|C<4>,2|C<3>}	C[6](N[6]C[6,6a]C)(C[6]C[6]H)(CC[5]C){1|H<1>,2|C<3>}	H(C[6]C[6]2)	118.1755	0.401	2	118.1755	0.161	2	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]C)(C[6]C[6]H)(CC[5]Cl)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|C<4>,2|C<3>}	C[6](N[6]C[6,6a]C)(C[6]C[6]H)(CC[5]Cl){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5250	0.000	1	120.5250	0.000	1	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]C)(C[6]C[6]H)(CC[5]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|C<4>,2|C<3>}	C[6](N[6]C[6,6a]C)(C[6]C[6]H)(CC[5]H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	115.9130	2.707	2	115.9130	7.327	2	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]C)(C[6]C[6]H)(CC[5]S)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|C<4>,2|C<3>}	C[6](N[6]C[6,6a]C)(C[6]C[6]H)(CC[5]S){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.7810	0.000	1	119.7810	0.000	1	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Cd)(C[6]C[6]H)(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Cd<5>,2|C<3>}	C[6](N[6]C[6,6a]Cd)(C[6]C[6]H)(CCH){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.0345	0.834	2	119.9537	0.180	8	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Cd)(C[6]C[6]H)(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Cd<6>,2|C<3>}	C[6](N[6]C[6,6a]Cd)(C[6]C[6]H)(CCH){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.9268	0.331	6	119.9537	0.180	8	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Cd)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Cd<5>,2|C<3>}	C[6](N[6]C[6,6a]Cd)(C[6]C[6]H)(CHN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.8320	0.000	1	120.5445	0.077	4	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Cd)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Cd<8>,2|C<3>}	C[6](N[6]C[6,6a]Cd)(C[6]C[6]H)(CHN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.4487	0.247	3	120.5445	0.077	4	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Co)(C[6]C[6]H)(CHP)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Co<4>,2|C<3>}	C[6](N[6]C[6,6a]Co)(C[6]C[6]H)(CHP){1|H<1>,2|C<3>}	H(C[6]C[6]2)	118.8440	0.000	1	118.9827	0.021	3	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Co)(C[6]C[6]H)(CHP)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Co<5>,2|C<3>}	C[6](N[6]C[6,6a]Co)(C[6]C[6]H)(CHP){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.0520	0.119	2	118.9827	0.021	3	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Co)(C[6]C[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Co<6>,2|C<3>}	C[6](N[6]C[6,6a]Co)(C[6]C[6]H)(CNO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.4500	0.000	1	120.4500	0.000	1	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Co)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Co<5>,2|C<3>}	C[6](N[6]C[6,6a]Co)(C[6]C[6]H)(COO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.9615	0.134	2	120.8197	0.034	4	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Co)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Co<6>,2|C<3>}	C[6](N[6]C[6,6a]Co)(C[6]C[6]H)(COO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.6780	0.052	2	120.8197	0.034	4	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Cu<4>,2|C<3>}	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(CCH){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.5525	0.083	2	119.5525	0.007	2	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(CC[5a]C)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Cu<5>,2|C<3>}	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(CC[5a]C){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.4565	0.043	2	119.4565	0.002	2	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Cu<4>,2|C<3>}	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(CHN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.7155	0.342	4	120.6567	0.091	6	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Cu<5>,2|C<3>}	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(CHN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5390	0.252	2	120.6567	0.091	6	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Cu<4>,2|C<3>}	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(CNO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.4440	0.262	2	120.4495	0.050	6	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Cu<5>,2|C<3>}	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(CNO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.4207	0.290	3	120.4495	0.050	6	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Cu<6>,2|C<3>}	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(CNO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5470	0.000	1	120.4495	0.050	6	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Cu<4>,2|C<3>}	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(COO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3570	0.134	2	120.3570	0.018	2	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Fe)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Fe<6>,2|C<3>}	C[6](N[6]C[6,6a]Fe)(C[6]C[6]H)(CHN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.2567	0.328	4	120.2567	0.108	4	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Fe)(C[6]C[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Fe<6>,2|C<3>}	C[6](N[6]C[6,6a]Fe)(C[6]C[6]H)(CNO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.2983	0.410	3	120.2983	0.168	3	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Fe)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Fe<5>,2|C<3>}	C[6](N[6]C[6,6a]Fe)(C[6]C[6]H)(COO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	118.6945	1.139	2	119.7248	1.595	9	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Fe)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Fe<6>,2|C<3>}	C[6](N[6]C[6,6a]Fe)(C[6]C[6]H)(COO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.0191	1.206	7	119.7248	1.595	9	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]H)(C[6]C[6]H)(CCC)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|H<1>,2|C<3>}	C[6](N[6]C[6,6a]H)(C[6]C[6]H)(CCC){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	119.3160	0.000	1	119.4400	0.031	2	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]H)(C[6]C[6]H)(CCC)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|H<1>,2|C<3>}	C[6](N[6]C[6,6a]H)(C[6]C[6]H)(CCC){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.5640	0.000	1	119.4400	0.031	2	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]H)(C[6]C[6]H)(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|H<1>,2|C<3>}	C[6](N[6]C[6,6a]H)(C[6]C[6]H)(CCH){1|H<1>,2|C<3>}	H(C[6]C[6]2)	118.2154	1.630	10	118.2154	2.657	10	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]H)(C[6]C[6]H)(CC[6a]2)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|H<1>,2|C<3>}	C[6](N[6]C[6,6a]H)(C[6]C[6]H)(CC[6a]2){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	119.4510	0.000	1	119.4510	0.000	1	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]H)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|H<1>,2|C<3>}	C[6](N[6]C[6,6a]H)(C[6]C[6]H)(CHN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.9405	0.046	2	119.9405	0.002	2	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]H)(C[6]C[6]H)(CNS)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|H<1>,2|C<3>}	C[6](N[6]C[6,6a]H)(C[6]C[6]H)(CNS){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3120	0.000	1	120.3120	0.000	1	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]H)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|H<1>,2|C<3>}	C[6](N[6]C[6,6a]H)(C[6]C[6]H)(COO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.1406	0.703	16	120.1406	0.495	16	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Hg)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Hg<4>,2|C<3>}	C[6](N[6]C[6,6a]Hg)(C[6]C[6]H)(CHN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.4166	0.186	5	120.4166	0.034	5	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Ir)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Ir<7>,2|C<3>}	C[6](N[6]C[6,6a]Ir)(C[6]C[6]H)(CHN){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.2950	0.000	1	120.4205	0.032	2	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Ir)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Ir<8>,2|C<3>}	C[6](N[6]C[6,6a]Ir)(C[6]C[6]H)(CHN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5460	0.000	1	120.4205	0.032	2	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Ir)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Ir<7>,2|C<3>}	C[6](N[6]C[6,6a]Ir)(C[6]C[6]H)(COO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.2740	0.000	1	119.2740	0.000	1	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Mg)(C[6]C[6]H)(CHP)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Mg<4>,2|C<3>}	C[6](N[6]C[6,6a]Mg)(C[6]C[6]H)(CHP){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.2220	0.190	2	119.2220	0.036	2	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Mg)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Mg<6>,2|C<3>}	C[6](N[6]C[6,6a]Mg)(C[6]C[6]H)(COO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.2130	0.000	1	120.2130	0.000	1	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Mn)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Mn<6>,2|C<3>}	C[6](N[6]C[6,6a]Mn)(C[6]C[6]H)(CHN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.6237	0.475	23	120.6237	0.226	23	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Mn)(C[6]C[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Mn<6>,2|C<3>}	C[6](N[6]C[6,6a]Mn)(C[6]C[6]H)(CNO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5120	0.000	1	120.5120	0.000	1	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Mn)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Mn<6>,2|C<3>}	C[6](N[6]C[6,6a]Mn)(C[6]C[6]H)(COO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.6498	0.299	10	120.6498	0.089	10	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Ni)(C[6]C[6]H)(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Ni<4>,2|C<3>}	C[6](N[6]C[6,6a]Ni)(C[6]C[6]H)(CCH){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.3145	0.142	2	119.3145	0.020	2	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Ni)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Ni<5>,2|C<3>}	C[6](N[6]C[6,6a]Ni)(C[6]C[6]H)(CHN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.7603	0.438	6	120.7603	0.192	6	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Ni)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Ni<6>,2|C<3>}	C[6](N[6]C[6,6a]Ni)(C[6]C[6]H)(COO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.2067	2.741	4	119.2067	7.514	4	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]O)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|O<1>,2|C<3>}	C[6](N[6]C[6,6a]O)(C[6]C[6]H)(COO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	116.5160	0.000	1	116.5160	0.000	1	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Os)(C[6]C[6]H)(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Os<7>,2|C<3>}	C[6](N[6]C[6,6a]Os)(C[6]C[6]H)(CCH){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.3800	0.000	1	119.3800	0.000	1	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Pd)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Pd<4>,2|C<3>}	C[6](N[6]C[6,6a]Pd)(C[6]C[6]H)(CHN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	118.8448	2.408	4	118.8448	5.797	4	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Pd)(C[6]C[6]H)(CHP)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Pd<4>,2|C<3>}	C[6](N[6]C[6,6a]Pd)(C[6]C[6]H)(CHP){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.2767	0.440	3	119.2767	0.193	3	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Pd)(C[6]C[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Pd<4>,2|C<3>}	C[6](N[6]C[6,6a]Pd)(C[6]C[6]H)(CNO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.0330	0.000	1	120.0330	0.000	1	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Pd)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Pd<4>,2|C<3>}	C[6](N[6]C[6,6a]Pd)(C[6]C[6]H)(COO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.2680	0.000	1	120.2680	0.000	1	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Pt)(C[6]C[6]H)(CCC)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Pt<4>,2|C<3>}	C[6](N[6]C[6,6a]Pt)(C[6]C[6]H)(CCC){1|H<1>,2|C<3>}	H(C[6]C[6]2)	118.7400	0.429	2	118.7400	0.184	2	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Pt)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Pt<4>,2|C<3>}	C[6](N[6]C[6,6a]Pt)(C[6]C[6]H)(COO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.4220	0.000	1	120.4220	0.000	1	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Re)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Re<6>,2|C<3>}	C[6](N[6]C[6,6a]Re)(C[6]C[6]H)(COO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.8940	0.431	2	119.8940	0.186	2	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Ru)(C[6]C[6]H)(CHP)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Ru<5>,2|C<3>}	C[6](N[6]C[6,6a]Ru)(C[6]C[6]H)(CHP){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.3920	0.000	1	119.3920	0.000	1	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Ru)(C[6]C[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Ru<9>,2|C<3>}	C[6](N[6]C[6,6a]Ru)(C[6]C[6]H)(CNO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5360	0.105	6	120.5360	0.011	6	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Ru)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Ru<10>,2|C<3>}	C[6](N[6]C[6,6a]Ru)(C[6]C[6]H)(COO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.6247	0.175	6	120.6247	0.031	6	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Sn)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Sn<5>,2|C<3>}	C[6](N[6]C[6,6a]Sn)(C[6]C[6]H)(COO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.8070	0.059	2	120.6724	0.019	5	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Sn)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Sn<6>,2|C<3>}	C[6](N[6]C[6,6a]Sn)(C[6]C[6]H)(COO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5827	0.073	3	120.6724	0.019	5	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Zn)(C[6]C[6]H)(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Zn<4>,2|C<3>}	C[6](N[6]C[6,6a]Zn)(C[6]C[6]H)(CCH){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.4790	0.000	1	119.4790	0.000	1	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Zn)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Zn<4>,2|C<3>}	C[6](N[6]C[6,6a]Zn)(C[6]C[6]H)(CHN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.9488	0.944	6	120.9488	0.891	6	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Zn)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Zn<5>,2|C<3>}	C[6](N[6]C[6,6a]Zn)(C[6]C[6]H)(COO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.8320	1.235	21	120.0054	1.183	29	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Zn)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Zn<6>,2|C<3>}	C[6](N[6]C[6,6a]Zn)(C[6]C[6]H)(COO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.4606	0.214	8	120.0054	1.183	29	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]N)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]C)(C[6]C[6]H)(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]N)(C[6]N[6]C)(H){1|C<4>,2|C<3>}	C[6](N[6]C[6,6a]C)(C[6]C[6]H)(CCH){1|N<3>,2|C<3>}	H(C[6]C[6]2)	117.6885	1.100	2	117.6885	1.209	2	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]N)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]H)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]N)(C[6]N[6]C)(H){1|H<1>,2|C<3>}	C[6](N[6]C[6,6a]H)(C[6]C[6]H)(COO){1|N<3>,2|C<3>}	H(C[6]C[6]2)	118.0090	3.827	2	118.0090	14.645	2	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]H)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]N[6]C)(H){1|H<1>,2|C<3>}	C[6](N[6]C[6,6a]H)(C[6]C[6]H)(COO){1|O<2>,2|C<3>}	H(C[6]C[6]2)	117.7950	4.342	3	117.7950	18.849	3	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Ir)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]N[6]C)(H){1|Ir<6>,2|C<3>}	C[6](N[6]C[6,6a]Ir)(C[6]C[6]H)(COO){1|O<2>,2|C<3>}	H(C[6]C[6]2)	120.3210	0.000	1	120.3210	0.000	1	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Re)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]N[6]C)(H){1|Re<6>,2|C<3>}	C[6](N[6]C[6,6a]Re)(C[6]C[6]H)(COO){1|O<2>,2|C<3>}	H(C[6]C[6]2)	120.6210	0.000	1	120.6210	0.000	1	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](N[6]C[6]Al)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|Al<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Al)(C[6]C[6]H)(COO){3|C<3>}	H(C[6]C[6]2)	120.9850	0.014	2	120.9850	0.000	2	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|Co<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CCN){1|C<4>,2|C<3>}	H(C[6]C[6]2)	119.7280	0.126	4	119.7280	0.016	4	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(COO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.2200	0.000	1	120.5488	0.041	5	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(COO){3|C<3>}	H(C[6]C[6]2)	120.6310	0.101	4	120.5488	0.041	5	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(COO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5460	0.000	1	120.6483	0.014	3	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|Cu<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(COO){3|C<3>}	H(C[6]C[6]2)	120.6995	0.115	2	120.6483	0.014	3	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|Fe<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CCN){1|C<4>,2|C<3>}	H(C[6]C[6]2)	119.5148	0.104	12	119.5148	0.011	12	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|Ir<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(COO){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.0470	0.260	2	120.0470	0.068	2	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mg)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|Mg<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mg)(C[6]C[6]H)(COO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3417	0.190	3	120.3417	0.036	3	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|Mn<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CCN){3|C<3>}	H(C[6]C[6]2)	120.8450	0.048	4	120.8450	0.002	4	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(COO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.1740	0.000	1	120.1740	0.000	1	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(COO){3|C<3>}	H(C[6]C[6]2)	120.9693	0.112	4	120.9693	0.013	4	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(COO){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.0310	0.000	1	120.0310	0.000	1	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(COO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.6400	0.187	6	120.6400	0.035	6	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]N[6]C)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CNO){1|Cl<1>,2|C<3>}	H(C[6]C[6]2)	121.4150	0.095	2	121.4150	0.009	2	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]N[6]C)(H){1|Mn<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CCN){1|Cl<1>,2|C<3>}	H(C[6]C[6]2)	121.1835	0.268	2	121.1835	0.072	2	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]N[6]C)(H){1|Ni<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CNO){1|Cl<1>,2|C<3>}	H(C[6]C[6]2)	121.6595	0.474	2	121.6595	0.225	2	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]B[6]C[6])(C[6]C[6]H)(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](N[6]B[6]C[6])(C[6]C[6]H)(CCH){3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.5470	0.000	1	119.5470	0.000	1	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ag)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ag<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ag)(C[6]C[6]H)(CHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5740	0.072	2	120.7423	0.088	3	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ag)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ag<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ag)(C[6]C[6]H)(CHN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	121.0790	0.000	1	120.7423	0.088	3	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Al)(C[6]C[6]H)(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Al<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Al)(C[6]C[6]H)(CCH){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.5280	0.000	1	119.6958	0.022	5	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Al)(C[6]C[6]H)(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Al<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Al)(C[6]C[6]H)(CCH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7378	0.135	4	119.6958	0.022	5	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Al)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Al<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Al)(C[6]C[6]H)(CCN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1650	0.000	1	120.1534	0.039	9	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Al)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Al<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Al)(C[6]C[6]H)(CCN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.0530	0.354	3	120.1534	0.039	9	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Al)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Al<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Al)(C[6]C[6]H)(CCN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2470	0.013	3	120.1534	0.039	9	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Al)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Al<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Al)(C[6]C[6]H)(CCN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.1580	0.010	2	120.1534	0.039	9	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Al)(C[6]C[6]H)(CC[6a]N)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Al<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Al)(C[6]C[6]H)(CC[6a]N){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.2780	0.000	1	120.3254	0.419	24	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Al)(C[6]C[6]H)(CC[6a]N)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Al<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Al)(C[6]C[6]H)(CC[6a]N){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3499	0.766	14	120.3254	0.419	24	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Al)(C[6]C[6]H)(CC[6a]N)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Al<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Al)(C[6]C[6]H)(CC[6a]N){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.2926	0.497	9	120.3254	0.419	24	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Al)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Al<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Al)(C[6]C[6]H)(CHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1848	0.146	4	120.1848	0.021	4	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Al)(C[6]C[6]H)(CHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Al<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Al)(C[6]C[6]H)(CHP){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.6110	0.000	1	119.6110	0.000	1	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Al)(C[6]C[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Al<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Al)(C[6]C[6]H)(CNO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.8830	0.172	4	120.8830	0.030	4	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Al)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Al<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Al)(C[6]C[6]H)(COO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	121.1275	0.108	4	121.1275	0.012	4	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Al)(C[6]C[6]H)(CSiC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Al<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Al)(C[6]C[6]H)(CSiC){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.5415	0.480	2	119.5415	0.231	2	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Au)(C[6]C[6]H)(CNS)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Au<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Au)(C[6]C[6]H)(CNS){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.2210	0.171	2	120.2210	0.029	2	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Bi)(C[6]C[6]H)(CC[6a]N)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Bi<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Bi)(C[6]C[6]H)(CC[6a]N){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2880	0.000	1	120.2880	0.000	1	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ca)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ca<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ca)(C[6]C[6]H)(CHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4786	0.145	5	120.4786	0.021	5	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ca)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ca<9>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ca)(C[6]C[6]H)(COO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.6893	0.132	3	120.6893	0.017	3	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cd)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cd<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cd)(C[6]C[6]H)(CCN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5084	0.165	5	120.4312	0.052	14	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cd)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cd<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cd)(C[6]C[6]H)(CCN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5435	0.457	2	120.4312	0.052	14	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cd)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cd<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cd)(C[6]C[6]H)(CCN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3440	0.204	7	120.4312	0.052	14	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cd)(C[6]C[6]H)(CC[6]N)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cd<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cd)(C[6]C[6]H)(CC[6]N){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5280	0.165	2	120.5280	0.027	2	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cd)(C[6]C[6]H)(CC[6a]N)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cd<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cd)(C[6]C[6]H)(CC[6a]N){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3875	0.073	2	120.2205	0.027	8	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cd)(C[6]C[6]H)(CC[6a]N)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cd<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cd)(C[6]C[6]H)(CC[6a]N){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1648	0.146	6	120.2205	0.027	8	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cd)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cd)(C[6]C[6]H)(CHN){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.3900	0.000	1	120.6595	0.178	14	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cd)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cd<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cd)(C[6]C[6]H)(CHN){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	121.4625	0.128	2	120.6595	0.178	14	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cd)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cd<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cd)(C[6]C[6]H)(CHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4870	0.182	4	120.6595	0.178	14	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cd)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cd<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cd)(C[6]C[6]H)(CHN){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.9495	0.050	2	120.6595	0.178	14	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cd)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cd<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cd)(C[6]C[6]H)(CHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4582	0.263	4	120.6595	0.178	14	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cd)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cd<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cd)(C[6]C[6]H)(CHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2380	0.000	1	120.6595	0.178	14	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cd)(C[6]C[6]H)(CNN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cd<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cd)(C[6]C[6]H)(CNN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3740	0.000	1	120.3740	0.000	1	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cd)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cd<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cd)(C[6]C[6]H)(COO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	118.9333	2.202	4	120.1318	1.525	31	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cd)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cd<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cd)(C[6]C[6]H)(COO){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.8053	0.166	4	120.1318	1.525	31	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cd)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cd<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cd)(C[6]C[6]H)(COO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	118.6112	1.828	4	120.1318	1.525	31	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cd)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cd<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cd)(C[6]C[6]H)(COO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.6211	0.159	14	120.1318	1.525	31	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cd)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cd<6>,2|C<3>}	C[6](N[6]C[6]Cd)(C[6]C[6]H)(COO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3980	0.243	5	120.1318	1.525	31	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CCH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.6890	0.317	2	119.5303	0.090	6	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CCH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.4510	0.301	4	119.5303	0.090	6	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CCN){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.1860	0.000	1	120.5508	0.253	162	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CCN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3318	0.466	53	120.5508	0.253	162	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<5>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CCN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	121.4313	0.426	4	120.5508	0.253	162	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CCN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3120	0.138	3	120.5508	0.253	162	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CCN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.6888	0.425	60	120.5508	0.253	162	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<5>,1|C<3>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CCN){1|C<2>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.4030	0.000	1	120.5508	0.253	162	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CCN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3298	0.358	9	120.5508	0.253	162	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CCN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.4443	0.409	20	120.5508	0.253	162	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CCN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.9278	0.633	11	120.5508	0.253	162	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CCO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CCO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6723	0.081	3	120.6723	0.007	3	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CC[6]C)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CC[6]C){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.4950	0.542	2	120.4950	0.293	2	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CC[6a]N)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CC[6a]N){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	115.5400	0.000	1	119.8473	2.212	11	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CC[6a]N)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CC[6a]N){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3895	0.187	4	119.8473	2.212	11	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CC[6a]N)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CC[6a]N){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9580	0.508	4	119.8473	2.212	11	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CC[6a]N)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CC[6a]N){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.6950	0.157	2	119.8473	2.212	11	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CC[6a]O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CC[6a]O){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3470	0.000	1	120.3470	0.000	1	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CClN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CClN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.8324	0.118	8	120.8324	0.014	8	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.1266	2.387	8	120.3597	1.039	69	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CHN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.4410	0.164	2	120.3597	1.039	69	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5360	0.173	3	120.3597	1.039	69	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CHN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.2533	0.182	4	120.3597	1.039	69	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CHN){1|Br<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3875	0.070	2	120.3597	1.039	69	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CHN){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.6053	0.716	6	120.3597	1.039	69	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4837	0.674	27	120.3597	1.039	69	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CHN){1|Cl<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6705	0.975	2	120.3597	1.039	69	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CHN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.6332	0.249	15	120.3597	1.039	69	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CHP){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.0290	0.134	2	119.0290	0.018	2	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CNN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CNN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	121.3410	0.057	2	121.3410	0.003	2	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CNO){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.8790	0.000	1	120.4931	0.608	111	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CNO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.7062	0.048	5	120.4931	0.608	111	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CNO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4224	0.516	45	120.4931	0.608	111	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CNO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5266	0.986	57	120.4931	0.608	111	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<6>,2|C<3>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CNO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4340	0.222	3	120.4931	0.608	111	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(COO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5790	0.000	1	120.6575	0.515	86	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(COO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.9640	0.000	1	120.6575	0.515	86	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<6>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(COO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4740	0.000	1	120.6575	0.515	86	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(COO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1525	1.402	17	120.6575	0.515	86	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(COO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.8169	0.335	57	120.6575	0.515	86	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<6>,2|C<3>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(COO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5726	0.099	8	120.6575	0.515	86	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(COO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.7970	0.000	1	120.6575	0.515	86	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cr)(C[6]C[6]H)(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cr<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cr)(C[6]C[6]H)(CCH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.8570	0.000	1	119.8330	0.001	2	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cr)(C[6]C[6]H)(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cr<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cr)(C[6]C[6]H)(CCH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8090	0.000	1	119.8330	0.001	2	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cr)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cr<6>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Cr)(C[6]C[6]H)(CCN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.7740	0.000	1	120.7535	0.001	2	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cr)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cr<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cr)(C[6]C[6]H)(CCN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.7330	0.000	1	120.7535	0.001	2	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cr)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cr<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cr)(C[6]C[6]H)(CHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.6025	0.012	2	119.6164	3.659	16	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cr)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cr<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cr)(C[6]C[6]H)(CHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	117.6505	3.150	4	119.6164	3.659	16	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cr)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cr<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cr)(C[6]C[6]H)(CHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2824	0.805	5	119.6164	3.659	16	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cr)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cr<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cr)(C[6]C[6]H)(CHN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.8405	0.257	2	119.6164	3.659	16	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cr)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cr<6>,2|C<3>}	C[6](N[6]C[6]Cr)(C[6]C[6]H)(CHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.7610	0.000	1	119.6164	3.659	16	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cr)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cr<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cr)(C[6]C[6]H)(CHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1005	0.047	2	119.6164	3.659	16	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cr)(C[6]C[6]H)(CHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cr<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cr)(C[6]C[6]H)(CHP){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.7950	0.000	1	119.4270	0.102	3	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cr)(C[6]C[6]H)(CHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cr<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cr)(C[6]C[6]H)(CHP){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.2430	0.000	2	119.4270	0.102	3	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cr)(C[6]C[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cr<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cr)(C[6]C[6]H)(CNO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3317	0.334	19	120.3317	0.111	19	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cr)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cr<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cr)(C[6]C[6]H)(COO){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	121.1510	0.000	1	120.6508	1.287	16	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cr)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cr<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cr)(C[6]C[6]H)(COO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.0455	2.296	2	120.6508	1.287	16	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cr)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cr<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cr)(C[6]C[6]H)(COO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.8592	0.819	13	120.6508	1.287	16	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<3>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CCH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.4710	0.000	1	119.5318	0.028	6	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CCH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.5440	0.184	5	119.5318	0.028	6	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CCN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4139	0.201	9	120.5663	0.109	44	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CCN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.4378	0.515	5	120.5663	0.109	44	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CCN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5026	0.309	17	120.5663	0.109	44	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CCN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.7938	0.275	10	120.5663	0.109	44	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CCN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.8400	0.084	3	120.5663	0.109	44	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CCO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CCO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4250	0.000	1	120.4250	0.000	1	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CC[5a]C)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CC[5a]C){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.4995	0.305	2	119.4995	0.093	2	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CC[5a]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<3>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CC[5a]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6090	0.000	1	119.9068	0.253	4	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CC[5a]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CC[5a]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.6727	0.227	3	119.9068	0.253	4	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CC[6]N)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CC[6]N){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.7120	0.226	2	120.7120	0.051	2	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CC[6]O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CC[6]O){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2495	0.217	2	120.2495	0.047	2	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CC[6a]N)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CC[6a]N){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2930	0.000	1	120.3800	0.015	2	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CC[6a]N)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CC[6a]N){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4670	0.000	1	120.3800	0.015	2	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CC[6a]O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CC[6a]O){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3420	0.000	1	120.3420	0.000	1	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CC[6a]P)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<3>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CC[6a]P){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3930	0.209	2	120.3930	0.044	2	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CHN){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.3470	0.000	1	120.5899	0.451	90	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5207	0.426	29	120.5899	0.451	90	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CHN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.7275	0.165	2	120.5899	0.451	90	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CHN){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.9065	0.176	6	120.5899	0.451	90	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5449	1.222	22	120.5899	0.451	90	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CHN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.6120	0.257	3	120.5899	0.451	90	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CHN){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.8720	0.000	1	120.5899	0.451	90	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CHN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.6559	0.180	26	120.5899	0.451	90	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CHP){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5345	0.021	2	120.5345	0.000	2	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CNN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CNN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	126.6685	2.648	2	126.6685	7.013	2	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<3>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CNO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6115	0.108	2	120.7689	0.174	56	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CNO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3275	0.442	6	120.7689	0.174	56	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CNO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.9382	0.205	23	120.7689	0.174	56	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CNO){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	122.5170	0.000	1	120.7689	0.174	56	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CNO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5572	0.267	18	120.7689	0.174	56	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CNO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	121.0427	0.162	4	120.7689	0.174	56	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CNO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.7855	0.541	2	120.7689	0.174	56	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<4>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(COO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3520	0.000	1	120.7737	0.252	83	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(COO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0490	0.000	1	120.7737	0.252	83	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(COO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.8048	0.213	6	120.7737	0.252	83	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(COO){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.7594	0.514	5	120.7737	0.252	83	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(COO){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.9055	0.127	2	120.7737	0.252	83	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(COO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.9110	0.093	3	120.7737	0.252	83	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(COO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.9699	0.382	31	120.7737	0.252	83	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<5>,2|C<3>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(COO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.7862	0.119	4	120.7737	0.252	83	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(COO){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.5123	0.106	3	120.7737	0.252	83	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(COO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5889	0.673	27	120.7737	0.252	83	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Er)(C[6]C[6]H)(CCO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Er<12>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Er)(C[6]C[6]H)(CCO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.4698	0.292	4	120.4698	0.085	4	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Eu)(C[6]C[6]H)(CCO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Eu<12>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Eu)(C[6]C[6]H)(CCO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.2447	0.210	4	120.2447	0.044	4	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Eu)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Eu<10>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Eu)(C[6]C[6]H)(CHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.7820	0.190	2	120.7820	0.036	2	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CCH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.5420	0.071	2	119.6243	0.031	4	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CCH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7065	0.245	2	119.6243	0.031	4	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CCN){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.8520	0.130	2	120.3176	0.906	219	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CCN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.7705	1.691	17	120.3176	0.906	219	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CCN){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.8200	0.000	1	120.3176	0.906	219	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CCN){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.5680	1.056	2	120.3176	0.906	219	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CCN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4442	0.183	4	120.3176	0.906	219	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CCN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3864	0.945	119	120.3176	0.906	219	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CCN){1|Br<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3270	0.000	1	120.3176	0.906	219	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CCN){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.5830	0.000	1	120.3176	0.906	219	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CCN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4823	0.404	13	120.3176	0.906	219	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CCN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.4386	0.435	31	120.3176	0.906	219	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CCN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2445	0.084	2	120.3176	0.906	219	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CCN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.0300	1.057	26	120.3176	0.906	219	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CCO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CCO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5720	0.000	1	120.5720	0.000	1	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CC[5]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CC[5]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.1770	0.000	1	119.1770	0.000	1	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CC[5]O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CC[5]O){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.5410	0.000	1	119.5410	0.000	1	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CC[6]O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CC[6]O){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5950	0.134	2	120.5380	0.019	3	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CC[6]O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CC[6]O){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.4240	0.000	1	120.5380	0.019	3	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CC[6a]N)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CC[6a]N){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5830	0.069	2	120.0842	1.025	12	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CC[6a]N)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CC[6a]N){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2644	0.268	8	120.0842	1.025	12	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CC[6a]N)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CC[6a]N){1|H<1>,2|C<3>}	H(C[6]C[6]2)	118.8650	2.652	2	120.0842	1.025	12	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CC[6a]P)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CC[6a]P){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.7985	0.131	2	119.7985	0.017	2	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHN){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.6540	0.000	1	120.3335	0.992	149	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7680	0.000	1	120.3335	0.992	149	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.4232	0.110	4	120.3335	0.992	149	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHN){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1008	0.159	4	120.3335	0.992	149	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.5786	1.061	9	120.3335	0.992	149	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3933	0.305	3	120.3335	0.992	149	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4105	0.503	2	120.3335	0.992	149	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHN){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.4749	1.007	57	120.3335	0.992	149	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3518	1.174	53	120.3335	0.992	149	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.1620	0.360	4	120.3335	0.992	149	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|O<2>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0077	0.302	6	120.3335	0.992	149	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,2|C<3>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5163	0.060	3	120.3335	0.992	149	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5055	0.071	2	120.3335	0.992	149	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CNN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CNN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.9335	0.656	4	120.9749	0.197	8	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CNN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CNN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	121.0162	0.161	4	120.9749	0.197	8	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CNO){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.9500	0.263	2	120.4732	0.340	103	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CNO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6295	0.245	2	120.4732	0.340	103	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CNO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.8657	0.182	3	120.4732	0.340	103	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CNO){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	121.0254	0.171	5	120.4732	0.340	103	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CNO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4154	0.585	82	120.4732	0.340	103	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CNO){1|Cl<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8400	0.000	1	120.4732	0.340	103	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CNO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.7575	1.394	2	120.4732	0.340	103	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CNO){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.9180	0.051	2	120.4732	0.340	103	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CNO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.6502	0.055	4	120.4732	0.340	103	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CNS)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CNS){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.4490	0.000	1	120.2820	0.062	11	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CNS)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CNS){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3407	0.239	4	120.2820	0.062	11	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CNS)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CNS){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.2150	0.274	6	120.2820	0.062	11	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CN[5]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CN[5]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9615	0.858	2	119.7143	0.551	3	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CN[5]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CN[5]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.2200	0.000	1	119.7143	0.551	3	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(COO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.7450	0.000	1	120.7205	1.048	85	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(COO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	118.7984	2.059	7	120.7205	1.048	85	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(COO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.8991	0.676	76	120.7205	1.048	85	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,2|C<3>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(COO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5770	0.000	1	120.7205	1.048	85	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(COS)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(COS){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.7910	0.000	1	120.7910	0.000	1	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ga)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ga<3>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ga)(C[6]C[6]H)(CCN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	121.1548	0.441	4	121.1548	0.195	4	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ga)(C[6]C[6]H)(CC[6a]N)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ga<3>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ga)(C[6]C[6]H)(CC[6a]N){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5583	0.582	3	120.5583	0.338	3	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ge)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ge<2>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ge)(C[6]C[6]H)(CHN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5655	0.067	2	120.5655	0.005	2	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Hg)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Hg<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Hg)(C[6]C[6]H)(CCN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.4983	0.564	16	120.4983	0.318	16	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Hg)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Hg<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Hg)(C[6]C[6]H)(CHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3460	0.000	1	120.3460	0.000	1	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CCH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1900	0.000	1	120.2773	0.197	3	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CCH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3210	0.618	2	120.2773	0.197	3	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CCN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.8012	0.959	6	120.7522	0.648	15	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CCN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.0070	0.098	2	120.7522	0.648	15	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CCN){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6617	0.228	3	120.7522	0.648	15	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CCN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	121.1192	0.943	4	120.7522	0.648	15	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CC[6a]N)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CC[6a]N){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5240	0.000	1	120.5240	0.000	1	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CC[6a]O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CC[6a]O){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1920	0.506	5	120.1920	0.256	5	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CClC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CClC){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2840	0.000	1	120.2840	0.000	1	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6544	0.631	10	120.7303	0.363	18	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.8251	0.593	8	120.7303	0.363	18	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CHO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CHO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.6330	0.000	1	119.6330	0.000	1	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CHP){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.4933	0.171	4	119.6329	0.092	10	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CHP){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.7702	0.371	5	119.6329	0.092	10	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CHP){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.5050	0.000	1	119.6329	0.092	10	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CHS)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CHS){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.0595	0.057	2	120.0595	0.003	2	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CIrC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CIrC){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5320	0.000	1	120.5320	0.000	1	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CNO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2333	0.424	3	120.3797	0.070	9	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CNO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4528	0.145	6	120.3797	0.070	9	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(COO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5199	0.402	22	120.4531	0.168	27	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(COO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.9040	0.103	2	120.4531	0.168	27	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(COO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5550	0.000	1	120.4531	0.168	27	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(COO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.2160	0.393	2	120.4531	0.168	27	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CP[5]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CP[5]H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.6300	0.000	1	119.6300	0.000	1	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Li)(C[6]C[6]H)(CHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Li<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Li)(C[6]C[6]H)(CHP){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.5660	0.160	2	119.5660	0.026	2	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mg)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mg<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mg)(C[6]C[6]H)(CCN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.8533	0.364	4	120.8533	0.133	4	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mg)(C[6]C[6]H)(CC[6a]N)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mg<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mg)(C[6]C[6]H)(CC[6a]N){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3710	0.260	6	120.4350	0.074	12	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mg)(C[6]C[6]H)(CC[6a]N)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mg<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mg)(C[6]C[6]H)(CC[6a]N){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.4990	0.293	6	120.4350	0.074	12	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mg)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mg<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mg)(C[6]C[6]H)(CHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9910	0.021	2	119.9910	0.000	2	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mg)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mg<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mg)(C[6]C[6]H)(COO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	121.0615	0.069	2	121.0615	0.005	2	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CCN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3722	0.175	4	120.5875	0.093	72	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CCN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5173	0.258	8	120.5875	0.093	72	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CCN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4295	0.125	12	120.5875	0.093	72	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CCN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3632	0.254	10	120.5875	0.093	72	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CCN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6010	0.000	1	120.5875	0.093	72	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CCN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.7375	0.310	37	120.5875	0.093	72	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CCO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CCO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1980	0.000	1	120.0915	0.023	2	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CCO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CCO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9850	0.000	1	120.0915	0.023	2	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CC[6]O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CC[6]O){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.6310	0.124	2	120.6310	0.015	2	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CC[6a]N)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CC[6a]N){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3545	0.074	2	120.3545	0.006	2	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CC[6a]O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CC[6a]O){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.3540	0.000	1	119.3540	0.000	1	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8780	0.170	4	120.5887	0.127	55	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CHN){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.1760	0.000	1	120.5887	0.127	55	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5990	0.000	1	120.5887	0.127	55	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CHN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.8507	0.221	3	120.5887	0.127	55	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CHN){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.8360	0.004	2	120.5887	0.127	55	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CHN){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	121.0540	0.000	1	120.5887	0.127	55	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5473	0.315	26	120.5887	0.127	55	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CHN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.7237	0.172	3	120.5887	0.127	55	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3467	0.250	3	120.5887	0.127	55	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CHN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.9006	0.146	8	120.5887	0.127	55	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<7>,2|C<3>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.7237	0.070	3	120.5887	0.127	55	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CHP){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.2825	0.155	2	119.3692	0.018	4	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CHP){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.4560	0.016	2	119.3692	0.018	4	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CNN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CNN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.7633	0.595	26	120.7848	0.299	31	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CNN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CNN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.8966	0.122	5	120.7848	0.299	31	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CNO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9336	1.781	22	120.2721	1.968	40	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CNO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.7926	0.295	16	120.2721	1.968	40	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CNO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.8315	1.262	2	120.2721	1.968	40	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(COO){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.9510	0.038	2	120.6692	0.463	36	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(COO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0370	0.952	6	120.6692	0.463	36	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(COO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.8664	0.626	21	120.6692	0.463	36	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<6>,2|C<3>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(COO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4942	0.307	4	120.6692	0.463	36	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(COO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5993	0.108	3	120.6692	0.463	36	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mo)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mo<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mo)(C[6]C[6]H)(CCN){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.9490	0.000	1	119.9413	0.125	31	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mo)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mo<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mo)(C[6]C[6]H)(CCN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.8492	0.248	6	119.9413	0.125	31	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mo)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mo<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mo)(C[6]C[6]H)(CCN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0980	0.000	1	119.9413	0.125	31	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mo)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mo<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mo)(C[6]C[6]H)(CCN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.8657	0.256	11	119.9413	0.125	31	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mo)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mo<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mo)(C[6]C[6]H)(CCN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.1024	0.508	10	119.9413	0.125	31	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mo)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mo<9>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mo)(C[6]C[6]H)(CCN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.7460	0.082	2	119.9413	0.125	31	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mo)(C[6]C[6]H)(CC[6a]N)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mo<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mo)(C[6]C[6]H)(CC[6a]N){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.5680	0.000	1	119.5680	0.000	1	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mo)(C[6]C[6]H)(CHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mo<8>,1|C<4>,1|H<1>}	C[6](N[6]C[6]Mo)(C[6]C[6]H)(CHH){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	113.5825	5.288	2	113.5825	27.968	2	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mo)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mo<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mo)(C[6]C[6]H)(CHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.2990	2.857	3	120.0382	2.367	9	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mo)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mo<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mo)(C[6]C[6]H)(CHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4078	0.172	6	120.0382	2.367	9	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mo)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mo<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mo)(C[6]C[6]H)(COO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	122.2665	1.534	2	121.7157	2.086	3	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mo)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mo<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mo)(C[6]C[6]H)(COO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6140	0.000	1	121.7157	2.086	3	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Nd)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Nd<16>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Nd)(C[6]C[6]H)(CHN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5570	0.052	2	120.5570	0.003	2	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CCH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.4700	0.085	2	119.4700	0.007	2	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CCN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.7080	0.000	1	120.6657	0.076	70	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CCN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.7232	0.411	11	120.6657	0.076	70	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CCN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3793	0.212	6	120.6657	0.076	70	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CCN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.7616	0.241	9	120.6657	0.076	70	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CCN){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.7000	0.000	1	120.6657	0.076	70	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CCN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5716	0.165	20	120.6657	0.076	70	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CCN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.7578	0.258	22	120.6657	0.076	70	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CCO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CCO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6070	0.000	1	120.4553	0.040	3	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CCO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CCO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3795	0.213	2	120.4553	0.040	3	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CC[5a]C)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CC[5a]C){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7830	0.109	2	119.7830	0.012	2	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CC[6]N)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CC[6]N){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5620	0.000	1	120.4087	0.018	3	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CC[6]N)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CC[6]N){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3320	0.004	2	120.4087	0.018	3	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CC[6]O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CC[6]O){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5670	0.000	1	120.5670	0.000	1	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CC[6a]N)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CC[6a]N){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3350	0.000	1	120.4566	0.075	30	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CC[6a]N)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CC[6a]N){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.8030	0.221	2	120.4566	0.075	30	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CC[6a]N)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CC[6a]N){1|Br<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2810	0.508	2	120.4566	0.075	30	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CC[6a]N)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CC[6a]N){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4478	0.254	25	120.4566	0.075	30	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CC[6a]O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CC[6a]O){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3717	0.499	4	120.3717	0.249	4	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CC[6a]P)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CC[6a]P){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8527	0.261	3	119.8527	0.068	3	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1017	1.076	11	120.5967	0.409	154	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.0477	0.252	6	120.5967	0.409	154	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHN){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	121.0900	0.000	1	120.5967	0.409	154	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHN){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.9372	0.193	5	120.5967	0.409	154	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.7335	0.183	2	120.5967	0.409	154	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.7759	0.348	7	120.5967	0.409	154	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHN){1|Br<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3293	0.100	6	120.5967	0.409	154	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHN){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.3255	0.475	11	120.5967	0.409	154	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHN){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	117.5850	0.000	1	120.5967	0.409	154	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHN){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.1540	0.433	3	120.5967	0.409	154	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.7098	0.562	86	120.5967	0.409	154	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.6685	0.429	13	120.5967	0.409	154	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,2|C<3>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.7405	0.073	2	120.5967	0.409	154	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHP){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.4745	0.221	2	119.7703	0.133	4	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHP){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.0660	0.023	2	119.7703	0.133	4	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CNN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CNN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1360	1.223	10	120.5014	1.617	18	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CNN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CNN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.9581	1.255	8	120.5014	1.617	18	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CNO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.9546	1.648	12	120.6645	0.478	88	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CNO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.7444	0.223	28	120.6645	0.478	88	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CNO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.7167	0.133	3	120.6645	0.478	88	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CNO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3882	0.531	25	120.6645	0.478	88	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CNO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.7163	0.147	20	120.6645	0.478	88	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CNS)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CNS){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1290	0.000	1	120.1290	0.000	1	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(COO){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.5865	0.032	2	120.7412	0.177	112	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(COO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.9530	0.156	2	120.7412	0.177	112	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(COO){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.1323	0.289	3	120.7412	0.177	112	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(COO){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.4008	0.257	4	120.7412	0.177	112	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(COO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6310	0.000	1	120.7412	0.177	112	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(COO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.7869	0.408	90	120.7412	0.177	112	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,2|C<3>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(COO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3484	0.421	10	120.7412	0.177	112	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(COS)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(COS){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3216	0.232	5	120.3216	0.054	5	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Os)(C[6]C[6]H)(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Os<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Os)(C[6]C[6]H)(CCH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.4835	0.131	2	119.9290	0.394	7	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Os)(C[6]C[6]H)(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Os<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Os)(C[6]C[6]H)(CCH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.6770	0.000	1	119.9290	0.394	7	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Os)(C[6]C[6]H)(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Os<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Os)(C[6]C[6]H)(CCH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8827	0.346	3	119.9290	0.394	7	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Os)(C[6]C[6]H)(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Os<9>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Os)(C[6]C[6]H)(CCH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	121.2110	0.000	1	119.9290	0.394	7	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Os)(C[6]C[6]H)(CC[6a]N)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Os<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Os)(C[6]C[6]H)(CC[6a]N){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.9380	0.192	2	120.9380	0.037	2	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Os)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Os<9>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Os)(C[6]C[6]H)(CHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4715	0.112	2	120.4715	0.013	2	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Os)(C[6]C[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Os<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Os)(C[6]C[6]H)(CNO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3720	0.000	1	120.3720	0.000	1	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Os)(C[6]C[6]H)(CNS)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Os<9>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Os)(C[6]C[6]H)(CNS){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0410	0.000	1	120.0410	0.000	1	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Os)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Os<9>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Os)(C[6]C[6]H)(COO){1|Br<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6880	0.000	1	120.6470	0.096	3	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Os)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Os<9>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Os)(C[6]C[6]H)(COO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6265	0.435	2	120.6470	0.096	3	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pb)(C[6]C[6]H)(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pb<3>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pb)(C[6]C[6]H)(CCH){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5045	0.052	2	120.5045	0.003	2	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pb)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pb<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pb)(C[6]C[6]H)(CHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1540	0.000	1	120.1540	0.000	1	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CCH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.3279	0.477	7	119.3279	0.228	7	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CCN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.5681	1.621	10	120.1780	1.492	23	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CCN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.6472	0.464	13	120.1780	1.492	23	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CCO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CCO){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.7762	0.328	5	120.7129	0.060	12	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CCO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CCO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.8200	0.081	2	120.7129	0.060	12	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CCO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CCO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.6180	0.201	4	120.7129	0.060	12	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CCO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CCO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5620	0.000	1	120.7129	0.060	12	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CC[5a]2)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CC[5a]2){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7970	0.000	1	119.7970	0.000	1	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CC[5a]O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CC[5a]O){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.5970	0.000	1	119.5970	0.000	1	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CC[6]C)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CC[6]C){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3670	0.035	2	120.3670	0.001	2	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CC[6a]N)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CC[6a]N){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5045	1.409	12	120.5045	1.984	12	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CC[6a]O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CC[6a]O){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3730	0.014	2	120.3730	0.000	2	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CHN){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.3885	0.425	2	120.5443	0.052	16	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5720	0.221	12	120.5443	0.052	16	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CHN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.4600	0.000	1	120.5443	0.052	16	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6070	0.000	1	120.5443	0.052	16	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CHP){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	118.5166	2.157	5	118.5166	4.652	5	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CNO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1593	0.695	19	120.4945	0.889	57	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CNO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.6621	1.012	38	120.4945	0.889	57	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CNS)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CNS){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4040	0.757	3	120.3807	0.254	11	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CNS)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CNS){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3720	0.446	8	120.3807	0.254	11	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CN[5]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CN[5]H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.5800	0.000	2	120.5800	0.000	2	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(COO){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.0820	0.000	1	120.4720	0.138	6	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(COO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1975	0.088	2	120.4720	0.138	6	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(COO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.9025	0.037	2	120.4720	0.138	6	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(COO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5500	0.000	1	120.4720	0.138	6	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CCH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.3651	0.744	8	119.4576	0.561	9	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pt<6>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CCH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1970	0.000	1	119.4576	0.561	9	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CCN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5917	0.278	3	120.5917	0.077	3	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CCO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pt<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CCO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5050	0.000	1	120.5050	0.000	1	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CC[5a]O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CC[5a]O){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.7520	0.000	1	120.7520	0.000	1	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CC[6]O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CC[6]O){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3910	0.788	14	120.8394	3.583	16	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CC[6]O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pt<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CC[6]O){1|C<3>,2|H<1>}	H(C[6]C[6]2)	123.9785	4.812	2	120.8394	3.583	16	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2696	0.183	7	120.3889	0.075	14	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pt<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9170	0.000	1	120.3889	0.075	14	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pt<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6068	0.182	6	120.3889	0.075	14	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CHP){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.5830	0.458	2	119.5830	0.210	2	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CNN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CNN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3985	0.103	2	120.3985	0.011	2	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CNO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9937	0.429	6	119.9937	0.184	6	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CNP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CNP){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1710	0.000	1	120.1710	0.000	1	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CNS)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CNS){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.2470	1.237	22	120.2470	1.530	22	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(COO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3241	0.463	15	120.4571	0.272	25	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(COO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.8265	0.597	6	120.4571	0.272	25	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pt<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(COO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4020	0.468	4	120.4571	0.272	25	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CTeC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CTeC){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2530	0.042	2	120.2530	0.002	2	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Re<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(CCH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9810	0.000	1	119.9810	0.000	1	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(CCN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4751	0.180	7	120.2995	0.188	17	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(CCN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.1765	0.522	10	120.2995	0.188	17	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(CC[6]N)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(CC[6]N){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3220	0.682	2	120.3220	0.465	2	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(CC[6a]N)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(CC[6a]N){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.5230	0.000	1	119.5230	0.000	1	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Re<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(CHN){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.1800	0.000	1	120.2101	0.707	26	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(CHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2113	0.858	25	120.2101	0.707	26	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(CHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Re<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(CHP){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.4020	0.000	1	119.4020	0.000	1	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(CNO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6370	0.000	1	120.6370	0.000	1	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(COO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4430	0.161	7	120.4528	0.023	8	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Re<6>,2|C<3>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(COO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5210	0.000	1	120.4528	0.023	8	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Rh<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(CCH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6100	0.000	1	120.6100	0.000	1	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Rh<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(CCN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1430	0.000	1	120.1430	0.000	1	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(CC[6a]O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Rh<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(CC[6a]O){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0485	0.845	2	119.9322	0.196	5	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(CC[6a]O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Rh<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(CC[6a]O){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9190	0.000	2	119.9322	0.196	5	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(CC[6a]O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Rh<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(CC[6a]O){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7260	0.000	1	119.9322	0.196	5	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Rh<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(CHN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.4010	0.212	2	120.4323	0.065	4	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Rh<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(CHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4635	0.381	2	120.4323	0.065	4	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(CHO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Rh<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(CHO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8045	0.489	2	119.8045	0.239	2	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(CHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Rh<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(CHP){1|H<1>,2|C<3>}	H(C[6]C[6]2)	121.5045	0.080	2	121.5045	0.006	2	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(CHS)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Rh<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(CHS){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.1660	0.058	2	120.1660	0.003	2	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Rh<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(CNO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4108	0.168	5	120.4169	0.060	7	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Rh<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(CNO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4320	0.494	2	120.4169	0.060	7	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Rh<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(COO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4660	0.000	1	120.4660	0.000	1	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(COP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Rh<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(COP){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.0455	0.081	2	120.0455	0.007	2	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(CRhC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Rh<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(CRhC){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7214	0.634	8	119.7214	0.402	8	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CB[5a]P)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CB[5a]P){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.6480	0.000	1	119.6480	0.000	1	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CCH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8782	0.589	5	119.7870	0.188	9	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<6>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CCH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7430	0.000	1	119.7870	0.188	9	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CCH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.5510	0.000	1	119.7870	0.188	9	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CCH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.6990	0.049	2	119.7870	0.188	9	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CCN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.9254	0.203	8	120.2343	0.109	19	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CCN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.4389	0.188	10	120.2343	0.109	19	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<9>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CCN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6600	0.000	1	120.2343	0.109	19	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CCO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<9>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CCO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5230	0.297	2	120.5230	0.088	2	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CCP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CCP){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.4780	0.000	1	119.7967	0.112	3	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CCP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CCP){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9560	0.267	2	119.7967	0.112	3	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CC[5]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CC[5]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	118.7950	0.000	1	118.7950	0.000	1	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CC[6a]N)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CC[6a]N){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3080	0.000	1	120.3080	0.000	1	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CC[6a]O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<9>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CC[6a]O){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1620	0.000	1	120.1620	0.000	1	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3233	1.199	4	120.4521	0.527	10	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<9>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5380	0.253	6	120.4521	0.527	10	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CHP){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.8600	0.000	1	119.5270	0.068	6	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CHP){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.3550	0.000	1	119.5270	0.068	6	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CHP){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.3160	0.000	1	119.5270	0.068	6	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CHP){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.6730	0.232	2	119.5270	0.068	6	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CHP){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.2850	0.000	1	119.5270	0.068	6	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CNO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.9633	0.331	3	120.4964	0.129	18	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CNO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.7075	0.211	2	120.4964	0.129	18	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<9>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CNO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3562	0.277	13	120.4964	0.129	18	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CNS)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CNS){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0790	0.312	3	120.1130	0.980	18	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CNS)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CNS){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.1256	1.125	14	120.1130	0.980	18	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CNS)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<9>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CNS){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0390	0.000	1	120.1130	0.980	18	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(COO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.9845	0.043	2	120.5367	0.112	11	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(COO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2855	0.350	2	120.5367	0.112	11	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(COO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.4428	0.312	5	120.5367	0.112	11	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<9>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(COO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5750	0.171	2	120.5367	0.112	11	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Sb)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Sb<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Sb)(C[6]C[6]H)(CCN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4980	0.000	1	120.4980	0.000	1	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Sb)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Sb<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Sb)(C[6]C[6]H)(COO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.7295	0.062	2	120.7295	0.004	2	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Se)(C[6]C[6]H)(CC[6a]N)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Se<1>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Se)(C[6]C[6]H)(CC[6a]N){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.0205	0.397	2	120.0205	0.157	2	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Sm)(C[6]C[6]H)(CCO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Sm<12>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Sm)(C[6]C[6]H)(CCO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	118.7873	7.812	4	118.7873	61.029	4	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Sm)(C[6]C[6]H)(CC[6a]N)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Sm<9>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Sm)(C[6]C[6]H)(CC[6a]N){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3473	0.248	3	120.3473	0.062	3	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Sm)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Sm<10>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Sm)(C[6]C[6]H)(CHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	121.5715	0.571	2	121.5715	0.326	2	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Sn)(C[6]C[6]H)(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Sn<3>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Sn)(C[6]C[6]H)(CCH){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.8540	0.291	2	119.8540	0.085	2	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Sn)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Sn<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Sn)(C[6]C[6]H)(CCN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3800	0.174	4	120.3096	0.631	27	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Sn)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Sn<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Sn)(C[6]C[6]H)(CCN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.4428	0.226	4	120.3096	0.631	27	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Sn)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Sn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Sn)(C[6]C[6]H)(CCN){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	117.7020	0.590	2	120.3096	0.631	27	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Sn)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Sn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Sn)(C[6]C[6]H)(CCN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4234	0.223	8	120.3096	0.631	27	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Sn)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Sn<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Sn)(C[6]C[6]H)(CCN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.6973	0.201	9	120.3096	0.631	27	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Sn)(C[6]C[6]H)(CC[6a]N)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Sn<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Sn)(C[6]C[6]H)(CC[6a]N){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3105	0.107	2	120.3105	0.011	2	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Sn)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Sn<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Sn)(C[6]C[6]H)(CHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9410	0.366	2	120.4214	0.166	11	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Sn)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Sn<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Sn)(C[6]C[6]H)(CHN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.1895	0.206	2	120.4214	0.166	11	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Sn)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Sn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Sn)(C[6]C[6]H)(CHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6249	0.322	7	120.4214	0.166	11	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Sn)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Sn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Sn)(C[6]C[6]H)(COO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.8282	0.141	4	120.8843	0.022	7	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Sn)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Sn<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Sn)(C[6]C[6]H)(COO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.9590	0.145	3	120.8843	0.022	7	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Sr)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Sr<9>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Sr)(C[6]C[6]H)(COO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.6810	0.262	4	120.6810	0.069	4	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Yb)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Yb<12>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Yb)(C[6]C[6]H)(CHN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.4370	0.000	1	120.4370	0.000	1	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CCC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CCC){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.6116	0.277	5	119.6116	0.077	5	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CCH){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.6670	0.153	2	119.6065	0.012	11	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CCH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.6090	0.097	8	119.6065	0.012	11	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CCH){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.4650	0.000	1	119.6065	0.012	11	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<3>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CCN){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.3620	0.000	1	120.6236	0.238	55	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CCN){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	121.0240	0.000	1	120.6236	0.238	55	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CCN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5520	0.341	7	120.6236	0.238	55	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CCN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.9836	0.492	5	120.6236	0.238	55	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CCN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5697	0.279	13	120.6236	0.238	55	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CCN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.7239	0.590	20	120.6236	0.238	55	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CCN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	121.0245	0.117	6	120.6236	0.238	55	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CCN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5490	0.184	2	120.6236	0.238	55	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CCP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CCP){1|C<3>,2|H<1>}	H(C[6]C[6]2)	118.7365	1.312	2	118.7365	1.721	2	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CC[3]N)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CC[3]N){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3120	0.000	1	120.3120	0.000	1	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CC[6]P)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CC[6]P){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4460	0.191	2	120.4460	0.036	2	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CC[6a]N)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CC[6a]N){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3907	0.059	3	120.2862	0.355	11	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CC[6a]N)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CC[6a]N){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2470	0.707	8	120.2862	0.355	11	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CHN){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	121.0440	0.000	1	120.6135	0.520	169	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CHN){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	121.3815	1.182	11	120.6135	0.520	169	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3613	0.835	25	120.6135	0.520	169	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CHN){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	121.1090	0.000	1	120.6135	0.520	169	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.8064	0.586	13	120.6135	0.520	169	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CHN){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.5501	0.220	22	120.6135	0.520	169	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5457	0.193	56	120.6135	0.520	169	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CHN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5857	1.228	26	120.6135	0.520	169	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<6>,1|C<3>,1|O<2>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2160	0.164	3	120.6135	0.520	169	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<6>,1|C<3>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CHN){1|C<2>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1530	0.000	1	120.6135	0.520	169	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<6>,2|C<3>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.8122	0.385	10	120.6135	0.520	169	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<3>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CHP){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.6110	0.027	2	119.7093	0.074	6	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CHP){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.7520	0.000	1	119.7093	0.074	6	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CHP){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2220	0.000	1	119.7093	0.074	6	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CHP){1|C<3>,1|H<1>,1|P<4>}	H(C[6]C[6]2)	119.4270	0.000	1	119.7093	0.074	6	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CHP){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.6330	0.000	1	119.7093	0.074	6	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CNN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CNN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	121.0555	0.196	2	121.0935	0.015	4	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CNN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CNN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	121.1315	0.008	2	121.0935	0.015	4	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CNO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.7740	0.000	1	120.5493	0.049	8	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CNO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4397	0.322	3	120.5493	0.049	8	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CNO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5752	0.125	4	120.5493	0.049	8	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<5>,1|C<2>,1|C<3>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(COO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5235	0.110	2	120.4578	0.373	21	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<5>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(COO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6090	0.044	2	120.4578	0.373	21	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<5>,1|C<3>,1|F<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(COO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4530	0.000	1	120.4578	0.373	21	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(COO){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.9108	0.106	4	120.4578	0.373	21	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<5>,2|C<3>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(COO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4965	0.367	2	120.4578	0.373	21	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<6>,1|C<2>,1|C<3>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(COO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3806	0.222	5	120.4578	0.373	21	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<6>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(COO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	118.8260	0.000	1	120.4578	0.373	21	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(COO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6535	1.643	2	120.4578	0.373	21	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<6>,2|C<3>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(COO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1115	0.708	2	120.4578	0.373	21	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zr)(C[6]C[6]H)(CC[6a]C)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zr<13>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zr)(C[6]C[6]H)(CC[6a]C){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9510	0.000	1	119.9510	0.000	1	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]N[6]Ca)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ca<8>,1|H<1>,1|N<2>}	C[6](N[6]N[6]Ca)(C[6]C[6]H)(COO){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.2235	0.954	2	119.2235	0.910	2	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]N[6]Co)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<6>,1|C<3>,1|N<3>}	C[6](N[6]N[6]Co)(C[6]C[6]H)(CCN){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.1000	0.006	2	121.1000	0.000	2	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]N[6]Co)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<6>,1|C<3>,1|N<3>}	C[6](N[6]N[6]Co)(C[6]C[6]H)(CHN){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.1685	0.109	4	121.1685	0.012	4	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]N[6]Co)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<6>,1|C<3>,1|N<3>}	C[6](N[6]N[6]Co)(C[6]C[6]H)(COO){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.9395	0.252	2	121.0740	0.086	3	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]N[6]Co)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<6>,1|H<1>,1|N<2>}	C[6](N[6]N[6]Co)(C[6]C[6]H)(COO){1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.3430	0.000	1	121.0740	0.086	3	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]N[6]Cu)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<4>,1|C<3>,1|N<3>}	C[6](N[6]N[6]Cu)(C[6]C[6]H)(CHN){1|Cu<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.0930	0.143	4	121.0930	0.020	4	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]N[6]Cu)(C[6]C[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<5>,1|C<3>,1|N<3>}	C[6](N[6]N[6]Cu)(C[6]C[6]H)(CNO){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.3045	0.155	2	121.3045	0.024	2	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]N[6]Cu)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<5>,1|C<3>,1|N<3>}	C[6](N[6]N[6]Cu)(C[6]C[6]H)(COO){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.2455	0.209	2	121.2455	0.044	2	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]N[6]Li)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Li<4>,1|H<1>,1|N<2>}	C[6](N[6]N[6]Li)(C[6]C[6]H)(COO){1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.8390	0.000	1	119.3952	1.741	5	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]N[6]Li)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Li<5>,1|C<3>,1|N<3>}	C[6](N[6]N[6]Li)(C[6]C[6]H)(COO){1|Li<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.0343	1.205	4	119.3952	1.741	5	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]N[6]Mg)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mg<6>,1|H<1>,1|N<2>}	C[6](N[6]N[6]Mg)(C[6]C[6]H)(COO){1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0120	0.000	1	120.0120	0.000	1	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]N[6]Mn)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<6>,1|C<3>,1|N<3>}	C[6](N[6]N[6]Mn)(C[6]C[6]H)(COO){1|Mn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.8574	0.398	7	120.8574	0.158	7	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]N[6]Ni)(C[6]C[6]H)(CNN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|N<2>}	C[6](N[6]N[6]Ni)(C[6]C[6]H)(CNN){1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.2500	0.220	3	121.2500	0.049	3	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]N[6]Ni)(C[6]C[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|N<2>}	C[6](N[6]N[6]Ni)(C[6]C[6]H)(CNO){1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.5495	0.182	2	121.5495	0.033	2	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]N[6]Ni)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,1|N<2>,1|O<2>}	C[6](N[6]N[6]Ni)(C[6]C[6]H)(COO){1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7280	0.000	1	120.7280	0.000	1	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]N[6]Pd)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|N<3>}	C[6](N[6]N[6]Pd)(C[6]C[6]H)(CHN){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.0890	0.069	2	121.0890	0.005	2	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]N[6]Zn)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<6>,1|C<3>,1|N<3>}	C[6](N[6]N[6]Zn)(C[6]C[6]H)(COO){1|Zn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.2295	0.105	2	121.2295	0.011	2	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]C)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CCN){1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.8920	0.049	2	120.0402	0.079	5	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]C)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CCN){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.1390	0.348	3	120.0402	0.079	5	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]C)(H){1|Fe<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CCN){1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.9255	0.308	4	119.9255	0.095	4	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]C)(H){1|Ir<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(COO){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9657	0.094	3	119.9657	0.009	3	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]N[5])(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]N[6]C)(H){1|Co<4>,1|C<3>,1|H<1>,2|C<4>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CCN){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.3572	0.244	4	120.3572	0.059	4	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cd)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]C)(H){1|Cd<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cd)(C[6]C[6]H)(COO){1|O<2>,2|C<3>}	H(C[6]C[6]2)	120.8130	0.113	4	120.8130	0.013	4	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]C)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(COO){1|O<2>,2|C<3>}	H(C[6]C[6]2)	120.7775	0.179	2	120.7775	0.032	2	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cr)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]C)(H){1|Cr<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cr)(C[6]C[6]H)(COO){1|O<2>,2|C<3>}	H(C[6]C[6]2)	121.0431	0.150	8	121.0431	0.022	8	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]C)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(COO){1|O<2>,2|C<3>}	H(C[6]C[6]2)	120.9725	0.193	2	120.7945	0.081	6	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]C)(H){1|Cu<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(COO){1|O<2>,2|C<3>}	H(C[6]C[6]2)	120.7055	0.301	4	120.7945	0.081	6	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(COO){1|O<2>,2|C<3>}	H(C[6]C[6]2)	120.9236	0.207	5	120.9236	0.043	5	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]C)(H){1|Ni<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CNO){1|O<2>,2|C<3>}	H(C[6]C[6]2)	121.0780	0.000	1	121.0780	0.000	1	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(COO){1|O<2>,2|C<3>}	H(C[6]C[6]2)	120.9480	0.494	2	120.9480	0.244	2	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CNO){1|O<2>,2|C<3>}	H(C[6]C[6]2)	120.2495	0.282	2	120.2495	0.080	2	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]C)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CNO){1|O<2>,2|C<3>}	H(C[6]C[6]2)	121.3920	1.898	2	121.3920	3.602	2	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]C)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(COO){1|O<2>,2|C<3>}	H(C[6]C[6]2)	120.8650	0.325	4	120.8650	0.106	4	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]S)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]S)(C[6]N[6]C)(H){1|Zn<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CNO){1|S<2>,2|C<3>}	H(C[6]C[6]2)	120.7809	0.284	8	120.7809	0.081	8	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]C)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]C)(H){1|Mn<6>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(COO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.2650	0.000	1	120.2650	0.000	1	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]C)(H){1|Ni<6>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(COO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.2070	0.000	1	120.2070	0.000	1	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]C)(H){1|Zn<5>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CCN){3|C<3>}	H(C[6]C[6]2)	120.3872	0.292	4	120.3872	0.085	4	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]C)(H){1|Zn<6>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(COO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3800	0.081	2	120.3800	0.006	2	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]N[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]N[6]C)(C[6]N[6]H)(H){1|Co<6>,1|C<3>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(COO){1|N<2>,2|H<1>}	H(C[6]C[6]2)	121.4660	0.000	1	121.4660	0.000	1	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]N[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]N[6]C)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CNO){1|N<2>,2|H<1>}	H(C[6]C[6]2)	121.4105	0.196	2	121.4105	0.038	2	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]N[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Li)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]N[6]C)(C[6]N[6]H)(H){1|Li<5>,1|C<3>}	C[6](N[6]C[6]Li)(C[6]C[6]H)(COO){1|N<2>,2|H<1>}	H(C[6]C[6]2)	121.5490	0.137	2	121.5490	0.019	2	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Fe<5>,1|C<3>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CCN){1|C<3>,1|C<4>,1|N<2>}	H(C[6]C[6]2)	120.5290	0.000	1	120.5290	0.000	1	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6]Mg)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Mg<6>,1|C<3>}	C[6](N[6]C[6]Mg)(C[6]C[6]H)(COO){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	121.3400	0.000	1	121.3400	0.000	1	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(CHH)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){2|C<3>}	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(CHH){1|C<4>,1|N<2>,1|O<1>,2|C<3>}	H(C[6]C[6]2)	120.3380	0.000	1	120.3380	0.000	1	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CHH)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Ge<2>,2|C<3>}	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CHH){1|C<4>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	115.2890	0.000	1	115.1628	0.139	4	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CHH)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Ge<4>,2|C<3>}	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CHH){1|C<4>,1|N<2>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	114.6080	0.000	1	115.1628	0.139	4	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CHH)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Ge<4>,2|C<3>}	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CHH){1|C<4>,1|N<3>,1|O<1>,3|C<3>}	H(C[6]C[6]2)	115.3770	0.042	2	115.1628	0.139	4	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CHH)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Si<2>,2|C<3>}	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CHH){1|C<4>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	116.2770	0.000	1	115.7186	0.125	27	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CHH)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Si<4>,2|C<3>}	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CHH){1|Br<1>,1|C<4>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	116.0255	0.032	2	115.7186	0.125	27	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CHH)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Si<4>,2|C<3>}	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CHH){1|Br<1>,1|N<3>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	114.8570	0.000	1	115.7186	0.125	27	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CHH)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Si<4>,2|C<3>}	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CHH){1|C<4>,1|F<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	115.6820	0.000	1	115.7186	0.125	27	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CHH)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Si<4>,2|C<3>}	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CHH){1|C<4>,1|H<1>,1|N<3>,1|O<2>,2|C<3>}	H(C[6]C[6]2)	116.0167	0.141	3	115.7186	0.125	27	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CHH)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Si<4>,2|C<3>}	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CHH){1|C<4>,1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	116.0907	0.003	3	115.7186	0.125	27	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CHH)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Si<4>,2|C<3>}	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CHH){1|C<4>,1|H<1>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	115.6905	0.296	2	115.7186	0.125	27	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CHH)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Si<4>,2|C<3>}	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CHH){1|C<4>,1|N<3>,2|C<3>,2|P<3>}	H(C[6]C[6]2)	115.4490	0.000	1	115.7186	0.125	27	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CHH)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Si<4>,2|C<3>}	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CHH){1|C<4>,1|O<1>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	115.4580	0.000	1	115.7186	0.125	27	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CHH)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Si<4>,2|C<3>}	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CHH){1|C<4>,1|O<2>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	115.4490	0.000	1	115.7186	0.125	27	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CHH)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Si<4>,2|C<3>}	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CHH){1|C<4>,1|P<3>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	115.4140	0.000	1	115.7186	0.125	27	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CHH)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Si<4>,2|C<3>}	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CHH){1|C<4>,2|C<3>,3|N<3>}	H(C[6]C[6]2)	116.0900	0.000	1	115.7186	0.125	27	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CHH)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Si<4>,2|C<3>}	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CHH){1|C<4>,2|N<3>,3|C<3>}	H(C[6]C[6]2)	115.9215	0.013	2	115.7186	0.125	27	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CHH)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Si<4>,2|C<3>}	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CHH){1|Cl<1>,1|C<4>,1|N<3>,1|P<3>,2|C<3>}	H(C[6]C[6]2)	115.4170	0.000	1	115.7186	0.125	27	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CHH)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Si<4>,2|C<3>}	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CHH){1|Cl<1>,1|N<3>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	115.2480	0.000	1	115.7186	0.125	27	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CHH)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Si<4>,2|C<3>}	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CHH){1|Cl<1>,1|Si<4>,1|C<4>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	115.4840	0.000	1	115.7186	0.125	27	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CHH)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Si<4>,2|C<3>}	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CHH){1|Si<4>,1|C<4>,1|N<3>,1|O<2>,2|C<3>}	H(C[6]C[6]2)	115.5100	0.000	1	115.7186	0.125	27	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CHH)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Si<4>,2|C<3>}	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CHH){2|Br<1>,1|C<4>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	115.6140	0.028	2	115.7186	0.125	27	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CHH)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Si<4>,2|C<3>}	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CHH){2|Cl<1>,1|C<4>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	115.2420	0.000	1	115.7186	0.125	27	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]Si[3,6]C[6a])(C[6]C[6]H)(CHH)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Si<5>,2|C<3>}	C[6](N[6]Si[3,6]C[6a])(C[6]C[6]H)(CHH){1|C<4>,1|N<3>,2|O<2>,3|C<3>}	H(C[6]C[6]2)	115.8370	0.000	1	115.8370	0.000	1	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]Si[5,6]C[6a])(C[6]C[6]H)(CHH)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Si<4>,2|C<3>}	C[6](N[6]Si[5,6]C[6a])(C[6]C[6]H)(CHH){1|C<4>,1|O<2>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	115.6290	0.082	2	115.4116	0.286	5	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]Si[5,6]C[6a])(C[6]C[6]H)(CHH)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Si<4>,2|C<3>}	C[6](N[6]Si[5,6]C[6a])(C[6]C[6]H)(CHH){1|C<4>,2|N<3>,3|C<3>}	H(C[6]C[6]2)	115.9440	0.000	1	115.4116	0.286	5	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]Si[5,6]C[6a])(C[6]C[6]H)(CHH)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Si<4>,2|C<3>}	C[6](N[6]Si[5,6]C[6a])(C[6]C[6]H)(CHH){1|N<3>,2|C<3>,3|C<4>}	H(C[6]C[6]2)	115.3100	0.000	1	115.4116	0.286	5	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]Si[5,6]C[6a])(C[6]C[6]H)(CHH)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Si<4>,2|C<3>}	C[6](N[6]Si[5,6]C[6a])(C[6]C[6]H)(CHH){2|C<3>,2|C<4>,2|N<3>}	H(C[6]C[6]2)	114.5460	0.000	1	115.4116	0.286	5	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]Si[6,6]C[6a])(C[6]C[6]H)(CHH)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Si<4>,2|C<3>}	C[6](N[6]Si[6,6]C[6a])(C[6]C[6]H)(CHH){1|N<3>,2|C<3>,3|C<4>}	H(C[6]C[6]2)	115.0780	0.000	1	115.0780	0.000	1	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]Si[6]C[6])(C[6]C[6]H)(CHH)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Si<5>,2|C<3>}	C[6](N[6]Si[6]C[6])(C[6]C[6]H)(CHH){1|Br<2>,1|Li<5>,1|C<3>,1|N<3>,1|N<4>,2|C<4>}	H(C[6]C[6]2)	115.4930	0.000	1	115.4930	0.000	1	120.3735	0.997	3862	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]C[6]N[6])(H)	C[6](N[6]C[6,6a]Cu)(C[6]C[6]N[6])(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]C[6]N[6])(H){1|Cu<4>,1|N<3>,3|C<3>}	C[6](N[6]C[6,6a]Cu)(C[6]C[6]N[6])(C[6]C[6]H){1|H<1>,5|C<3>}	H(C[6]C[6]2)	120.1475	0.163	2	120.1475	0.027	2	120.3863	0.780	313	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]C[6]N[6])(H)	C[6](N[6]C[6,6a]Mn)(C[6]C[6]N[6])(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]C[6]N[6])(H){1|Mn<6>,1|N<3>,3|C<3>}	C[6](N[6]C[6,6a]Mn)(C[6]C[6]N[6])(C[6]C[6]H){1|H<1>,5|C<3>}	H(C[6]C[6]2)	119.9530	0.109	2	119.9530	0.012	2	120.3863	0.780	313	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]C[6]N[6])(H)	C[6](N[6]C[6,6a]Os)(C[6]C[6]N[6])(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]C[6]N[6])(H){1|Os<6>,1|N<3>,3|C<3>}	C[6](N[6]C[6,6a]Os)(C[6]C[6]N[6])(C[6]C[6]H){1|H<1>,5|C<3>}	H(C[6]C[6]2)	120.0690	0.066	2	120.0690	0.004	2	120.3863	0.780	313	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]C[6]N[6])(H)	C[6](N[6]C[6,6a]Pt)(C[6]C[6]N[6])(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]C[6]N[6])(H){1|Pt<4>,1|N<3>,3|C<3>}	C[6](N[6]C[6,6a]Pt)(C[6]C[6]N[6])(C[6]C[6]H){1|C<4>,1|H<1>,4|C<3>}	H(C[6]C[6]2)	120.3550	0.000	1	120.3550	0.000	1	120.3863	0.780	313	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H)	C[6](N[6]C[6,6a]Ag)(C[6]C[6]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H){1|Ag<4>,4|C<3>}	C[6](N[6]C[6,6a]Ag)(C[6]C[6]2)(C[6]C[6]H){1|C<2>,1|H<1>,2|O<2>,3|C<3>}	H(C[6]C[6]2)	118.5670	0.000	1	118.5670	0.000	1	120.3863	0.780	313	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H)	C[6](N[6]C[6,6a]Au)(C[6]C[6]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H){1|Au<4>,4|C<3>}	C[6](N[6]C[6,6a]Au)(C[6]C[6]2)(C[6]C[6]H){1|C<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	121.3010	0.000	1	121.3010	0.000	1	120.3863	0.780	313	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H)	C[6](N[6]C[6,6a]Co)(C[6]C[6]N[6])(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H){1|Co<4>,1|N<3>,3|C<3>}	C[6](N[6]C[6,6a]Co)(C[6]C[6]N[6])(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.3317	0.155	6	120.3317	0.024	6	120.3863	0.780	313	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H)	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(C[6]N[6]2)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H){1|Cu<5>,1|N<2>,1|N<3>,2|C<3>}	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(C[6]N[6]2){1|H<1>,1|N<2>,3|C<3>}	H(C[6]C[6]2)	120.6010	0.000	1	120.6010	0.000	1	120.3863	0.780	313	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H)	C[6](N[6]C[6,6a]Cu)(C[6]C[6]N[6])(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H){1|Cu<4>,1|N<3>,3|C<3>}	C[6](N[6]C[6,6a]Cu)(C[6]C[6]N[6])(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.4860	0.335	6	120.3952	0.069	16	120.3863	0.780	313	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H)	C[6](N[6]C[6,6a]Cu)(C[6]C[6]N[6])(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H){1|Cu<5>,1|N<2>,1|N<3>,2|C<3>}	C[6](N[6]C[6,6a]Cu)(C[6]C[6]N[6])(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.1730	0.000	1	120.3952	0.069	16	120.3863	0.780	313	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H)	C[6](N[6]C[6,6a]Cu)(C[6]C[6]N[6])(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H){1|Cu<5>,1|N<3>,3|C<3>}	C[6](N[6]C[6,6a]Cu)(C[6]C[6]N[6])(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.3955	0.154	4	120.3952	0.069	16	120.3863	0.780	313	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H)	C[6](N[6]C[6,6a]Cu)(C[6]C[6]N[6])(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H){1|Cu<6>,1|N<3>,3|C<3>}	C[6](N[6]C[6,6a]Cu)(C[6]C[6]N[6])(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.3304	0.266	5	120.3952	0.069	16	120.3863	0.780	313	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H)	C[6](N[6]C[6,6a]Fe)(C[6]C[6]N[6])(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H){1|Fe<4>,1|N<3>,3|C<3>}	C[6](N[6]C[6,6a]Fe)(C[6]C[6]N[6])(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.4510	0.021	2	120.1640	0.069	7	120.3863	0.780	313	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H)	C[6](N[6]C[6,6a]Fe)(C[6]C[6]N[6])(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H){1|Fe<6>,1|N<3>,3|C<3>}	C[6](N[6]C[6,6a]Fe)(C[6]C[6]N[6])(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.0492	0.213	5	120.1640	0.069	7	120.3863	0.780	313	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H)	C[6](N[6]C[6,6a]Ir)(C[6]C[6]N[6])(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H){1|Ir<6>,1|N<3>,3|C<3>}	C[6](N[6]C[6,6a]Ir)(C[6]C[6]N[6])(C[6]C[6]H){1|N<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.3110	0.000	1	120.2597	0.304	13	120.3863	0.780	313	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H)	C[6](N[6]C[6,6a]Ir)(C[6]C[6]N[6])(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H){1|Ir<6>,1|N<3>,3|C<3>}	C[6](N[6]C[6,6a]Ir)(C[6]C[6]N[6])(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.2242	0.323	8	120.2597	0.304	13	120.3863	0.780	313	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H)	C[6](N[6]C[6,6a]Ir)(C[6]C[6]N[6])(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H){1|Ir<7>,1|N<3>,3|C<3>}	C[6](N[6]C[6,6a]Ir)(C[6]C[6]N[6])(C[6]C[6]H){1|N<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	121.2610	0.000	1	120.2597	0.304	13	120.3863	0.780	313	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H)	C[6](N[6]C[6,6a]Ir)(C[6]C[6]N[6])(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H){1|Ir<7>,1|N<3>,3|C<3>}	C[6](N[6]C[6,6a]Ir)(C[6]C[6]N[6])(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.0033	0.923	3	120.2597	0.304	13	120.3863	0.780	313	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H)	C[6](N[6]C[6,6a]Mn)(C[6]C[6]N[6])(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H){1|Mn<5>,1|N<3>,3|C<3>}	C[6](N[6]C[6,6a]Mn)(C[6]C[6]N[6])(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.9345	0.391	2	119.9883	0.085	3	120.3863	0.780	313	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H)	C[6](N[6]C[6,6a]Mn)(C[6]C[6]N[6])(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H){1|Mn<6>,1|N<3>,3|C<3>}	C[6](N[6]C[6,6a]Mn)(C[6]C[6]N[6])(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.0960	0.000	1	119.9883	0.085	3	120.3863	0.780	313	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H)	C[6](N[6]C[6,6a]Mo)(C[6]C[6]N[6])(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H){1|Mo<6>,1|N<3>,3|C<3>}	C[6](N[6]C[6,6a]Mo)(C[6]C[6]N[6])(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.0320	0.208	4	120.0320	0.043	4	120.3863	0.780	313	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H)	C[6](N[6]C[6,6a]Pt)(C[6]C[6]N[6])(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H){1|Pt<4>,1|N<3>,3|C<3>}	C[6](N[6]C[6,6a]Pt)(C[6]C[6]N[6])(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.0243	0.440	3	120.0243	0.193	3	120.3863	0.780	313	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H)	C[6](N[6]C[6,6a]Pu)(C[6]C[6]H)(C[6]N[6]2)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H){1|Pu<11>,1|N<2>,1|N<3>,2|C<3>}	C[6](N[6]C[6,6a]Pu)(C[6]C[6]H)(C[6]N[6]2){1|H<1>,1|N<2>,3|C<3>}	H(C[6]C[6]2)	120.6527	0.367	4	120.6527	0.135	4	120.3863	0.780	313	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H)	C[6](N[6]C[6,6a]Re)(C[6]C[6]N[6])(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H){1|Re<6>,1|N<3>,3|C<3>}	C[6](N[6]C[6,6a]Re)(C[6]C[6]N[6])(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.1982	0.341	12	120.1982	0.116	12	120.3863	0.780	313	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H)	C[6](N[6]C[6,6a]Ru)(C[6]C[6]N[6])(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H){1|Ru<6>,1|N<2>,1|N<3>,2|C<3>}	C[6](N[6]C[6,6a]Ru)(C[6]C[6]N[6])(C[6]C[6]H){1|C<4>,1|H<1>,4|C<3>}	H(C[6]C[6]2)	119.6670	0.000	1	120.0682	0.396	10	120.3863	0.780	313	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H)	C[6](N[6]C[6,6a]Ru)(C[6]C[6]N[6])(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H){1|Ru<6>,1|N<2>,1|N<3>,2|C<3>}	C[6](N[6]C[6,6a]Ru)(C[6]C[6]N[6])(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.2170	0.000	1	120.0682	0.396	10	120.3863	0.780	313	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H)	C[6](N[6]C[6,6a]Ru)(C[6]C[6]N[6])(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H){1|Ru<6>,1|N<3>,3|C<3>}	C[6](N[6]C[6,6a]Ru)(C[6]C[6]N[6])(C[6]C[6]H){1|N<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.0763	0.815	6	120.0682	0.396	10	120.3863	0.780	313	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H)	C[6](N[6]C[6,6a]Ru)(C[6]C[6]N[6])(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H){1|Ru<8>,1|N<3>,3|C<3>}	C[6](N[6]C[6,6a]Ru)(C[6]C[6]N[6])(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.1700	0.195	2	120.0682	0.396	10	120.3863	0.780	313	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H)	C[6](N[6]C[6,6a]Zn)(C[6]C[6]N[6])(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H){1|Zn<4>,1|N<2>,1|N<3>,2|C<3>}	C[6](N[6]C[6,6a]Zn)(C[6]C[6]N[6])(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.1480	0.000	1	120.1454	0.473	11	120.3863	0.780	313	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H)	C[6](N[6]C[6,6a]Zn)(C[6]C[6]N[6])(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H){1|Zn<4>,1|N<3>,3|C<3>}	C[6](N[6]C[6,6a]Zn)(C[6]C[6]N[6])(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.4974	0.203	5	120.1454	0.473	11	120.3863	0.780	313	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H)	C[6](N[6]C[6,6a]Zn)(C[6]C[6]N[6])(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H){1|Zn<5>,1|N<2>,1|N<3>,2|C<3>}	C[6](N[6]C[6,6a]Zn)(C[6]C[6]N[6])(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.3550	0.000	1	120.1454	0.473	11	120.3863	0.780	313	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H)	C[6](N[6]C[6,6a]Zn)(C[6]C[6]N[6])(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H){1|Zn<5>,1|N<3>,3|C<3>}	C[6](N[6]C[6,6a]Zn)(C[6]C[6]N[6])(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.4745	0.052	2	120.1454	0.473	11	120.3863	0.780	313	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H)	C[6](N[6]C[6,6a]Zn)(C[6]C[6]N[6])(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H){1|Zn<6>,1|N<3>,3|C<3>}	C[6](N[6]C[6,6a]Zn)(C[6]C[6]N[6])(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	118.8300	0.468	2	120.1454	0.473	11	120.3863	0.780	313	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6,6]H)(H)	C[6](N[6]C[6,6]Rh)(C[6]C[6]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6,6]H)(H){1|Rh<5>,1|C<4>,3|C<3>}	C[6](N[6]C[6,6]Rh)(C[6]C[6]2)(C[6]C[6]H){1|N<3>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.2760	0.000	1	120.2760	0.000	1	120.3863	0.780	313	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Ir<6>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Ir)(C[6]C[6]2)(C[6]C[6]H){1|C<3>,1|C<4>,1|H<1>,1|N<2>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.2080	0.000	1	120.2080	0.000	1	120.3863	0.780	313	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Ag)(C[6]C[6]H)(C[6]N[6]2)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ag<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](N[6]C[6]Ag)(C[6]C[6]H)(C[6]N[6]2){1|C<3>,1|N<2>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.7105	0.159	2	120.7105	0.025	2	120.3863	0.780	313	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Cd)(C[6]C[6]H)(C[6]N[6]2)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cd<5>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](N[6]C[6]Cd)(C[6]C[6]H)(C[6]N[6]2){2|H<1>,3|C<3>}	H(C[6]C[6]2)	121.7330	0.934	4	121.7330	0.873	4	120.3863	0.780	313	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(C[6]N[6]2)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Co<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(C[6]N[6]2){1|H<1>,4|C<3>}	H(C[6]C[6]2)	121.0690	0.000	1	120.6539	0.211	35	120.3863	0.780	313	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(C[6]N[6]2)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Co<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(C[6]N[6]2){2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.5916	0.470	28	120.6539	0.211	35	120.3863	0.780	313	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(C[6]N[6]2)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Co<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(C[6]N[6]2){1|B<4>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	120.6390	0.372	2	120.6539	0.211	35	120.3863	0.780	313	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(C[6]N[6]2)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Co<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(C[6]N[6]2){1|S<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.9938	0.329	4	120.6539	0.211	35	120.3863	0.780	313	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(C[6]N[6]2)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|C<3>,1|C<4>,1|N<2>,1|N<3>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(C[6]N[6]2){2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.2870	0.000	1	120.3235	4.460	22	120.3863	0.780	313	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(C[6]N[6]2)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(C[6]N[6]2){1|C<3>,1|C<4>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.8110	0.000	1	120.3235	4.460	22	120.3863	0.780	313	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(C[6]N[6]2)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(C[6]N[6]2){1|C<3>,1|N<2>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.6890	0.000	1	120.3235	4.460	22	120.3863	0.780	313	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(C[6]N[6]2)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(C[6]N[6]2){1|C<3>,2|H<1>,2|N<3>}	H(C[6]C[6]2)	116.0340	7.140	2	120.3235	4.460	22	120.3863	0.780	313	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(C[6]N[6]2)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(C[6]N[6]2){1|N<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.8190	0.057	3	120.3235	4.460	22	120.3863	0.780	313	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(C[6]N[6]2)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(C[6]N[6]2){2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.9965	0.619	4	120.3235	4.460	22	120.3863	0.780	313	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(C[6]N[6]2)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(C[6]N[6]2){2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.6820	0.237	10	120.3235	4.460	22	120.3863	0.780	313	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Eu)(C[6]C[6]H)(C[6]N[6]2)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Eu<13>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](N[6]C[6]Eu)(C[6]C[6]H)(C[6]N[6]2){1|H<1>,1|N<2>,3|C<3>}	H(C[6]C[6]2)	120.6195	0.052	2	120.6505	0.017	6	120.3863	0.780	313	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Eu)(C[6]C[6]H)(C[6]N[6]2)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Eu<13>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](N[6]C[6]Eu)(C[6]C[6]H)(C[6]N[6]2){2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.7880	0.034	2	120.6505	0.017	6	120.3863	0.780	313	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Eu)(C[6]C[6]H)(C[6]N[6]2)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Eu<8>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](N[6]C[6]Eu)(C[6]C[6]H)(C[6]N[6]2){2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.5440	0.130	2	120.6505	0.017	6	120.3863	0.780	313	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Fe<5>,1|C<4>,1|H<1>,2|C<3>}	C[6](N[6]C[6]Fe)(C[6]C[6]2)(C[6]C[6]H){1|Fe<6>,1|C<4>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	118.8810	1.243	2	119.1803	1.041	3	120.3863	0.780	313	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Fe<5>,1|C<4>,1|N<3>,2|C<3>}	C[6](N[6]C[6]Fe)(C[6]C[6]2)(C[6]C[6]H){1|Fe<6>,1|C<4>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	119.7790	0.000	1	119.1803	1.041	3	120.3863	0.780	313	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(C[6]N[6]2)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Fe<5>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(C[6]N[6]2){1|S<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6010	0.173	2	120.6936	0.042	14	120.3863	0.780	313	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(C[6]N[6]2)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(C[6]N[6]2){1|C<3>,2|H<1>,2|N<3>}	H(C[6]C[6]2)	120.7830	0.074	3	120.6936	0.042	14	120.3863	0.780	313	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(C[6]N[6]2)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(C[6]N[6]2){1|H<1>,4|C<3>}	H(C[6]C[6]2)	120.9465	0.087	2	120.6936	0.042	14	120.3863	0.780	313	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(C[6]N[6]2)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(C[6]N[6]2){2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.6273	0.231	6	120.6936	0.042	14	120.3863	0.780	313	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(C[6]N[6]2)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(C[6]N[6]2){1|B<4>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	120.5030	0.000	1	120.6936	0.042	14	120.3863	0.780	313	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Ir)(C[6]C[6]2)(C[6]C[6]H){1|N<3>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	120.6063	0.760	4	120.4484	0.330	8	120.3863	0.780	313	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Ir)(C[6]C[6]2)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.2905	0.356	4	120.4484	0.330	8	120.3863	0.780	313	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(C[6]N[6]2)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(C[6]N[6]2){2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.4160	0.321	2	120.4160	0.103	2	120.3863	0.780	313	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Li)(C[6]C[6]H)(C[6]N[6]2)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Li<5>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](N[6]C[6]Li)(C[6]C[6]H)(C[6]N[6]2){2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.7340	0.112	2	120.7340	0.012	2	120.3863	0.780	313	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(C[6]N[6]2)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Mn<5>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(C[6]N[6]2){2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.6053	2.040	6	120.2479	1.419	20	120.3863	0.780	313	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(C[6]N[6]2)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(C[6]N[6]2){1|N<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5740	0.201	2	120.2479	1.419	20	120.3863	0.780	313	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(C[6]N[6]2)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(C[6]N[6]2){2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.4746	0.549	9	120.2479	1.419	20	120.3863	0.780	313	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(C[6]N[6]2)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Mn<8>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(C[6]N[6]2){2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.6360	0.225	3	120.2479	1.419	20	120.3863	0.780	313	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Mo)(C[6]C[6]H)(C[6]N[6]2)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Mo<9>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](N[6]C[6]Mo)(C[6]C[6]H)(C[6]N[6]2){1|N<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	117.6230	0.000	1	117.6230	0.000	1	120.3863	0.780	313	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(C[6]N[6]2)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(C[6]N[6]2){1|H<1>,4|C<3>}	H(C[6]C[6]2)	121.1690	0.219	2	120.8317	0.081	30	120.3863	0.780	313	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(C[6]N[6]2)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(C[6]N[6]2){1|N<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5837	0.096	4	120.8317	0.081	30	120.3863	0.780	313	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(C[6]N[6]2)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(C[6]N[6]2){2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.8449	0.280	24	120.8317	0.081	30	120.3863	0.780	313	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Pd)(C[6]C[6]2)(C[6]C[6]H){3|C<3>,4|H<1>}	H(C[6]C[6]2)	119.4940	0.000	1	119.4940	0.000	1	120.3863	0.780	313	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(C[6]N[6]2)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(C[6]N[6]2){1|C<3>,2|H<1>,2|N<3>}	H(C[6]C[6]2)	120.6749	0.259	7	120.6444	0.091	12	120.3863	0.780	313	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(C[6]N[6]2)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(C[6]N[6]2){1|H<1>,1|N<2>,3|C<3>}	H(C[6]C[6]2)	120.6403	0.428	4	120.6444	0.091	12	120.3863	0.780	313	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(C[6]N[6]2)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(C[6]N[6]2){2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.4480	0.000	1	120.6444	0.091	12	120.3863	0.780	313	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Pt)(C[6]C[6]2)(C[6]C[6]H){1|N<3>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	120.8255	0.701	2	120.5593	0.458	3	120.3863	0.780	313	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Pt)(C[6]C[6]2)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.0270	0.000	1	120.5593	0.458	3	120.3863	0.780	313	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(C[6]N[6]2)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(C[6]N[6]2){1|C<3>,2|H<1>,2|N<3>}	H(C[6]C[6]2)	120.1940	0.000	1	120.2938	0.251	4	120.3863	0.780	313	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(C[6]N[6]2)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(C[6]N[6]2){1|N<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3270	0.608	3	120.2938	0.251	4	120.3863	0.780	313	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(C[6]N[6]2)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Re<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(C[6]N[6]2){1|C<3>,2|H<1>,2|N<2>}	H(C[6]C[6]2)	120.2640	0.000	1	120.4171	0.364	10	120.3863	0.780	313	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(C[6]N[6]2)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Re<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(C[6]N[6]2){1|C<4>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1452	0.363	6	120.4171	0.364	10	120.3863	0.780	313	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(C[6]N[6]2)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Re<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(C[6]N[6]2){2|H<1>,3|C<3>}	H(C[6]C[6]2)	121.0120	0.737	3	120.4171	0.364	10	120.3863	0.780	313	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(C[6]N[6]2)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(C[6]N[6]2){1|H<1>,4|C<3>}	H(C[6]C[6]2)	120.4820	0.492	2	120.1312	1.533	18	120.3863	0.780	313	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(C[6]N[6]2)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(C[6]N[6]2){2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.0873	1.305	16	120.1312	1.533	18	120.3863	0.780	313	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Sm)(C[6]C[6]H)(C[6]N[6]2)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Sm<13>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](N[6]C[6]Sm)(C[6]C[6]H)(C[6]N[6]2){2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.5575	0.197	2	120.5575	0.039	2	120.3863	0.780	313	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Ta)(C[6]C[6]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ta<8>,1|C<4>,1|H<1>,2|C<3>}	C[6](N[6]C[6]Ta)(C[6]C[6]2)(C[6]C[6]H){1|O<2>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.3760	1.204	6	119.3760	1.449	6	120.3863	0.780	313	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Ti)(C[6]C[6]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ti<7>,1|C<4>,1|H<1>,2|C<3>}	C[6](N[6]C[6]Ti)(C[6]C[6]2)(C[6]C[6]H){1|O<2>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.8660	0.208	2	119.8660	0.043	2	120.3863	0.780	313	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(C[6]N[6]2)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Zn<4>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(C[6]N[6]2){2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.1970	0.000	1	120.6275	0.173	4	120.3863	0.780	313	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(C[6]N[6]2)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Zn<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(C[6]N[6]2){2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.7710	0.369	3	120.6275	0.173	4	120.3863	0.780	313	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Zr)(C[6]C[6]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Zr<10>,1|C<4>,1|H<1>,2|C<3>}	C[6](N[6]C[6]Zr)(C[6]C[6]2)(C[6]C[6]H){1|O<2>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.8300	0.000	1	119.8300	0.000	1	120.3863	0.780	313	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6,6]Co)(C[6]C[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]N)(H){1|Co<6>,2|C<3>}	C[6](N[6]C[6,6]Co)(C[6]C[6]H)(NHH){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8390	0.089	2	119.8390	0.008	2	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6,6]Cu)(C[6]C[6]H)(NC[6a]Pt)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]N)(H){1|Cu<4>,2|C<3>}	C[6](N[6]C[6,6]Cu)(C[6]C[6]H)(NC[6a]Pt){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9310	0.000	1	119.9310	0.000	1	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6,6]Cu)(C[6]C[6]H)(NCuC)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]N)(H){1|Cu<3>,2|C<3>}	C[6](N[6]C[6,6]Cu)(C[6]C[6]H)(NCuC){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1135	0.087	2	120.1135	0.008	2	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]N)(H)	C[6](N[6]C[6,6a]Cd)(C[6]C[6]H)(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]N)(H){1|Cd<5>,2|C<3>}	C[6](N[6]C[6,6a]Cd)(C[6]C[6]H)(NCC){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.1680	0.000	1	120.3680	0.080	2	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]N)(H)	C[6](N[6]C[6,6a]Cd)(C[6]C[6]H)(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]N)(H){1|Cd<6>,2|C<3>}	C[6](N[6]C[6,6a]Cd)(C[6]C[6]H)(NCC){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5680	0.000	1	120.3680	0.080	2	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]N)(H)	C[6](N[6]C[6,6a]Co)(C[6]C[6]H)(NCN)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]N)(H){1|Co<7>,2|C<3>}	C[6](N[6]C[6,6a]Co)(C[6]C[6]H)(NCN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5390	0.144	5	120.5390	0.021	5	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]N)(H)	C[6](N[6]C[6,6a]Co)(C[6]C[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]N)(H){1|Co<6>,2|C<3>}	C[6](N[6]C[6,6a]Co)(C[6]C[6]H)(NHH){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.4170	0.000	1	119.4170	0.000	1	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]N)(H)	C[6](N[6]C[6,6a]H)(C[6]C[6]H)(NBH)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]N)(H){1|H<1>,2|C<3>}	C[6](N[6]C[6,6a]H)(C[6]C[6]H)(NBH){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.7860	0.116	2	119.7860	0.013	2	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]N)(H)	C[6](N[6]C[6,6a]Ni)(C[6]C[6]H)(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]N)(H){1|Ni<6>,2|C<3>}	C[6](N[6]C[6,6a]Ni)(C[6]C[6]H)(NCC){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.8830	0.000	1	119.8830	0.000	1	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]N)(H)	C[6](N[6]C[6,6a]Ni)(C[6]C[6]H)(NHP)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]N)(H){1|Ni<4>,2|C<3>}	C[6](N[6]C[6,6a]Ni)(C[6]C[6]H)(NHP){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.1230	0.000	1	120.1230	0.000	1	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]N)(H)	C[6](N[6]C[6,6a]O)(C[6]C[6]H)(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]N)(H){1|O<1>,2|C<3>}	C[6](N[6]C[6,6a]O)(C[6]C[6]H)(NCH){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.7860	0.000	1	119.7860	0.000	1	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]N)(H)	C[6](N[6]C[6,6a]Pt)(C[6]C[6]H)(NC[6a]2)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]N)(H){1|Pt<4>,2|C<3>}	C[6](N[6]C[6,6a]Pt)(C[6]C[6]H)(NC[6a]2){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.7200	0.000	1	119.7200	0.000	1	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]N)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(NC[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]N)(H){1|Co<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(NC[6]H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.8070	0.202	2	119.8070	0.041	2	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]N)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(NCoC)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]N)(H){1|Co<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(NCoC){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.9888	0.348	6	119.9888	0.121	6	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]N)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]N)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(NCH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.5600	0.000	1	119.5600	0.000	1	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]N)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(NC[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]N)(H){1|Cu<3>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(NC[6]H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.8610	0.064	2	119.8610	0.004	2	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]N)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(NC[6a]H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]N)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(NC[6a]H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.9797	0.067	4	119.9797	0.004	4	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]N)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]N)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(NHH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.3430	0.000	1	119.3430	0.000	1	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(NC[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]N)(H){1|Ir<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(NC[6]H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.8060	0.020	2	119.8060	0.000	2	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NRuH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]N)(H){1|Ru<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NRuH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.5615	0.248	2	119.5615	0.062	2	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ag)(C[6]C[6]H)(NC[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ag<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ag)(C[6]C[6]H)(NC[6]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5455	0.585	8	120.5455	0.342	8	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Al)(C[6]C[6]H)(NAlSi)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Al<5>,1|C<4>,1|H<1>}	C[6](N[6]C[6]Al)(C[6]C[6]H)(NAlSi){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3963	0.151	3	120.3963	0.023	3	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Al)(C[6]C[6]H)(NCO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Al<5>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Al)(C[6]C[6]H)(NCO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6650	0.202	4	120.6008	0.024	8	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Al)(C[6]C[6]H)(NCO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Al<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Al)(C[6]C[6]H)(NCO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4990	0.088	2	120.6008	0.024	8	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Al)(C[6]C[6]H)(NCO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Al<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Al)(C[6]C[6]H)(NCO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5740	0.038	2	120.6008	0.024	8	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Al)(C[6]C[6]H)(NC[6a]Al)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Al<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Al)(C[6]C[6]H)(NC[6a]Al){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1200	0.000	1	120.1200	0.000	1	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ca)(C[6]C[6]H)(NHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ca<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ca)(C[6]C[6]H)(NHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.7920	0.103	2	120.7920	0.011	2	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Cd)(C[6]C[6]H)(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cd)(C[6]C[6]H)(NCH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1915	0.101	2	120.1915	0.010	2	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Cd)(C[6]C[6]H)(NC[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cd<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cd)(C[6]C[6]H)(NC[6]H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4340	0.107	2	120.3432	0.015	4	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Cd)(C[6]C[6]H)(NC[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cd<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cd)(C[6]C[6]H)(NC[6]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2525	0.039	2	120.3432	0.015	4	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Cd)(C[6]C[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cd<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cd)(C[6]C[6]H)(NHH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1780	0.252	4	120.1780	0.063	4	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Cd)(C[6]C[6]H)(NHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cd<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cd)(C[6]C[6]H)(NHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.7500	0.226	2	120.7500	0.051	2	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(NAlC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Co<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(NAlC){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9538	0.109	6	119.9538	0.012	6	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(NCC){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.5640	0.133	2	119.5640	0.018	2	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Co<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(NCH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2540	0.092	3	120.5386	0.119	11	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Co<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(NCH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.1710	0.000	1	120.5386	0.119	11	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(NCH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.8588	0.271	4	120.5386	0.119	11	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(NCH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2180	0.000	1	120.5386	0.119	11	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Co<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(NCH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.6695	0.161	2	120.5386	0.119	11	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(NCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(NCN){1|C<3>,1|H<1>,1|N<4>}	H(C[6]C[6]2)	120.1940	0.000	1	120.1940	0.000	1	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(NC[6]C)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(NC[6]C){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.9043	0.583	4	120.9043	0.340	4	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(NC[6]Co)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Co<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(NC[6]Co){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9319	0.233	123	119.9319	0.054	123	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(NC[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Co<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(NC[6]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	118.4043	2.328	4	120.0227	1.474	28	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(NC[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Co<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(NC[6]H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	118.5500	0.762	2	120.0227	1.474	28	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(NC[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(NC[6]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4651	0.562	12	120.0227	1.474	28	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(NC[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Co<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(NC[6]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4337	0.267	10	120.0227	1.474	28	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(NC[6]Pt)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Co<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(NC[6]Pt){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1442	0.262	8	120.1442	0.069	8	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(NCoC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Co<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(NCoC){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0915	0.563	10	120.0915	0.317	10	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Co<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(NHH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3665	0.190	4	120.3080	0.036	9	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(NHH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.3160	0.151	2	120.3080	0.036	9	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(NHH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3010	0.000	1	120.3080	0.036	9	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Co<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(NHH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1865	0.342	2	120.3080	0.036	9	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(NHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Co<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(NHP){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8035	0.122	4	120.7334	0.109	16	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(NHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Co<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(NHP){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7044	0.395	11	120.7334	0.109	16	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(NHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Co<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(NHP){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.7730	0.000	1	120.7334	0.109	16	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(NSiH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Co<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(NSiH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.2210	0.000	1	120.2210	0.000	1	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Cr)(C[6]C[6]H)(NC[6]2)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cr<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cr)(C[6]C[6]H)(NC[6]2){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.9443	0.151	3	120.9443	0.023	3	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Cr)(C[6]C[6]H)(NC[6]C)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cr<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cr)(C[6]C[6]H)(NC[6]C){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5081	0.309	10	120.4691	0.070	20	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Cr)(C[6]C[6]H)(NC[6]C)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cr<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cr)(C[6]C[6]H)(NC[6]C){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4301	0.218	10	120.4691	0.070	20	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Cr)(C[6]C[6]H)(NC[6]Cr)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cr<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cr)(C[6]C[6]H)(NC[6]Cr){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9926	0.227	24	120.0589	0.056	36	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Cr)(C[6]C[6]H)(NC[6]Cr)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cr<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cr)(C[6]C[6]H)(NC[6]Cr){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1913	0.200	12	120.0589	0.056	36	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Cr)(C[6]C[6]H)(NCrC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cr<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cr)(C[6]C[6]H)(NCrC){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1590	0.000	1	120.1590	0.000	1	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Cr)(C[6]C[6]H)(NHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cr<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cr)(C[6]C[6]H)(NHP){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.8250	0.000	1	120.8503	0.002	3	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Cr)(C[6]C[6]H)(NHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cr<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cr)(C[6]C[6]H)(NHP){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8630	0.057	2	120.8503	0.002	3	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(NCH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6220	0.272	2	119.7321	1.767	15	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(NCH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.2620	1.412	10	119.7321	1.767	15	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(NCH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.8260	0.004	2	119.7321	1.767	15	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cu<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(NCH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4650	0.000	1	119.7321	1.767	15	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(NCP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(NCP){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.3908	0.106	6	121.3908	0.011	6	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(NC[6]C)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(NC[6]C){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8660	0.015	3	120.4580	0.323	5	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(NC[6]C)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(NC[6]C){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8460	0.204	2	120.4580	0.323	5	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(NC[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cu<3>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(NC[6]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3570	0.060	3	120.2397	0.762	47	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(NC[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cu<3>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(NC[6]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1945	0.333	2	120.2397	0.762	47	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(NC[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(NC[6]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2828	0.259	12	120.2397	0.762	47	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(NC[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(NC[6]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1123	1.493	16	120.2397	0.762	47	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(NC[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cu<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(NC[6]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3296	0.153	14	120.2397	0.762	47	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(NC[6]Pd)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(NC[6]Pd){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8668	0.208	6	119.8668	0.043	6	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(NC[6]Pt)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(NC[6]Pt){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0686	0.284	8	120.0686	0.081	8	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(NC[6a]C)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(NC[6a]C){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5305	0.206	2	120.5305	0.042	2	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(NC[6a]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(NC[6a]H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.4695	0.223	4	120.4210	0.035	6	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(NC[6a]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(NC[6a]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3240	0.011	2	120.4210	0.035	6	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(NC[6a]N)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(NC[6a]N){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5385	0.037	2	120.5385	0.001	2	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(NCoC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(NCoC){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9014	0.207	5	119.9014	0.043	5	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(NCrC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(NCrC){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8830	0.000	1	119.8830	0.000	1	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(NCuC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cu<3>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(NCuC){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2330	0.137	2	120.4218	0.118	5	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(NCuC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(NCuC){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0970	0.000	1	120.4218	0.118	5	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(NCuC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(NCuC){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.7730	0.170	2	120.4218	0.118	5	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(NHH){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.9155	0.068	4	120.6999	0.049	9	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(NHH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5274	0.109	5	120.6999	0.049	9	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(NHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cu<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(NHN){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.0995	0.035	2	121.0995	0.001	2	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(NHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cu<3>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(NHP){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4440	0.000	1	120.8304	0.067	12	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(NHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(NHP){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.1082	0.242	4	120.8304	0.067	12	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(NHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(NHP){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.7269	0.067	7	120.8304	0.067	12	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Fe<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NCH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.3887	0.143	3	120.7208	0.219	10	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NCH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.7575	0.095	2	120.7208	0.219	10	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NCH){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	121.2270	0.000	1	120.7208	0.219	10	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NCH){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8540	0.000	1	120.7208	0.219	10	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NCH){1|H<1>,2|C<3>}	H(C[6]C[6]2)	121.1487	0.114	3	120.7208	0.219	10	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NCP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Fe<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NCP){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7570	0.014	2	120.7570	0.034	19	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NCP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NCP){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8424	0.145	11	120.7570	0.034	19	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NCP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NCP){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3785	0.121	2	120.7570	0.034	19	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NCP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Fe<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NCP){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7115	0.081	4	120.7570	0.034	19	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NC[6]C)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NC[6]C){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5048	0.411	16	120.5048	0.169	16	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NC[6]Cr)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Fe<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NC[6]Cr){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0759	0.172	8	120.0759	0.030	8	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NC[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Fe<6>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NC[6]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3178	0.150	6	120.4193	0.024	24	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NC[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NC[6]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3162	0.098	4	120.4193	0.024	24	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NC[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NC[6]H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.4923	0.131	14	120.4193	0.024	24	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NC[6a]N)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Fe<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NC[6a]N){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.9055	0.004	2	120.9976	0.193	8	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NC[6a]N)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NC[6a]N){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.7782	0.440	4	120.9976	0.193	8	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NC[6a]N)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Fe<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NC[6a]N){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.5285	0.042	2	120.9976	0.193	8	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NCoC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Fe<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NCoC){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9563	0.046	3	119.9563	0.002	3	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NFeC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Fe<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NFeC){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7275	0.392	2	120.3108	0.185	5	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NFeC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Fe<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NFeC){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0330	0.061	3	120.3108	0.185	5	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NHH){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9630	0.000	1	119.3535	0.743	2	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NHH){1|H<1>,2|C<3>}	H(C[6]C[6]2)	118.7440	0.000	1	119.3535	0.743	2	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	121.1936	0.214	5	121.1936	0.046	5	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Fe<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NHP){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.0745	0.165	6	120.7951	0.086	58	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Fe<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NHP){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5320	0.064	6	120.7951	0.086	58	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Fe<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NHP){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8587	0.129	6	120.7951	0.086	58	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Fe<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NHP){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5595	0.308	2	120.7951	0.086	58	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NHP){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.5095	0.571	2	120.7951	0.086	58	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NHP){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8666	0.277	29	120.7951	0.086	58	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NHP){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5793	0.262	7	120.7951	0.086	58	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ir<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(NCC){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3282	0.355	6	120.3282	0.126	6	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ir<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(NCH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2833	0.703	3	120.4203	0.404	4	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ir<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(NCH){1|Br<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.8310	0.000	1	120.4203	0.404	4	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(NCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ir<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(NCN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3260	0.000	1	120.3260	0.000	1	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(NC[6]C)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ir<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(NC[6]C){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3130	0.000	1	120.3130	0.000	1	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(NC[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ir<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(NC[6]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4458	1.149	4	120.4458	1.319	4	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(NC[6a]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ir<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(NC[6a]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4880	0.000	1	120.4880	0.000	1	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(NHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ir<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(NHP){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1100	0.000	1	120.1100	0.000	1	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Li)(C[6]C[6]H)(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Li<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Li)(C[6]C[6]H)(NCH){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.7335	0.043	2	120.7335	0.002	2	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Li)(C[6]C[6]H)(NC[5a]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Li<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Li)(C[6]C[6]H)(NC[5a]H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	121.0140	0.000	1	121.0140	0.000	1	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Li)(C[6]C[6]H)(NC[6a]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Li<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Li)(C[6]C[6]H)(NC[6a]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.9350	0.000	1	120.9350	0.000	1	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Li)(C[6]C[6]H)(NC[6a]Zn)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Li<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Li)(C[6]C[6]H)(NC[6a]Zn){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0605	0.026	2	120.0605	0.001	2	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Li)(C[6]C[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Li<4>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Li)(C[6]C[6]H)(NHH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	115.6993	0.414	3	116.8923	5.806	4	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Li)(C[6]C[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Li<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Li)(C[6]C[6]H)(NHH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.4710	0.000	1	116.8923	5.806	4	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Li)(C[6]C[6]H)(NSiH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Li<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Li)(C[6]C[6]H)(NSiH){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8615	0.237	4	120.9524	0.084	5	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Li)(C[6]C[6]H)(NSiH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Li<5>,1|C<4>,1|H<1>}	C[6](N[6]C[6]Li)(C[6]C[6]H)(NSiH){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.3160	0.000	1	120.9524	0.084	5	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Mg)(C[6]C[6]H)(NMgSi)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Mg<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mg)(C[6]C[6]H)(NMgSi){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.5800	0.000	1	119.5800	0.000	1	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(NCH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	121.7340	0.000	1	121.7340	0.000	1	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(NC[6]Cr)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Mn<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(NC[6]Cr){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2480	0.075	4	120.2480	0.006	4	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(NC[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(NC[6]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4701	0.352	12	120.4699	0.113	14	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(NC[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Mn<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(NC[6]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4685	0.329	2	120.4699	0.113	14	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(NCoC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Mn<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(NCoC){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9470	0.119	3	119.9470	0.014	3	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(NFeC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Mn<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(NFeC){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9375	0.016	2	119.9375	0.000	2	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Mn<6>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(NHH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3800	0.000	1	120.4072	0.007	6	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(NHH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3805	0.018	2	120.4072	0.007	6	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(NHH){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.4645	0.152	2	120.4072	0.007	6	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Mn<6>,2|C<3>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(NHH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3730	0.000	1	120.4072	0.007	6	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(NHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(NHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.9710	0.000	1	119.5132	1.011	4	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(NHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Mn<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(NHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.0273	0.316	3	119.5132	1.011	4	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(NMnN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(NMnN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	121.2820	0.000	1	121.2820	0.000	1	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Mo)(C[6]C[6]H)(NCP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Mo<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mo)(C[6]C[6]H)(NCP){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.9100	0.184	10	120.8794	0.033	12	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Mo)(C[6]C[6]H)(NCP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Mo<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mo)(C[6]C[6]H)(NCP){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7265	0.016	2	120.8794	0.033	12	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Mo)(C[6]C[6]H)(NC[6a]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Mo<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mo)(C[6]C[6]H)(NC[6a]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4450	0.042	2	120.4450	0.002	2	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Mo)(C[6]C[6]H)(NHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Mo<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mo)(C[6]C[6]H)(NHP){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8507	0.077	3	120.8214	0.010	7	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Mo)(C[6]C[6]H)(NHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Mo<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mo)(C[6]C[6]H)(NHP){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7995	0.124	4	120.8214	0.010	7	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Mo)(C[6]C[6]H)(NSiH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Mo<9>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mo)(C[6]C[6]H)(NSiH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3600	0.052	2	120.3600	0.003	2	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NCH){1|C<3>,1|H<1>,1|N<4>}	H(C[6]C[6]2)	120.8005	0.050	2	120.7973	0.001	3	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NCH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.7910	0.000	1	120.7973	0.001	3	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NCO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NCO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	121.1593	0.589	4	121.0219	0.181	8	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NCO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<6>,2|C<3>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NCO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.8845	0.156	4	121.0219	0.181	8	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NC[6]C)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NC[6]C){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7750	0.233	4	120.7482	0.168	18	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NC[6]C)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NC[6]C){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8815	0.316	8	120.7482	0.168	18	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NC[6]C)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NC[6]C){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7908	0.558	4	120.7482	0.168	18	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NC[6]C)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NC[6]C){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0760	0.074	2	120.7482	0.168	18	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NC[6]Co)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NC[6]Co){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9410	0.843	2	119.9410	0.710	2	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NC[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NC[6]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5650	0.081	2	120.5745	0.257	14	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NC[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NC[6]H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4700	0.031	2	120.5745	0.257	14	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NC[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NC[6]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5973	0.606	10	120.5745	0.257	14	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NC[6]Ni)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NC[6]Ni){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8692	0.151	4	120.1974	0.153	44	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NC[6]Ni)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NC[6]Ni){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.5493	0.236	4	120.1974	0.153	44	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NC[6]Ni)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NC[6]Ni){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5000	0.163	4	120.1974	0.153	44	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NC[6]Ni)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NC[6]Ni){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1566	0.276	32	120.1974	0.153	44	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NC[6a]C)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NC[6a]C){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3886	0.322	5	120.3886	0.103	5	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NC[6a]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NC[6a]H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.3897	0.109	12	120.3897	0.012	12	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NC[6a]Ni)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NC[6a]Ni){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1052	0.234	4	120.1052	0.055	4	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NCoC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NCoC){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7377	0.104	3	119.7377	0.011	3	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NCuP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NCuP){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5550	0.000	1	120.5550	0.000	1	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NHH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3790	0.000	1	120.1282	0.056	6	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NHH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0700	0.000	1	120.1282	0.056	6	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NHH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0800	0.262	4	120.1282	0.056	6	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NHN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.8042	0.244	12	120.8042	0.060	12	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NHP){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	121.4355	0.093	2	120.7323	0.389	10	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NHP){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8163	0.723	3	120.7323	0.389	10	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NHP){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.7330	0.000	1	120.7323	0.389	10	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<4>,1|C<3>,2|C<4>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NHP){1|C<4>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.7480	0.065	2	120.7323	0.389	10	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NHP){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8870	0.078	2	120.7323	0.389	10	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NNiC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<5>,1|C<4>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NNiC){1|C<3>,1|H<1>,1|N<4>}	H(C[6]C[6]2)	119.9100	0.567	2	119.9100	0.322	2	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Os)(C[6]C[6]H)(NBH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Os<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Os)(C[6]C[6]H)(NBH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3600	0.179	3	120.3600	0.032	3	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Os)(C[6]C[6]H)(NC[6a]Os)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Os<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Os)(C[6]C[6]H)(NC[6a]Os){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9006	0.562	16	119.9006	0.316	16	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(NCC){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3205	0.011	2	120.3205	0.000	2	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(NCH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	121.0390	0.677	3	120.2390	0.920	10	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(NCH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1554	0.377	5	120.2390	0.920	10	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Pd<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(NCH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	118.0480	0.000	1	120.2390	0.920	10	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Pd<5>,1|C<4>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(NCH){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4480	0.000	1	120.2390	0.920	10	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(NCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(NCN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	121.1650	0.041	2	121.1650	0.002	2	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(NC[6]C)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(NC[6]C){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.6280	0.000	1	120.0332	0.170	4	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(NC[6]C)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(NC[6]C){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8120	0.000	1	120.0332	0.170	4	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(NC[6]C)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(NC[6]C){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.8465	0.193	2	120.0332	0.170	4	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(NC[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(NC[6]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4226	0.476	22	120.4226	0.227	22	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(NC[6a]2)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(NC[6a]2){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3130	0.065	2	120.3130	0.004	2	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(NC[6a]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(NC[6a]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.6015	0.413	4	119.6015	0.170	4	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(NC[6a]N)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(NC[6a]N){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.7970	0.000	1	120.7970	0.000	1	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(NHH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4810	0.000	1	120.4810	0.000	1	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(NHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(NHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.9300	0.278	5	120.9447	0.063	6	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(NHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Pd<4>,1|C<3>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(NHN){1|C<2>,2|H<1>}	H(C[6]C[6]2)	121.0180	0.000	1	120.9447	0.063	6	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(NHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(NHP){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8200	0.263	4	120.6495	0.046	13	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(NHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(NHP){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6270	0.136	2	120.6495	0.046	13	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(NHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Pd<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(NHP){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5842	0.154	6	120.6495	0.046	13	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(NHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Pd<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(NHP){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4050	0.000	1	120.6495	0.046	13	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(NPdC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(NPdC){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3610	0.000	1	120.3610	0.000	1	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(NPdN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(NPdN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.9657	0.061	3	120.9657	0.004	3	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(NCC){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3730	0.000	1	120.3730	0.000	1	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(NCH){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.0905	0.218	2	120.0905	0.048	2	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(NCP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(NCP){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2880	0.000	1	120.2880	0.000	1	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(NC[6]C)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(NC[6]C){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3249	0.470	15	120.3249	0.221	15	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(NC[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(NC[6]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2648	0.319	16	120.2364	0.111	21	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(NC[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Pt<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(NC[6]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1456	0.398	5	120.2364	0.111	21	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(NC[6a]2)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(NC[6a]2){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.5780	0.000	1	119.7122	0.042	4	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(NC[6a]2)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(NC[6a]2){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.7570	0.225	3	119.7122	0.042	4	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(NC[6a]C)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(NC[6a]C){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.3465	0.380	2	119.3465	0.144	2	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(NC[6a]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(NC[6a]H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.1010	0.000	1	120.1010	0.000	1	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(NHH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4367	0.624	6	120.2735	0.273	10	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(NHH){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.9677	0.184	3	120.2735	0.273	10	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Pt<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(NHH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2120	0.000	1	120.2735	0.273	10	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(NHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(NHP){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6720	0.363	2	120.6720	0.132	2	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(NCC){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0910	0.000	1	120.9862	0.769	4	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(NCC){1|H<1>,2|C<3>}	H(C[6]C[6]2)	121.2847	0.787	3	120.9862	0.769	4	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(NCH){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3373	0.365	3	120.3373	0.133	3	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(NC[6]C)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(NC[6]C){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2740	0.170	2	120.2740	0.029	2	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(NHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Br<1>,1|Re<6>,1|C<3>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(NHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.7120	0.000	1	120.8246	0.163	5	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(NHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(NHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.8528	0.460	4	120.8246	0.163	5	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(NHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(NHP){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.9370	0.542	2	120.9370	0.293	2	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(NReN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(NReN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0450	0.000	1	120.0450	0.000	1	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Rh<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(NCH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2016	0.213	5	120.2016	0.045	5	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(NC[6]Co)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Rh<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(NC[6]Co){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7495	0.367	2	119.7495	0.135	2	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(NC[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Rh<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(NC[6]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8770	1.245	2	119.8770	1.549	2	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(NC[6]Rh)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Rh<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(NC[6]Rh){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8835	0.286	16	119.8671	0.075	18	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(NC[6]Rh)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Rh<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(NC[6]Rh){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7360	0.092	2	119.8671	0.075	18	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(NC[6a]C)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Rh<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(NC[6a]C){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.6770	0.000	1	120.6770	0.000	1	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(NC[6a]Rh)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Rh<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(NC[6a]Rh){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.6690	0.112	2	119.6690	0.012	2	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(NHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Rh<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(NHP){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	121.2080	0.000	1	120.7699	0.091	7	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(NHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Rh<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(NHP){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6968	0.253	6	120.7699	0.091	7	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NCH){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.4530	0.372	2	120.4471	0.292	7	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NCH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	121.0950	0.000	1	120.4471	0.292	7	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<9>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NCH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9895	0.674	2	120.4471	0.292	7	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<9>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NCH){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5750	0.537	2	120.4471	0.292	7	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NC[5a]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NC[5a]H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.6960	0.000	1	120.6960	0.000	1	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NC[6]2)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<9>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NC[6]2){1|C<3>,2|H<1>}	H(C[6]C[6]2)	122.4400	0.000	2	122.4400	0.000	2	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NC[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NC[6]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0224	0.825	8	120.2473	0.411	15	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NC[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NC[6]H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.4560	0.000	1	120.2473	0.411	15	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NC[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<9>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NC[6]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5125	0.153	6	120.2473	0.411	15	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NC[6]Ru)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NC[6]Ru){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3860	1.195	9	120.3860	1.429	9	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NC[6a]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NC[6a]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0950	0.000	1	120.0950	0.000	1	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NC[6a]Ru)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NC[6a]Ru){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0620	0.399	24	120.0620	0.159	24	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NHH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1440	0.182	2	120.1967	0.025	3	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NHH){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3020	0.000	1	120.1967	0.025	3	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NHP){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.9955	0.153	2	120.7305	0.215	11	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NHP){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.7905	0.561	2	120.7305	0.215	11	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NHP){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8863	0.480	4	120.7305	0.215	11	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NHP){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.8380	0.000	1	120.7305	0.215	11	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NHP){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4990	0.000	1	120.7305	0.215	11	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<9>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NHP){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5820	0.000	1	120.7305	0.215	11	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NRuH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NRuH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2150	0.419	2	120.2150	0.175	2	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NSi2)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NSi2){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.4430	0.476	3	119.4430	0.227	3	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NSiC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NSiC){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7982	0.128	6	120.0654	0.784	20	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NSiC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NSiC){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2289	1.127	12	120.0654	0.784	20	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NSiC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<9>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NSiC){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8860	0.161	2	120.0654	0.784	20	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Sn)(C[6]C[6]H)(NC[6a]Sn)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Sn<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Sn)(C[6]C[6]H)(NC[6a]Sn){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.9395	0.084	2	120.9395	0.007	2	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Sn)(C[6]C[6]H)(NHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Sn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Sn)(C[6]C[6]H)(NHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	121.0640	0.362	2	121.0640	0.131	2	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ta)(C[6]C[6]H)(NC[6a]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ta<9>,1|C<4>,1|H<1>}	C[6](N[6]C[6]Ta)(C[6]C[6]H)(NC[6a]H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3650	0.000	1	120.3650	0.000	1	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(NCH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.8540	0.000	1	120.5273	0.178	20	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(NCH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3170	0.192	2	120.5273	0.178	20	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Zn<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(NCH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.5371	0.458	16	120.5273	0.178	20	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Zn<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(NCH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4650	0.000	1	120.5273	0.178	20	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(NC[5]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Zn<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(NC[5]H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.9875	0.064	2	120.9875	0.004	2	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(NC[6]Cr)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(NC[6]Cr){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8541	0.366	8	119.8541	0.134	8	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(NC[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(NC[6]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9316	1.128	8	120.1145	0.741	14	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(NC[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Zn<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(NC[6]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2790	0.120	2	120.1145	0.741	14	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(NC[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Zn<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(NC[6]H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.4760	0.024	2	120.1145	0.741	14	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(NC[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Zn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(NC[6]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3200	0.204	2	120.1145	0.741	14	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(NC[6a]N)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Zn<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(NC[6a]N){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.7853	0.352	6	120.7853	0.124	6	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(NC[6a]Zn)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Zn<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(NC[6a]Zn){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9730	0.000	1	119.9730	0.000	1	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(NCoC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(NCoC){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7558	0.409	4	119.7558	0.167	4	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Br<1>,1|Zn<4>,1|C<3>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(NHH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8220	0.000	1	120.2639	0.166	19	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Zn<4>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(NHH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8730	0.000	1	120.2639	0.166	19	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(NHH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.4375	0.080	2	120.2639	0.166	19	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(NHH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1348	0.328	10	120.2639	0.166	19	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Zn<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(NHH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.4133	0.370	3	120.2639	0.166	19	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Zn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(NHH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.9285	0.460	2	120.2639	0.166	19	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(NHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Zn<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(NHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.7910	0.044	2	120.8478	0.091	4	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(NHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Zn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(NHN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.9045	0.507	2	120.8478	0.091	4	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(NNiC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(NNiC){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.8910	0.000	1	120.8910	0.000	1	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(NZnC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(NZnC){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.9885	0.186	2	119.9885	0.035	2	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(NC[6a]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|H<1>,2|C<3>}	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(NC[6a]H){2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.0100	0.000	1	120.0100	0.000	1	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]N[6]Re)(C[6]C[6]H)(NCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Re<6>,1|C<3>,1|N<2>}	C[6](N[6]N[6]Re)(C[6]C[6]H)(NCN){1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.1930	0.000	1	120.8215	0.276	2	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]N[6]Re)(C[6]C[6]H)(NCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Re<6>,1|C<4>,1|N<2>}	C[6](N[6]N[6]Re)(C[6]C[6]H)(NCN){1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4500	0.000	1	120.8215	0.276	2	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]N[6]Cl)(C[6]N[6]N)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NHP)	H(C[6]C[6]2)	C[6](C[6]N[6]Cl)(C[6]N[6]N)(H){1|Fe<5>,1|C<3>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NHP){1|Cl<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	122.1530	0.185	2	122.2350	0.037	3	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]N[6]Cl)(C[6]N[6]N)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NHP)	H(C[6]C[6]2)	C[6](C[6]N[6]Cl)(C[6]N[6]N)(H){1|Fe<6>,1|C<3>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(NHP){1|Cl<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	122.3990	0.000	1	122.2350	0.037	3	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]N[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ca)(C[6]C[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]N[6]H)(C[6]N[6]N)(H){1|Ca<10>,1|C<4>,1|H<1>}	C[6](N[6]C[6]Ca)(C[6]C[6]H)(NHH){1|H<1>,1|N<3>,1|O<3>}	H(C[6]C[6]2)	120.9780	0.000	1	121.1795	0.081	2	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]N[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ca)(C[6]C[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]N[6]H)(C[6]N[6]N)(H){1|Ca<8>,1|C<4>,1|H<1>}	C[6](N[6]C[6]Ca)(C[6]C[6]H)(NHH){1|H<1>,1|N<3>,1|O<3>}	H(C[6]C[6]2)	121.3810	0.000	1	121.1795	0.081	2	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]N[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(NC[6]H)	H(C[6]C[6]2)	C[6](C[6]N[6]H)(C[6]N[6]N)(H){1|Co<6>,1|C<3>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(NC[6]H){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	121.3200	0.000	1	121.3200	0.000	1	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]N[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]N[6]H)(C[6]N[6]N)(H){1|Co<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(NHH){1|H<1>,1|N<3>,1|O<1>}	H(C[6]C[6]2)	121.3520	0.144	2	121.3520	0.021	2	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]N[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(NPdH)	H(C[6]C[6]2)	C[6](C[6]N[6]H)(C[6]N[6]N)(H){1|Pd<4>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(NPdH){1|H<1>,1|N<3>,1|O<1>}	H(C[6]C[6]2)	120.3200	0.539	2	120.3200	0.290	2	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]N[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]N[6]H)(C[6]N[6]N)(H){1|Pt<4>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(NHH){1|H<1>,1|N<3>,1|O<1>}	H(C[6]C[6]2)	120.6650	3.509	3	120.6650	12.314	3	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]N[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(NPtH)	H(C[6]C[6]2)	C[6](C[6]N[6]H)(C[6]N[6]N)(H){1|Pt<4>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(NPtH){1|H<1>,1|N<3>,1|O<1>}	H(C[6]C[6]2)	120.5797	1.153	3	120.5797	1.330	3	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]N[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(NCH)	H(C[6]C[6]2)	C[6](C[6]N[6]H)(C[6]N[6]N)(H){1|Re<6>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(NCH){1|H<1>,1|N<3>,1|O<1>}	H(C[6]C[6]2)	120.8080	0.000	1	120.8080	0.000	1	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]N[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]N[6]H)(C[6]N[6]N)(H){1|Zn<4>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(NHH){1|H<1>,1|N<3>,1|O<1>}	H(C[6]C[6]2)	121.1310	0.000	1	121.0880	0.002	3	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]N[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]N[6]H)(C[6]N[6]N)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(NHH){1|H<1>,1|N<3>,1|O<1>}	H(C[6]C[6]2)	121.0665	0.028	2	121.0880	0.002	3	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]N[6]N)(C[6]N[6]O)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(NHH)	H(C[6]C[6]2)	C[6](C[6]N[6]N)(C[6]N[6]O)(H){1|Zn<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(NHH){1|N<3>,1|O<1>,1|S<2>}	H(C[6]C[6]2)	118.0030	0.000	1	118.0030	0.000	1	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]N[6]N)2(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(NCN)	H(C[6]C[6]2)	C[6](C[6]N[6]N)2(H){1|Mn<5>,1|C<3>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(NCN){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	121.6550	0.000	1	121.6550	0.000	1	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]N[6]N)2(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(NCN)	H(C[6]C[6]2)	C[6](C[6]N[6]N)2(H){1|Pd<4>,1|Zn<5>,1|C<3>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(NCN){1|C<4>,2|N<3>}	H(C[6]C[6]2)	121.6910	0.000	1	121.6910	0.000	1	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]N[6]N)2(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(NCN)	H(C[6]C[6]2)	C[6](C[6]N[6]N)2(H){1|Pd<4>,1|Zn<5>,1|C<3>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(NCN){1|C<4>,2|N<3>}	H(C[6]C[6]2)	121.5350	0.000	1	121.5350	0.000	1	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]N[6]N)2(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(NHN)	H(C[6]C[6]2)	C[6](C[6]N[6]N)2(H){2|Zn<6>,1|C<3>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(NHN){1|C<3>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.8780	0.000	1	120.8780	0.000	1	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]N[6]N)2(H)	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(NCC)	H(C[6]C[6]2)	C[6](C[6]N[6]N)2(H){1|Ge<2>,2|C<3>}	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(NCC){2|C<3>,2|N<3>}	H(C[6]C[6]2)	115.6080	0.000	1	115.6080	0.000	1	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]N[6]N)2(H)	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(NCC)	H(C[6]C[6]2)	C[6](C[6]N[6]N)2(H){1|Si<3>,2|C<3>}	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(NCC){1|P<3>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	118.2440	0.000	1	117.0467	1.075	3	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]N[6]N)2(H)	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(NCC)	H(C[6]C[6]2)	C[6](C[6]N[6]N)2(H){1|Si<4>,2|C<3>}	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(NCC){1|H<1>,2|C<3>,3|N<3>}	H(C[6]C[6]2)	116.4480	0.014	2	117.0467	1.075	3	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]N[6]N)2(H)	C[6](N[6]Ge[6]Ge)(C[6]C[6]H)(NCC)	H(C[6]C[6]2)	C[6](C[6]N[6]N)2(H){2|Ge<4>,1|H<1>}	C[6](N[6]Ge[6]Ge)(C[6]C[6]H)(NCC){2|Cl<1>,2|N<3>}	H(C[6]C[6]2)	118.1270	0.000	1	118.1270	0.000	1	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]N[6]N)2(H)	C[6](N[6]Ge[6]H)(C[6]C[6]H)(NCC)	H(C[6]C[6]2)	C[6](C[6]N[6]N)2(H){2|Ge<4>,1|H<1>}	C[6](N[6]Ge[6]H)(C[6]C[6]H)(NCC){2|Cl<1>,2|N<3>}	H(C[6]C[6]2)	118.0860	0.000	1	118.0860	0.000	1	120.3178	0.487	1301	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H)	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(N[5]C[5]2)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H){1|Cu<3>,4|C<3>}	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(N[5]C[5]2){1|Cu<3>,1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.6735	0.280	4	120.8689	0.095	8	121.1634	0.351	169	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H)	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(N[5]C[5]2)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H){1|Cu<4>,4|C<3>}	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(N[5]C[5]2){1|Cu<2>,1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	121.0520	0.270	2	120.8689	0.095	8	121.1634	0.351	169	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H)	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(N[5]C[5]2)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H){1|Cu<4>,4|C<3>}	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(N[5]C[5]2){1|Pd<4>,1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	121.0765	0.218	2	120.8689	0.095	8	121.1634	0.351	169	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H)	C[6](N[6]C[6,6a]Pd)(C[6]C[6]H)(N[5]C[5]2)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H){1|Pd<4>,4|C<3>}	C[6](N[6]C[6,6a]Pd)(C[6]C[6]H)(N[5]C[5]2){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	121.0090	0.000	1	120.5935	0.345	2	121.1634	0.351	169	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H)	C[6](N[6]C[6,6a]Pd)(C[6]C[6]H)(N[5]C[5]2)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H){1|Pd<4>,4|C<3>}	C[6](N[6]C[6,6a]Pd)(C[6]C[6]H)(N[5]C[5]2){1|Pd<4>,1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.1780	0.000	1	120.5935	0.345	2	121.1634	0.351	169	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H)	C[6](N[6]C[6,6a]Rh)(C[6]C[6]H)(N[5]C[5]2)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H){1|Rh<8>,4|C<3>}	C[6](N[6]C[6,6a]Rh)(C[6]C[6]H)(N[5]C[5]2){1|C<4>,1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.9430	0.000	1	121.2140	0.147	2	121.1634	0.351	169	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H)	C[6](N[6]C[6,6a]Rh)(C[6]C[6]H)(N[5]C[5]2)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H){1|Rh<8>,4|C<3>}	C[6](N[6]C[6,6a]Rh)(C[6]C[6]H)(N[5]C[5]2){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	121.4850	0.000	1	121.2140	0.147	2	121.1634	0.351	169	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H)	C[6](N[6]C[6,6a]Ru)(C[6]C[6]H)(N[5]C[5]2)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H){1|Ru<5>,4|C<3>}	C[6](N[6]C[6,6a]Ru)(C[6]C[6]H)(N[5]C[5]2){1|N<2>,1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1790	0.000	1	120.9368	0.452	5	121.1634	0.351	169	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H)	C[6](N[6]C[6,6a]Ru)(C[6]C[6]H)(N[5]C[5]2)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H){1|Ru<6>,4|C<3>}	C[6](N[6]C[6,6a]Ru)(C[6]C[6]H)(N[5]C[5]2){1|C<4>,1|H<1>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.4220	0.000	1	120.9368	0.452	5	121.1634	0.351	169	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H)	C[6](N[6]C[6,6a]Ru)(C[6]C[6]H)(N[5]C[5]2)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H){1|Ru<6>,4|C<3>}	C[6](N[6]C[6,6a]Ru)(C[6]C[6]H)(N[5]C[5]2){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	121.3610	0.464	3	120.9368	0.452	5	121.1634	0.351	169	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H)	C[6](N[6]C[6,6a]W)(C[6]C[6]H)(N[5]C[5]2)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H){1|W<6>,4|C<3>}	C[6](N[6]C[6,6a]W)(C[6]C[6]H)(N[5]C[5]2){1|N<2>,1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5330	0.000	1	120.5330	0.000	1	121.1634	0.351	169	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[5]N[6])(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(N[5]C[5]2)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[5]N[6])(H){1|Ru<6>,1|H<1>,1|N<2>,4|C<3>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(N[5]C[5]2){1|H<1>,2|N<3>,3|C<3>}	H(C[6]C[6]2)	120.3150	0.492	4	120.3150	0.242	4	121.1634	0.351	169	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]C)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(N[5]C[5]2)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]C)(H){1|Ir<6>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(N[5]C[5]2){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4480	0.000	1	120.4480	0.000	1	121.1634	0.351	169	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]C)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(N[5]C[5]2)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]C)(H){1|Pd<4>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(N[5]C[5]2){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4190	0.000	1	120.4190	0.000	1	121.1634	0.351	169	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(N[5]C[5]2)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]C)(H){1|Ru<6>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(N[5]C[5]2){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4180	0.000	1	120.4180	0.000	1	121.1634	0.351	169	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Ba)(C[6]C[6]H)(N[5]C[5]2)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ba<7>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Ba)(C[6]C[6]H)(N[5]C[5]2){2|C<3>,2|H<1>,2|N<3>}	H(C[6]C[6]2)	121.3245	0.129	2	121.3245	0.017	2	121.1634	0.351	169	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Ca)(C[6]C[6]H)(N[5]C[5]2)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ca<6>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Ca)(C[6]C[6]H)(N[5]C[5]2){2|C<3>,2|H<1>,2|N<3>}	H(C[6]C[6]2)	121.6280	0.294	6	121.6280	0.087	6	121.1634	0.351	169	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Cr)(C[6]C[6]H)(N[5]C[5]2)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Cr<4>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Cr)(C[6]C[6]H)(N[5]C[5]2){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	122.0800	0.000	2	122.0800	0.000	2	121.1634	0.351	169	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(N[5]C[5]2)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Cu<3>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(N[5]C[5]2){1|Cu<3>,1|N<3>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	121.0750	0.000	1	121.0750	0.000	1	121.1634	0.351	169	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(N[5]C[5]2)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Fe<5>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(N[5]C[5]2){1|N<3>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	120.2580	0.000	1	121.1969	0.141	24	121.1634	0.351	169	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(N[5]C[5]2)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Fe<5>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(N[5]C[5]2){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	121.7563	0.219	3	121.1969	0.141	24	121.1634	0.351	169	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(N[5]C[5]2)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Fe<5>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(N[5]C[5]2){2|C<3>,2|H<1>,2|N<3>}	H(C[6]C[6]2)	120.8945	0.074	4	121.1969	0.141	24	121.1634	0.351	169	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(N[5]C[5]2)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(N[5]C[5]2){1|N<3>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	121.1189	0.192	8	121.1969	0.141	24	121.1634	0.351	169	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(N[5]C[5]2)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(N[5]C[5]2){2|C<3>,2|H<1>,2|N<3>}	H(C[6]C[6]2)	121.3336	0.265	8	121.1969	0.141	24	121.1634	0.351	169	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(N[5]C[5]2)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|C<4>,1|H<1>,2|C<3>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(N[5]C[5]2){1|C<3>,1|C<4>,1|N<3>,4|H<1>}	H(C[6]C[6]2)	121.4070	0.000	1	121.4414	0.026	10	121.1634	0.351	169	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(N[5]C[5]2)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|C<4>,1|H<1>,2|C<3>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(N[5]C[5]2){1|C<3>,2|C<4>,4|H<1>}	H(C[6]C[6]2)	121.4450	0.000	1	121.4414	0.026	10	121.1634	0.351	169	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(N[5]C[5]2)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(N[5]C[5]2){1|N<3>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	121.3110	0.000	1	121.4414	0.026	10	121.1634	0.351	169	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(N[5]C[5]2)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(N[5]C[5]2){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	121.4333	0.101	3	121.4414	0.026	10	121.1634	0.351	169	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(N[5]C[5]2)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ir<8>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(N[5]C[5]2){1|N<3>,1|O<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	121.5997	0.128	3	121.4414	0.026	10	121.1634	0.351	169	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(N[5]C[5]2)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ir<8>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(N[5]C[5]2){1|N<3>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	121.1520	0.000	1	121.4414	0.026	10	121.1634	0.351	169	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Li)(C[6]C[6]H)(N[5]C[5]2)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Li<4>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Li)(C[6]C[6]H)(N[5]C[5]2){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	122.3095	0.062	2	122.3095	0.004	2	121.1634	0.351	169	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Mg)(C[6]C[6]H)(N[5]C[5]2)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Mg<6>,1|C<4>,1|H<1>,2|C<3>}	C[6](N[6]C[6]Mg)(C[6]C[6]H)(N[5]C[5]2){1|C<3>,1|C<4>,2|N<3>,3|H<1>}	H(C[6]C[6]2)	121.4110	0.061	2	121.4110	0.004	2	121.1634	0.351	169	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(N[5]C[5]2)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Mn<6>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(N[5]C[5]2){1|N<3>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	121.1270	0.075	3	121.1270	0.006	3	121.1634	0.351	169	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(N[5]C[5]2)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(N[5]C[5]2){2|C<3>,2|H<1>,2|N<3>}	H(C[6]C[6]2)	121.9610	0.000	1	121.9610	0.000	1	121.1634	0.351	169	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Os)(C[6]C[6]H)(N[5]C[5]2)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Os<9>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Os)(C[6]C[6]H)(N[5]C[5]2){1|N<3>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	120.9330	0.000	1	120.9330	0.000	1	121.1634	0.351	169	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(N[5]C[5]2)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|C<4>,1|H<1>,2|C<3>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(N[5]C[5]2){1|C<4>,2|C<3>,2|H<1>,2|N<3>}	H(C[6]C[6]2)	120.8740	0.000	2	121.2743	0.198	20	121.1634	0.351	169	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(N[5]C[5]2)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|C<4>,3|C<3>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(N[5]C[5]2){1|N<3>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	120.9180	0.000	1	121.2743	0.198	20	121.1634	0.351	169	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(N[5]C[5]2)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(N[5]C[5]2){1|N<3>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	121.2291	0.472	11	121.2743	0.198	20	121.1634	0.351	169	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(N[5]C[5]2)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(N[5]C[5]2){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	121.5360	0.000	1	121.2743	0.198	20	121.1634	0.351	169	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(N[5]C[5]2)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(N[5]C[5]2){2|C<3>,2|H<1>,2|N<3>}	H(C[6]C[6]2)	121.6432	0.389	4	121.2743	0.198	20	121.1634	0.351	169	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(N[5]C[5]2)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|N<3>,3|C<3>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(N[5]C[5]2){1|N<3>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	121.1910	0.000	1	121.2743	0.198	20	121.1634	0.351	169	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(N[5]C[5]2)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Re<6>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(N[5]C[5]2){1|N<3>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	121.3214	0.459	8	121.3214	0.211	8	121.1634	0.351	169	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(N[5]C[5]2)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Rh<5>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(N[5]C[5]2){1|N<3>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	120.9300	0.274	2	121.1411	0.122	7	121.1634	0.351	169	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(N[5]C[5]2)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Rh<6>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(N[5]C[5]2){1|N<3>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	121.4587	0.211	3	121.1411	0.122	7	121.1634	0.351	169	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(N[5]C[5]2)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Rh<8>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(N[5]C[5]2){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.7430	0.000	1	121.1411	0.122	7	121.1634	0.351	169	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(N[5]C[5]2)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Rh<8>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(N[5]C[5]2){1|N<3>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	121.0090	0.000	1	121.1411	0.122	7	121.1634	0.351	169	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(N[5]C[5]2)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(N[5]C[5]2){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	121.2047	0.099	4	121.0232	0.638	47	121.1634	0.351	169	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(N[5]C[5]2)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(N[5]C[5]2){1|N<3>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	120.9652	0.524	11	121.0232	0.638	47	121.1634	0.351	169	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(N[5]C[5]2)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(N[5]C[5]2){2|C<3>,2|H<1>,2|N<3>}	H(C[6]C[6]2)	120.9741	1.017	26	121.0232	0.638	47	121.1634	0.351	169	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(N[5]C[5]2)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ru<9>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(N[5]C[5]2){1|C<3>,1|N<2>,1|N<3>,3|H<1>}	H(C[6]C[6]2)	121.2130	0.000	1	121.0232	0.638	47	121.1634	0.351	169	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(N[5]C[5]2)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ru<9>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(N[5]C[5]2){1|N<3>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	121.2840	0.181	3	121.0232	0.638	47	121.1634	0.351	169	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(N[5]C[5]2)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ru<9>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(N[5]C[5]2){2|C<3>,2|H<1>,2|N<3>}	H(C[6]C[6]2)	121.4220	0.000	1	121.0232	0.638	47	121.1634	0.351	169	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(N[5]C[5]2)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Ru<9>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(N[5]C[5]2){2|C<3>,2|N<3>,3|H<1>}	H(C[6]C[6]2)	120.8400	0.000	1	121.0232	0.638	47	121.1634	0.351	169	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]C[6]Sr)(C[6]C[6]H)(N[5]C[5]2)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Sr<7>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Sr)(C[6]C[6]H)(N[5]C[5]2){2|C<3>,2|H<1>,2|N<3>}	H(C[6]C[6]2)	121.3385	0.045	2	121.3385	0.002	2	121.1634	0.351	169	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[6]N[6]Pd)(C[6]C[6]H)(N[5]C[5]2)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|N<2>,1|O<2>,2|C<3>}	C[6](N[6]N[6]Pd)(C[6]C[6]H)(N[5]C[5]2){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	121.6640	0.000	1	121.6640	0.000	1	121.1634	0.351	169	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]O)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(N[5]C[5]2)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]O)(H){1|Pd<4>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(N[5]C[5]2){1|N<3>,1|O<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	121.4990	0.262	3	121.4990	0.068	3	121.1634	0.351	169	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N[5]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]O)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(N[5]C[5]2)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]O)(H){1|Ru<6>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(N[5]C[5]2){1|H<1>,1|O<2>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	121.4005	0.156	2	121.4005	0.024	2	121.1634	0.351	169	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]2)(H)	C[6](N[6]C[6,6a]Cd)(C[6]C[6]H)(N[6]C[6]2)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]2)(H){1|Cd<5>,4|C<3>}	C[6](N[6]C[6,6a]Cd)(C[6]C[6]H)(N[6]C[6]2){1|O<2>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.5520	0.000	1	120.9640	0.339	2	120.7707	0.282	3	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]2)(H)	C[6](N[6]C[6,6a]Cd)(C[6]C[6]H)(N[6]C[6]2)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]2)(H){1|Cd<6>,4|C<3>}	C[6](N[6]C[6,6a]Cd)(C[6]C[6]H)(N[6]C[6]2){1|O<2>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	121.3760	0.000	1	120.9640	0.339	2	120.7707	0.282	3	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]2)(H)	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(N[6]C[6]2)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]2)(H){1|Cu<5>,4|C<3>}	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(N[6]C[6]2){1|O<2>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.3840	0.000	1	120.3840	0.000	1	120.7707	0.282	3	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:P-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	C[6](N[6]C[6]Ag)(C[6]C[6]H)(PPP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Ag<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ag)(C[6]C[6]H)(PPP){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0970	0.000	1	120.0970	0.000	1	120.0644	0.456	28	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:P-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(PC[6]2)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(PC[6]2){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0934	0.161	8	120.0934	0.026	8	120.0644	0.456	28	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:P-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(PC[6a]2)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Fe<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(PC[6a]2){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.4090	0.139	2	120.4090	0.019	2	120.0644	0.456	28	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:P-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	C[6](N[6]C[6]Li)(C[6]C[6]H)(PC[6]N)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Li<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Li)(C[6]C[6]H)(PC[6]N){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4910	0.123	2	120.4910	0.015	2	120.0644	0.456	28	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:P-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	C[6](N[6]C[6]Li)(C[6]C[6]H)(PC[6]O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Li<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Li)(C[6]C[6]H)(PC[6]O){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.8620	0.110	2	120.8620	0.012	2	120.0644	0.456	28	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:P-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	C[6](N[6]C[6]Mo)(C[6]C[6]H)(PC[6]2)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Mo<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mo)(C[6]C[6]H)(PC[6]2){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	118.6430	0.990	3	118.6430	0.980	3	120.0644	0.456	28	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:P-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(PC[6a]2)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(PC[6a]2){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.9170	0.000	1	120.9170	0.000	1	120.0644	0.456	28	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:P-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(PC[6]2)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Zn<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(PC[6]2){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.2022	0.187	4	120.2022	0.035	4	120.0644	0.456	28	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:P-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(PC[6a]2)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(PC[6a]2){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0190	0.000	1	120.0190	0.000	1	120.0644	0.456	28	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:P-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(PC[6a]2)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|H<1>,2|C<3>}	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(PC[6a]2){2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.5320	0.000	1	119.5320	0.000	1	120.0644	0.456	28	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:P-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(PCl2)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|H<1>,2|C<3>}	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(PCl2){1|N<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7620	0.000	1	119.7620	0.000	1	120.0644	0.456	28	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:P-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(PN[5a]2)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|H<1>,2|C<3>}	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(PN[5a]2){1|N<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2340	0.919	2	120.2340	0.845	2	120.0644	0.456	28	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:S-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(SCu2)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(SCu2){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7670	0.000	1	119.7670	0.000	1	120.5665	0.977	14	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:S-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](N[6]C[6]Mo)(C[6]C[6]H)(SMnMo)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Mo<9>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mo)(C[6]C[6]H)(SMnMo){1|C<3>,2|H<1>}	H(C[6]C[6]2)	121.4610	0.000	1	121.4610	0.000	1	120.5665	0.977	14	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:S-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](N[6]C[6]Mo)(C[6]C[6]H)(SMo2)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Mo<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mo)(C[6]C[6]H)(SMo2){1|C<3>,2|H<1>}	H(C[6]C[6]2)	121.0420	0.000	1	121.2005	0.050	2	120.5665	0.977	14	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:S-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](N[6]C[6]Mo)(C[6]C[6]H)(SMo2)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Mo<9>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mo)(C[6]C[6]H)(SMo2){1|C<3>,2|H<1>}	H(C[6]C[6]2)	121.3590	0.000	1	121.2005	0.050	2	120.5665	0.977	14	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:S-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(SNi2)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(SNi2){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.7930	0.520	4	120.7930	0.270	4	120.5665	0.977	14	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:S-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(SCO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(SCO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	121.0370	0.000	1	121.0370	0.000	1	120.5665	0.977	14	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:S-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(SC[6a]O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(SC[6a]O){1|C<3>,2|H<1>}	H(C[6]C[6]2)	121.0590	0.315	2	121.0590	0.099	2	120.5665	0.977	14	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:S-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(SOs2)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(SOs2){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1245	0.350	2	120.1245	0.123	2	120.5665	0.977	14	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:S-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(SRh2)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Rh<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(SRh2){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	117.7260	0.000	1	117.7260	0.000	1	120.5665	0.977	14	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]C[6a])(C[6]C[6a]N[6])(H)	C[6](N[6]C[6,6a]Ir)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C[6a])(C[6]C[6a]N[6])(H){1|Ir<6>,6|C<3>}	C[6](N[6]C[6,6a]Ir)(C[6a]C[6a]2)(C[6]C[6]H){1|H<1>,5|C<3>}	H(C[6]C[6]2)	118.6730	0.099	2	118.6730	0.010	2	119.5175	0.738	194	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]C[6a])(C[6]C[6a]N[6])(H)	C[6](N[6]C[6,6a]Pt)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C[6a])(C[6]C[6a]N[6])(H){1|Pt<4>,6|C<3>}	C[6](N[6]C[6,6a]Pt)(C[6a]C[6a]2)(C[6]C[6]H){1|H<1>,5|C<3>}	H(C[6]C[6]2)	116.4975	4.864	2	116.4975	23.660	2	119.5175	0.738	194	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]Cl)(C[6]C[6a]N[6])(H)	C[6](N[6]C[6,6a]Ir)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]Cl)(C[6]C[6a]N[6])(H){1|Ir<8>,4|C<3>}	C[6](N[6]C[6,6a]Ir)(C[6a]C[6a]2)(C[6]C[6]H){1|Cl<1>,1|H<1>,4|C<3>}	H(C[6]C[6]2)	120.2640	0.000	1	120.2640	0.000	1	119.5175	0.738	194	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H)	C[6](N[6]C[6]N[5])(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H){1|H<1>,1|N<3>,5|C<3>}	C[6](N[6]C[6]N[5])(C[6a]C[6a]2)(C[6]C[6]H){2|H<1>,7|C<3>}	H(C[6]C[6]2)	118.7335	0.271	2	118.7335	0.073	2	119.5175	0.738	194	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H)	C[6](N[6]C[6a]C[6])(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H){1|H<1>,6|C<3>}	C[6](N[6]C[6a]C[6])(C[6a]C[6a]2)(C[6]C[6]H){2|H<1>,7|C<3>}	H(C[6]C[6]2)	119.0685	0.031	4	119.0685	0.001	4	119.5175	0.738	194	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[5,6]H)(H)	C[6](N[6]C[5,6]Co)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[5,6]H)(H){1|Ru<10>,1|Co<4>,2|C<3>,2|C<4>}	C[6](N[6]C[5,6]Co)(C[6a]C[6a]2)(C[6]C[6]H){1|Ru<10>,1|H<1>,2|C<3>,4|C<4>}	H(C[6]C[6]2)	118.6277	0.455	4	118.6277	0.207	4	119.5175	0.738	194	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[5,6]H)(H)	C[6](N[6]C[5,6]Cu)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[5,6]H)(H){1|Ru<10>,1|Cu<2>,2|C<3>,2|C<4>}	C[6](N[6]C[5,6]Cu)(C[6a]C[6a]2)(C[6]C[6]H){1|Ru<10>,1|H<1>,2|C<3>,4|C<4>}	H(C[6]C[6]2)	119.2650	0.301	2	119.2650	0.091	2	119.5175	0.738	194	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[5,6]H)(H)	C[6](N[6]C[5,6]Fe)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[5,6]H)(H){1|Ru<10>,1|Fe<4>,2|C<3>,2|C<4>}	C[6](N[6]C[5,6]Fe)(C[6a]C[6a]2)(C[6]C[6]H){1|Ru<10>,1|H<1>,2|C<3>,4|C<4>}	H(C[6]C[6]2)	118.6010	0.117	2	118.6010	0.014	2	119.5175	0.738	194	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[5,6]H)(H)	C[6](N[6]C[5,6]Ir)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[5,6]H)(H){1|Ir<6>,1|C<4>,3|C<3>}	C[6](N[6]C[5,6]Ir)(C[6a]C[6a]2)(C[6]C[6]H){3|H<1>,4|C<3>}	H(C[6]C[6]2)	119.1030	0.000	1	119.1030	0.000	1	119.5175	0.738	194	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[5,6]H)(H)	C[6](N[6]C[5,6]Pt)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[5,6]H)(H){1|Pt<4>,1|C<4>,3|C<3>}	C[6](N[6]C[5,6]Pt)(C[6a]C[6a]2)(C[6]C[6]H){1|H<1>,2|C<4>,4|C<3>}	H(C[6]C[6]2)	118.9740	0.079	2	118.7748	0.080	4	119.5175	0.738	194	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[5,6]H)(H)	C[6](N[6]C[5,6]Pt)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[5,6]H)(H){1|Pt<4>,4|C<3>}	C[6](N[6]C[5,6]Pt)(C[6a]C[6a]2)(C[6]C[6]H){1|H<1>,2|C<4>,4|C<3>}	H(C[6]C[6]2)	118.5755	0.274	2	118.7748	0.080	4	119.5175	0.738	194	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[5]C[6])(H)	C[6](N[6]C[6a]C[6])(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[5]C[6])(H){1|C<4>,1|H<1>,1|N<3>,4|C<3>}	C[6](N[6]C[6a]C[6])(C[6a]C[6a]2)(C[6]C[6]H){2|H<1>,7|C<3>}	H(C[6]C[6]2)	118.9785	0.015	2	118.9785	0.000	2	119.5175	0.738	194	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6,6]H)(H)	C[6](N[6]C[6,6]Ni)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6,6]H)(H){1|Ni<4>,1|C<4>,3|C<3>}	C[6](N[6]C[6,6]Ni)(C[6a]C[6a]2)(C[6]C[6]H){1|O<2>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.0045	0.091	2	119.2817	0.235	3	119.5175	0.738	194	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6,6]H)(H)	C[6](N[6]C[6,6]Ni)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6,6]H)(H){1|Ni<4>,1|C<4>,3|C<3>}	C[6](N[6]C[6,6]Ni)(C[6a]C[6a]2)(C[6]C[6]H){3|H<1>,4|C<3>}	H(C[6]C[6]2)	119.8360	0.000	1	119.2817	0.235	3	119.5175	0.738	194	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6,6]H)(H)	C[6](N[6]C[6,6]Pd)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6,6]H)(H){1|Pd<4>,1|C<4>,3|C<3>}	C[6](N[6]C[6,6]Pd)(C[6a]C[6a]2)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.9933	0.169	3	119.9933	0.029	3	119.5175	0.738	194	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6,6]H)(H)	C[6](N[6]C[6,6]Rh)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6,6]H)(H){1|Rh<5>,4|C<3>}	C[6](N[6]C[6,6]Rh)(C[6a]C[6a]2)(C[6]C[6]H){1|Cl<1>,1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	119.2410	0.000	1	119.2410	0.000	1	119.5175	0.738	194	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]C)(H)	C[6](N[6]C[6,6a]Cu)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]C)(H){1|Cu<4>,4|C<3>}	C[6](N[6]C[6,6a]Cu)(C[6a]C[6a]2)(C[6]C[6]H){1|C<4>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	118.7975	0.114	2	118.7975	0.013	2	119.5175	0.738	194	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]C)(H)	C[6](N[6]C[6,6a]Ir)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]C)(H){1|Ir<6>,4|C<3>}	C[6](N[6]C[6,6a]Ir)(C[6a]C[6a]2)(C[6]C[6]H){1|C<4>,1|H<1>,4|C<3>}	H(C[6]C[6]2)	118.9815	0.045	2	119.1950	0.172	4	119.5175	0.738	194	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]C)(H)	C[6](N[6]C[6,6a]Ir)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]C)(H){1|Ir<6>,4|C<3>}	C[6](N[6]C[6,6a]Ir)(C[6a]C[6a]2)(C[6]C[6]H){1|H<1>,5|C<3>}	H(C[6]C[6]2)	119.4085	0.576	2	119.1950	0.172	4	119.5175	0.738	194	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]C)(H)	C[6](N[6]C[6,6a]Pd)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]C)(H){1|Pd<4>,4|C<3>}	C[6](N[6]C[6,6a]Pd)(C[6a]C[6a]2)(C[6]C[6]H){2|H<1>,5|C<3>}	H(C[6]C[6]2)	119.4250	0.000	1	119.4250	0.000	1	119.5175	0.738	194	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]C)(H)	C[6](N[6]C[6,6a]Pt)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]C)(H){1|Pt<4>,4|C<3>}	C[6](N[6]C[6,6a]Pt)(C[6a]C[6a]2)(C[6]C[6]H){1|C<4>,1|H<1>,4|C<3>}	H(C[6]C[6]2)	118.7070	0.000	1	119.3436	0.258	5	119.5175	0.738	194	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]C)(H)	C[6](N[6]C[6,6a]Pt)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]C)(H){1|Pt<4>,4|C<3>}	C[6](N[6]C[6,6a]Pt)(C[6a]C[6a]2)(C[6]C[6]H){1|H<1>,5|C<3>}	H(C[6]C[6]2)	119.5027	0.419	4	119.3436	0.258	5	119.5175	0.738	194	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H)	C[6](N[6]C[6,6a]Ag)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H){1|Ag<4>,4|C<3>}	C[6](N[6]C[6,6a]Ag)(C[6a]C[6a]2)(C[6]C[6]H){1|H<1>,2|O<2>,4|C<3>}	H(C[6]C[6]2)	117.3180	0.000	1	117.3180	0.000	1	119.5175	0.738	194	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H)	C[6](N[6]C[6,6a]Au)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H){1|Au<4>,4|C<3>}	C[6](N[6]C[6,6a]Au)(C[6a]C[6a]2)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	121.7170	0.000	1	121.7170	0.000	1	119.5175	0.738	194	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H)	C[6](N[6]C[6,6a]Co)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H){1|Co<4>,4|C<3>}	C[6](N[6]C[6,6a]Co)(C[6a]C[6a]2)(C[6]C[6]H){1|H<1>,2|C<4>,4|C<3>}	H(C[6]C[6]2)	119.1075	0.226	2	119.6523	0.195	6	119.5175	0.738	194	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H)	C[6](N[6]C[6,6a]Co)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H){1|Co<4>,4|C<3>}	C[6](N[6]C[6,6a]Co)(C[6a]C[6a]2)(C[6]C[6]H){3|H<1>,4|C<3>}	H(C[6]C[6]2)	119.9248	0.106	4	119.6523	0.195	6	119.5175	0.738	194	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H)	C[6](N[6]C[6,6a]Cr)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H){1|Cr<6>,4|C<3>}	C[6](N[6]C[6,6a]Cr)(C[6a]C[6a]2)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.2640	0.000	1	119.7127	0.232	3	119.5175	0.738	194	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H)	C[6](N[6]C[6,6a]Cr)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H){1|Cr<6>,4|C<3>}	C[6](N[6]C[6,6a]Cr)(C[6a]C[6a]2)(C[6]C[6]H){3|H<1>,4|C<3>}	H(C[6]C[6]2)	119.4370	0.095	2	119.7127	0.232	3	119.5175	0.738	194	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H)	C[6](N[6]C[6,6a]Cu)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H){1|Cu<3>,4|C<3>}	C[6](N[6]C[6,6a]Cu)(C[6a]C[6a]2)(C[6]C[6]H){1|H<1>,2|C<4>,4|C<3>}	H(C[6]C[6]2)	120.0418	0.264	4	119.9488	0.092	30	119.5175	0.738	194	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H)	C[6](N[6]C[6,6a]Cu)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H){1|Cu<4>,4|C<3>}	C[6](N[6]C[6,6a]Cu)(C[6a]C[6a]2)(C[6]C[6]H){1|C<4>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.9940	0.246	4	119.9488	0.092	30	119.5175	0.738	194	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H)	C[6](N[6]C[6,6a]Cu)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H){1|Cu<4>,4|C<3>}	C[6](N[6]C[6,6a]Cu)(C[6a]C[6a]2)(C[6]C[6]H){1|H<1>,2|C<4>,4|C<3>}	H(C[6]C[6]2)	120.0053	0.230	13	119.9488	0.092	30	119.5175	0.738	194	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H)	C[6](N[6]C[6,6a]Cu)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H){1|Cu<4>,4|C<3>}	C[6](N[6]C[6,6a]Cu)(C[6a]C[6a]2)(C[6]C[6]H){1|H<1>,2|O<2>,4|C<3>}	H(C[6]C[6]2)	120.0730	0.093	2	119.9488	0.092	30	119.5175	0.738	194	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H)	C[6](N[6]C[6,6a]Cu)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H){1|Cu<4>,4|C<3>}	C[6](N[6]C[6,6a]Cu)(C[6a]C[6a]2)(C[6]C[6]H){1|O<2>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.1120	0.000	1	119.9488	0.092	30	119.5175	0.738	194	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H)	C[6](N[6]C[6,6a]Cu)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H){1|Cu<4>,4|C<3>}	C[6](N[6]C[6,6a]Cu)(C[6a]C[6a]2)(C[6]C[6]H){3|H<1>,4|C<3>}	H(C[6]C[6]2)	119.8322	0.384	6	119.9488	0.092	30	119.5175	0.738	194	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H)	C[6](N[6]C[6,6a]Fe)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H){1|Fe<6>,4|C<3>}	C[6](N[6]C[6,6a]Fe)(C[6a]C[6a]2)(C[6]C[6]H){3|H<1>,4|C<3>}	H(C[6]C[6]2)	119.7242	0.388	4	119.7242	0.150	4	119.5175	0.738	194	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H)	C[6](N[6]C[6,6a]H)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H){1|H<1>,4|C<3>}	C[6](N[6]C[6,6a]H)(C[6a]C[6a]2)(C[6]C[6]H){3|H<1>,4|C<3>}	H(C[6]C[6]2)	119.6844	0.100	5	119.6844	0.010	5	119.5175	0.738	194	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H)	C[6](N[6]C[6,6a]Ir)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H){1|Ir<4>,4|C<3>}	C[6](N[6]C[6,6a]Ir)(C[6a]C[6a]2)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.1590	0.332	3	119.7745	0.143	42	119.5175	0.738	194	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H)	C[6](N[6]C[6,6a]Ir)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H){1|Ir<5>,4|C<3>}	C[6](N[6]C[6,6a]Ir)(C[6a]C[6a]2)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.1685	0.125	2	119.7745	0.143	42	119.5175	0.738	194	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H)	C[6](N[6]C[6,6a]Ir)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H){1|Ir<6>,4|C<3>}	C[6](N[6]C[6,6a]Ir)(C[6a]C[6a]2)(C[6]C[6]H){1|F<1>,1|H<1>,4|C<3>}	H(C[6]C[6]2)	120.0080	0.000	1	119.7745	0.143	42	119.5175	0.738	194	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H)	C[6](N[6]C[6,6a]Ir)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H){1|Ir<6>,4|C<3>}	C[6](N[6]C[6,6a]Ir)(C[6a]C[6a]2)(C[6]C[6]H){1|N<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.8860	0.000	1	119.7745	0.143	42	119.5175	0.738	194	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H)	C[6](N[6]C[6,6a]Ir)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H){1|Ir<6>,4|C<3>}	C[6](N[6]C[6,6a]Ir)(C[6a]C[6a]2)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.6926	0.362	32	119.7745	0.143	42	119.5175	0.738	194	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H)	C[6](N[6]C[6,6a]Ir)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H){1|Ir<7>,4|C<3>}	C[6](N[6]C[6,6a]Ir)(C[6a]C[6a]2)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.6740	0.440	2	119.7745	0.143	42	119.5175	0.738	194	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H)	C[6](N[6]C[6,6a]Ir)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H){1|Ir<8>,4|C<3>}	C[6](N[6]C[6,6a]Ir)(C[6a]C[6a]2)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.3120	0.000	1	119.7745	0.143	42	119.5175	0.738	194	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H)	C[6](N[6]C[6,6a]Ni)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H){1|Ni<3>,4|C<3>}	C[6](N[6]C[6,6a]Ni)(C[6a]C[6a]2)(C[6]C[6]H){1|H<1>,2|C<4>,4|C<3>}	H(C[6]C[6]2)	119.4823	0.185	7	119.5049	0.033	8	119.5175	0.738	194	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H)	C[6](N[6]C[6,6a]Ni)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H){1|Ni<4>,4|C<3>}	C[6](N[6]C[6,6a]Ni)(C[6a]C[6a]2)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.6630	0.000	1	119.5049	0.033	8	119.5175	0.738	194	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H)	C[6](N[6]C[6,6a]O)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H){1|O<1>,4|C<3>}	C[6](N[6]C[6,6a]O)(C[6a]C[6a]2)(C[6]C[6]H){3|H<1>,4|C<3>}	H(C[6]C[6]2)	119.0020	0.048	2	119.0020	0.002	2	119.5175	0.738	194	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H)	C[6](N[6]C[6,6a]Pd)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H){1|Pd<4>,4|C<3>}	C[6](N[6]C[6,6a]Pd)(C[6a]C[6a]2)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.0720	0.000	1	119.7985	0.150	2	119.5175	0.738	194	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H)	C[6](N[6]C[6,6a]Pd)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H){1|Pd<4>,4|C<3>}	C[6](N[6]C[6,6a]Pd)(C[6a]C[6a]2)(C[6]C[6]H){3|H<1>,4|C<3>}	H(C[6]C[6]2)	119.5250	0.000	1	119.7985	0.150	2	119.5175	0.738	194	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H)	C[6](N[6]C[6,6a]Pt)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H){1|Pt<4>,4|C<3>}	C[6](N[6]C[6,6a]Pt)(C[6a]C[6a]2)(C[6]C[6]H){1|O<2>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.4443	0.532	3	119.5884	0.103	9	119.5175	0.738	194	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H)	C[6](N[6]C[6,6a]Pt)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H){1|Pt<4>,4|C<3>}	C[6](N[6]C[6,6a]Pt)(C[6a]C[6a]2)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.7880	0.075	3	119.5884	0.103	9	119.5175	0.738	194	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H)	C[6](N[6]C[6,6a]Pt)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H){1|Pt<4>,4|C<3>}	C[6](N[6]C[6,6a]Pt)(C[6a]C[6a]2)(C[6]C[6]H){3|H<1>,4|C<3>}	H(C[6]C[6]2)	119.5330	0.164	3	119.5884	0.103	9	119.5175	0.738	194	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H)	C[6](N[6]C[6,6a]Re)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H){1|Re<6>,4|C<3>}	C[6](N[6]C[6,6a]Re)(C[6a]C[6a]2)(C[6]C[6]H){3|H<1>,4|C<3>}	H(C[6]C[6]2)	119.6065	0.750	2	119.6065	0.563	2	119.5175	0.738	194	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H)	C[6](N[6]C[6,6a]Ru)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H){1|Ru<6>,4|C<3>}	C[6](N[6]C[6,6a]Ru)(C[6a]C[6a]2)(C[6]C[6]H){3|H<1>,4|C<3>}	H(C[6]C[6]2)	120.1420	0.215	4	120.1420	0.046	4	119.5175	0.738	194	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H)	C[6](N[6]C[6,6a]Zn)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H){1|Zn<4>,4|C<3>}	C[6](N[6]C[6,6a]Zn)(C[6a]C[6a]2)(C[6]C[6]H){3|H<1>,4|C<3>}	H(C[6]C[6]2)	120.1110	0.158	2	119.9524	0.087	8	119.5175	0.738	194	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H)	C[6](N[6]C[6,6a]Zn)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H){1|Zn<5>,4|C<3>}	C[6](N[6]C[6,6a]Zn)(C[6a]C[6a]2)(C[6]C[6]H){1|O<2>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.7200	0.211	2	119.9524	0.087	8	119.5175	0.738	194	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H)	C[6](N[6]C[6,6a]Zn)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]H)(H){1|Zn<5>,4|C<3>}	C[6](N[6]C[6,6a]Zn)(C[6a]C[6a]2)(C[6]C[6]H){1|O<3>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.9892	0.352	4	119.9524	0.087	8	119.5175	0.738	194	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]2)(H)	C[6](N[6]C[6a]C[6])(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]2)(H){1|H<1>,2|N<3>,4|C<3>}	C[6](N[6]C[6a]C[6])(C[6a]C[6a]2)(C[6]C[6]H){2|H<1>,7|C<3>}	H(C[6]C[6]2)	118.5220	0.297	2	118.5220	0.088	2	119.5175	0.738	194	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H)	C[6](N[6]C[6a]C[6])(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H){1|H<1>,4|C<3>}	C[6](N[6]C[6a]C[6])(C[6a]C[6a]2)(C[6]C[6]H){1|Ir<6>,1|C<4>,1|N<2>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.2410	0.000	1	120.2410	0.000	1	119.5175	0.738	194	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](N[6]B[5a]C[6])(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(H){1|B<3>,1|H<1>,3|C<3>}	C[6](N[6]B[5a]C[6])(C[6a]C[6a]2)(C[6]C[6]H){1|H<1>,2|C<4>,2|O<2>,4|C<3>}	H(C[6]C[6]2)	118.6805	0.547	2	118.6805	0.299	2	119.5175	0.738	194	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]O)(H)	C[6](N[6]C[6a]C[6])(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]O)(H){1|C<4>,1|H<1>,4|C<3>}	C[6](N[6]C[6a]C[6])(C[6a]C[6a]2)(C[6]C[6]H){1|C<4>,1|O<1>,1|O<2>,3|H<1>,4|C<3>}	H(C[6]C[6]2)	123.9360	0.000	1	123.9360	0.000	1	119.5175	0.738	194	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]N[6]C)(H)	C[6](N[6]C[6a]B[6])(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]N[6]C)(H){1|B<4>,4|C<3>}	C[6](N[6]C[6a]B[6])(C[6a]C[6a]2)(C[6]C[6]H){1|C<4>,1|N<3>,2|F<1>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.4110	0.000	1	120.4110	0.000	1	119.5175	0.738	194	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]N[6]C)(H)	C[6](N[6]C[6a]C[6])(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]N[6]C)(H){4|C<3>}	C[6](N[6]C[6a]C[6])(C[6a]C[6a]2)(C[6]C[6]H){1|Se<1>,1|C<4>,1|N<2>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.6690	0.124	3	120.6690	0.015	3	119.5175	0.738	194	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])2(H)	C[6](N[6]C[6a]B[6])(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])2(H){1|B<4>,6|C<3>}	C[6](N[6]C[6a]B[6])(C[6a]C[6a]2)(C[6]C[6]H){1|N<3>,2|F<1>,2|H<1>,5|C<3>}	H(C[6]C[6]2)	118.2775	0.202	12	118.2775	0.041	12	119.5175	0.738	194	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:N[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H)	C[6](N[6]C[6,6a]Cd)(N[5]C[5]N[5])(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H){1|Cd<5>,1|N<3>,3|C<3>}	C[6](N[6]C[6,6a]Cd)(N[5]C[5]N[5])(C[6]C[6]H){1|C<4>,1|H<1>,4|C<3>}	H(C[6]C[6]2)	120.7933	0.088	3	121.0206	0.224	7	121.1386	0.186	18	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:N[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H)	C[6](N[6]C[6,6a]Cd)(N[5]C[5]N[5])(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H){1|Cd<6>,1|N<3>,3|C<3>}	C[6](N[6]C[6,6a]Cd)(N[5]C[5]N[5])(C[6]C[6]H){1|C<4>,1|H<1>,4|C<3>}	H(C[6]C[6]2)	120.7105	0.313	2	121.0206	0.224	7	121.1386	0.186	18	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:N[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H)	C[6](N[6]C[6,6a]Cd)(N[5]C[5]N[5])(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H){1|Cd<6>,1|N<3>,3|C<3>}	C[6](N[6]C[6,6a]Cd)(N[5]C[5]N[5])(C[6]C[6]H){1|N<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	121.6715	0.196	2	121.0206	0.224	7	121.1386	0.186	18	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:N[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H)	C[6](N[6]C[6,6a]Cu)(N[5]C[5]N[5])(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H){1|Cu<3>,1|N<2>,3|C<3>}	C[6](N[6]C[6,6a]Cu)(N[5]C[5]N[5])(C[6]C[6]H){1|Cu<3>,1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	121.0220	0.000	1	120.9275	0.027	6	121.1386	0.186	18	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:N[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H)	C[6](N[6]C[6,6a]Cu)(N[5]C[5]N[5])(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H){1|Cu<5>,1|N<3>,3|C<3>}	C[6](N[6]C[6,6a]Cu)(N[5]C[5]N[5])(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.9410	0.183	3	120.9275	0.027	6	121.1386	0.186	18	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:N[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H)	C[6](N[6]C[6,6a]Cu)(N[5]C[5]N[5])(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H){1|Cu<6>,1|N<3>,3|C<3>}	C[6](N[6]C[6,6a]Cu)(N[5]C[5]N[5])(C[6]C[6]H){1|N<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.8600	0.225	2	120.9275	0.027	6	121.1386	0.186	18	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:N[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H)	C[6](N[6]C[6,6a]Ni)(N[5]C[5]N[5])(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H){1|Ni<6>,1|N<3>,3|C<3>}	C[6](N[6]C[6,6a]Ni)(N[5]C[5]N[5])(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	121.0030	0.000	1	121.0030	0.000	1	121.1386	0.186	18	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:N[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H)	C[6](N[6]C[6,6a]Ru)(N[5]C[5]N[5])(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H){1|Ru<9>,1|N<3>,3|C<3>}	C[6](N[6]C[6,6a]Ru)(N[5]C[5]N[5])(C[6]C[6]H){1|N<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	121.6660	0.000	1	121.6660	0.000	1	121.1386	0.186	18	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:N[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H)	C[6](N[6]C[6,6a]Zn)(N[5]C[5]N[5])(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H){1|Zn<4>,1|N<3>,3|C<3>}	C[6](N[6]C[6,6a]Zn)(N[5]C[5]N[5])(C[6]C[6]H){1|C<4>,1|H<1>,4|C<3>}	H(C[6]C[6]2)	121.5190	0.000	1	121.7053	0.029	3	121.1386	0.186	18	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:N[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H)	C[6](N[6]C[6,6a]Zn)(N[5]C[5]N[5])(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[5]N[6])(H){1|Zn<6>,1|N<3>,3|C<3>}	C[6](N[6]C[6,6a]Zn)(N[5]C[5]N[5])(C[6]C[6]H){1|N<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	121.7985	0.083	2	121.7053	0.029	3	121.1386	0.186	18	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]2)(H)	C[6](N[6]C[6,6]C[6])(N[6]C[6]Re)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]2)(H){1|Re<6>,1|C<4>,1|H<1>,2|C<3>}	C[6](N[6]C[6,6]C[6])(N[6]C[6]Re)(C[6]C[6]H){1|C<3>,1|C<4>,3|H<1>,3|N<3>}	H(C[6]C[6]2)	120.8305	0.286	2	120.8305	0.082	2	120.9109	0.094	10	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]2)(H)	C[6](N[6]C[6,6]C[6])(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]2)(H){1|Ru<6>,1|C<4>,1|H<1>,2|C<3>}	C[6](N[6]C[6,6]C[6])(N[6]C[6]Ru)(C[6]C[6]H){1|C<4>,2|C<3>,2|N<3>,3|H<1>}	H(C[6]C[6]2)	120.5895	0.043	2	120.5895	0.002	2	120.9109	0.094	10	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]2)(H)	C[6](N[6]C[6]N[6])(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]2)(H){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](N[6]C[6]N[6])(N[6]C[6]Fe)(C[6]C[6]H){1|N<3>,1|O<1>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.8390	0.049	3	120.8390	0.002	3	120.9109	0.094	10	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]2)(H)	C[6](N[6]C[6]N[6])(N[6]C[6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]2)(H){1|Pd<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](N[6]C[6]N[6])(N[6]C[6]Pd)(C[6]C[6]H){1|N<3>,1|O<1>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	121.0815	0.054	2	121.0815	0.003	2	120.9109	0.094	10	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[6]Cl)(C[6]N[6]2)(H)	C[6](N[6]C[6,6]C[6])(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[6]Cl)(C[6]N[6]2)(H){1|Ru<6>,1|C<4>,2|C<3>}	C[6](N[6]C[6,6]C[6])(N[6]C[6]Ru)(C[6]C[6]H){1|Cl<1>,1|C<4>,1|N<2>,2|N<3>,3|H<1>}	H(C[6]C[6]2)	121.5890	0.000	1	121.5890	0.000	1	120.9109	0.094	10	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:N[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[6a]N[6])(C[6]C[6,6a]H)(H)	C[6](N[6]C[6,6a]Cd)(N[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[6a]N[6])(C[6]C[6,6a]H)(H){1|Cd<6>,4|C<3>}	C[6](N[6]C[6,6a]Cd)(N[6a]C[6a]2)(C[6]C[6]H){1|O<1>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.5820	0.000	1	120.5820	0.000	1	120.5820	0.000	1	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[6a]C[6])(C[6]C[6]H)(H)	C[6](N[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]2)	C[6](C[6]N[6a]C[6])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](N[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H){1|B<4>,1|H<1>,2|O<1>,3|C<3>}	H(C[6]C[6]2)	120.9884	0.089	11	120.9884	0.008	11	120.9323	0.091	21	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[6a]C[6])(C[6]N[6]H)(H)	C[6](N[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]N[6a]C[6])(C[6]N[6]H)(H){2|H<1>,3|C<3>}	C[6](N[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,2|C<3>,2|H<1>,2|O<1>}	H(C[6]C[6]2)	120.8707	0.431	10	120.8707	0.186	10	120.9323	0.091	21	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6a]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]N[6a]N[6])(C[6]C[6]H)(H)	C[6](N[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]O)	H(C[6]C[6]2)	C[6](C[6]N[6a]N[6])(C[6]C[6]H)(H){1|H<1>,1|O<1>,3|C<3>}	C[6](N[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]O){1|C<4>,1|O<1>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.0730	0.000	1	119.7867	0.062	3	119.7867	0.062	3	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6a]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]N[6a]N[6])(C[6]C[6]H)(H)	C[6](N[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]O)	H(C[6]C[6]2)	C[6](C[6]N[6a]N[6])(C[6]C[6]H)(H){1|H<1>,1|O<1>,3|C<3>}	C[6](N[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]O){1|O<1>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.6435	0.015	2	119.7867	0.062	3	119.7867	0.062	3	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[6a]N[6])(C[6]C[6]H)(H)	C[6](N[6a]C[6a,6a]B[6a])(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[6a]N[6])(C[6]C[6]H)(H){1|Ir<8>,1|B<3>,1|H<1>,2|C<3>}	C[6](N[6a]C[6a,6a]B[6a])(N[6]C[6]Ir)(C[6]C[6]H){1|N<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.9815	0.141	2	119.9815	0.020	2	119.9815	0.020	2	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	O[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]O)(C[6]O[6]C)(H)	C[6](O[6]C[6]Ca)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]O[6]C)(H){1|Ca<8>,1|C<3>,1|H<1>}	C[6](O[6]C[6]Ca)(C[6]C[6]H)(COO){1|O<1>,2|C<3>}	H(C[6]C[6]2)	119.8800	0.096	2	119.8800	0.009	2	119.8800	0.009	2	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	P-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]P)(H)	C[6](PC[6a]C[6])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]P)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](PC[6a]C[6])(C[6]C[6]H)2{1|C<4>,2|C<3>}	H(C[6]C[6]2)	116.9513	4.902	4	116.9513	24.032	4	116.9513	24.032	4	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:C[6]-3:H-1:	P-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	C[6](PC[6a]C[6])(C[6]C[6]H)(N[6]C[6]W)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|C<3>,1|H<1>,1|W<6>}	C[6](PC[6a]C[6])(C[6]C[6]H)(N[6]C[6]W){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0275	0.121	2	120.0275	0.015	2	120.0275	0.015	2	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[5,6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5,6]C[6a])(N[6]C[6]Pt)(H)	C[6](C[5,6]C[5,6]C[5])(C[6a]C[6a]2)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[5,6]C[6a])(N[6]C[6]Pt)(H){1|C<4>,4|C<3>}	C[6](C[5,6]C[5,6]C[5])(C[6a]C[6a]2)(C[6]N[6]H){1|Pt<4>,2|C<4>,3|C<3>,4|H<1>}	H(C[6]C[6]N[6])	118.3838	0.443	5	118.3838	0.196	5	118.3838	0.196	5	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[5]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(N[6]C[6]C)(H)	C[6](C[5]N[5]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[5]C[6])(N[6]C[6]C)(H){1|C<3>,2|H<1>,2|N<3>}	C[6](C[5]N[5]2)(C[6]C[6]H)(C[6]N[6]H){2|C<3>,2|O<1>,3|C<4>}	H(C[6]C[6]N[6])	120.2315	0.383	2	120.2315	0.146	2	119.6539	1.447	20	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[5]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(N[6]C[6]Cd)(H)	C[6](C[5]C[5]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[5]C[6])(N[6]C[6]Cd)(H){2|H<1>,3|C<3>}	C[6](C[5]C[5]2)(C[6]C[6]H)(C[6]N[6]H){1|Cd<6>,1|C<3>,2|N<2>,3|H<1>}	H(C[6]C[6]N[6])	118.8805	0.056	2	118.8805	0.003	2	119.6539	1.447	20	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[5]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(N[6]C[6]Co)(H)	C[6](C[5]N[5]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[5]C[6])(N[6]C[6]Co)(H){1|H<1>,2|C<3>,2|N<2>}	C[6](C[5]N[5]2)(C[6]C[6]H)(C[6]N[6]H){1|Co<6>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.7520	0.000	1	118.7520	0.000	1	119.6539	1.447	20	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[5]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(N[6]C[6]H)(H)	C[6](C[5]N[5]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[5]C[6])(N[6]C[6]H)(H){1|C<3>,1|N<2>,1|N<3>,2|H<1>}	C[6](C[5]N[5]2)(C[6]C[6]H)(C[6]N[6]H){2|C<3>,2|H<1>,2|N<3>}	H(C[6]C[6]N[6])	123.5270	0.000	1	120.4271	1.377	9	119.6539	1.447	20	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[5]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(N[6]C[6]H)(H)	C[6](C[5]N[5]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[5]C[6])(N[6]C[6]H)(H){1|C<3>,2|H<1>,2|N<2>}	C[6](C[5]N[5]2)(C[6]C[6]H)(C[6]N[6]H){1|C<3>,2|H<1>,2|N<2>}	H(C[6]C[6]N[6])	120.0825	0.100	4	120.4271	1.377	9	119.6539	1.447	20	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[5]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(N[6]C[6]H)(H)	C[6](C[5]N[5]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[5]C[6])(N[6]C[6]H)(H){1|C<3>,2|H<1>,2|N<3>}	C[6](C[5]N[5]2)(C[6]C[6]H)(C[6]N[6]H){3|C<3>,4|H<1>}	H(C[6]C[6]N[6])	119.9968	0.232	4	120.4271	1.377	9	119.6539	1.447	20	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[5]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(N[6]C[6]Mn)(H)	C[6](C[5]N[5]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[5]C[6])(N[6]C[6]Mn)(H){1|C<3>,2|H<1>,2|N<2>}	C[6](C[5]N[5]2)(C[6]C[6]H)(C[6]N[6]H){1|Mn<6>,1|C<3>,1|H<1>,2|N<2>}	H(C[6]C[6]N[6])	117.6140	0.000	1	118.8730	1.193	3	119.6539	1.447	20	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[5]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(N[6]C[6]Mn)(H)	C[6](C[5]N[5]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[5]C[6])(N[6]C[6]Mn)(H){1|C<3>,2|H<1>,2|N<3>}	C[6](C[5]N[5]2)(C[6]C[6]H)(C[6]N[6]H){1|Mn<6>,1|C<3>,1|H<1>,1|O<1>,1|O<2>,2|C<4>}	H(C[6]C[6]N[6])	119.5025	0.091	2	118.8730	1.193	3	119.6539	1.447	20	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[5]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(N[6]C[6]Ni)(H)	C[6](C[5]N[5]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[5]C[6])(N[6]C[6]Ni)(H){1|C<3>,2|H<1>,2|N<2>}	C[6](C[5]N[5]2)(C[6]C[6]H)(C[6]N[6]H){1|Ni<6>,1|H<1>,1|N<2>,2|C<3>}	H(C[6]C[6]N[6])	118.4870	0.000	1	118.4870	0.000	1	119.6539	1.447	20	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[5]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(N[6]C[6]Rh)(H)	C[6](C[5]N[5]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[5]C[6])(N[6]C[6]Rh)(H){1|C<3>,2|H<1>,2|N<3>}	C[6](C[5]N[5]2)(C[6]C[6]H)(C[6]N[6]H){3|Rh<8>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.5760	0.607	2	118.5760	0.368	2	119.6539	1.447	20	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[5]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(N[6]C[6]H)(H)	C[6](C[5]N[5]2)(C[6]N[6]H)(N[6]C[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[5]N[6])(N[6]C[6]H)(H){1|C<3>,2|H<1>,2|N<2>}	C[6](C[5]N[5]2)(C[6]N[6]H)(N[6]C[6]H){1|N<2>,2|C<3>,2|H<1>}	H(C[6]C[6]N[6])	121.2590	0.479	2	121.2590	0.230	2	121.2590	0.230	2	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[5]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(N[6]C[6]Zn)(H)	C[6](C[5]N[5,5]N[5])(N[6]C[6]Zn)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[5]N[6])(N[6]C[6]Zn)(H){1|Zn<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](C[5]N[5,5]N[5])(N[6]C[6]Zn)(C[6]N[6]H){1|Zn<4>,1|H<1>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6]N[6])	119.7660	0.000	1	119.7660	0.000	1	119.7660	0.000	1	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[5a,6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a,6]C[6a])(N[6]C[6]S)(H)	C[6](C[5a,6]C[5a,6a]C[5a,6])(C[6a]C[6a]2)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[5a,6]C[6a])(N[6]C[6]S)(H){1|C<4>,1|H<1>,4|C<3>}	C[6](C[5a,6]C[5a,6a]C[5a,6])(C[6a]C[6a]2)(C[6]N[6]H){1|C<4>,1|N<3>,1|S<4>,2|H<1>,4|C<3>}	H(C[6]C[6]N[6])	119.1255	0.152	2	119.1255	0.023	2	119.1255	0.023	2	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(N[6]C[5]C[6])(H)	C[6](C[5a]C[5a]O[5a])(C[6]N[6]H)(C[6]N[6]O)	H(C[6]C[6]N[6])	C[6](C[6]C[5a]C[6])(N[6]C[5]C[6])(H){1|C<3>,1|C<4>,1|H<1>,1|N<2>,2|O<1>,2|O<2>}	C[6](C[5a]C[5a]O[5a])(C[6]N[6]H)(C[6]N[6]O){1|C<4>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	116.2630	0.000	1	116.2630	0.000	1	119.3493	1.650	45	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(N[6]C[6,6a]Cd)(H)	C[6](C[5a]C[5a]S[5a])(C[6]C[6,6a]H)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[5a]C[6])(N[6]C[6,6a]Cd)(H){1|H<1>,1|S<2>,3|C<3>}	C[6](C[5a]C[5a]S[5a])(C[6]C[6,6a]H)(C[6]N[6]H){1|Cd<6>,1|H<1>,4|C<3>}	H(C[6]C[6]N[6])	117.7110	0.448	4	117.7110	0.201	4	119.3493	1.650	45	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(N[6]C[6]C)(H)	C[6](C[5a]C[5a]N[5a])(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[5a]C[6])(N[6]C[6]C)(H){1|N<2>,2|C<3>,2|H<1>}	C[6](C[5a]C[5a]N[5a])(C[6]C[6]H)(C[6]N[6]H){1|C<4>,1|H<1>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6]N[6])	121.3325	0.446	2	120.1455	0.427	12	119.3493	1.650	45	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(N[6]C[6]C)(H)	C[6](C[5a]C[5a]N[5a])(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[5a]C[6])(N[6]C[6]C)(H){1|N<2>,2|C<3>,2|H<1>}	C[6](C[5a]C[5a]N[5a])(C[6]C[6]H)(C[6]N[6]H){1|C<4>,1|I<1>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6]N[6])	119.9081	0.351	10	120.1455	0.427	12	119.3493	1.650	45	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(N[6]C[6]Co)(H)	C[6](C[5a]N[5a]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[5a]C[6])(N[6]C[6]Co)(H){1|C<3>,1|N<2>,1|N<3>,2|H<1>}	C[6](C[5a]N[5a]2)(C[6]C[6]H)(C[6]N[6]H){1|Co<6>,1|H<1>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6]N[6])	118.1980	0.000	1	118.3340	0.066	6	119.3493	1.650	45	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(N[6]C[6]Co)(H)	C[6](C[5a]N[5a]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[5a]C[6])(N[6]C[6]Co)(H){1|C<3>,1|N<2>,1|N<3>,2|H<1>}	C[6](C[5a]N[5a]2)(C[6]C[6]H)(C[6]N[6]H){1|Co<6>,2|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.0670	0.000	1	118.3340	0.066	6	119.3493	1.650	45	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(N[6]C[6]Co)(H)	C[6](C[5a]N[5a]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[5a]C[6])(N[6]C[6]Co)(H){1|C<3>,2|H<1>,2|N<2>}	C[6](C[5a]N[5a]2)(C[6]C[6]H)(C[6]N[6]H){1|Co<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]N[6])	118.2160	0.048	2	118.3340	0.066	6	119.3493	1.650	45	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(N[6]C[6]Co)(H)	C[6](C[5a]N[5a]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[5a]C[6])(N[6]C[6]Co)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	C[6](C[5a]N[5a]2)(C[6]C[6]H)(C[6]N[6]H){1|Co<6>,2|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.6535	0.071	2	118.3340	0.066	6	119.3493	1.650	45	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(N[6]C[6]Cu)(H)	C[6](C[5a]N[5a]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[5a]C[6])(N[6]C[6]Cu)(H){1|C<3>,1|N<2>,1|N<3>,2|H<1>}	C[6](C[5a]N[5a]2)(C[6]C[6]H)(C[6]N[6]H){1|Cu<5>,2|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.2970	0.000	1	118.2970	0.000	1	119.3493	1.650	45	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(N[6]C[6]Fe)(H)	C[6](C[5a]N[5a]O[5a])(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[5a]C[6])(N[6]C[6]Fe)(H){1|C<3>,1|N<2>,1|O<2>,2|H<1>}	C[6](C[5a]N[5a]O[5a])(C[6]C[6]H)(C[6]N[6]H){1|Fe<6>,1|H<1>,1|N<2>,2|C<3>}	H(C[6]C[6]N[6])	118.4200	0.000	1	118.4200	0.000	1	119.3493	1.650	45	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(N[6]C[6]H)(H)	C[6](C[5a]C[5a]N[5a])(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[5a]C[6])(N[6]C[6]H)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[5a]C[5a]N[5a])(C[6]C[6]H)(C[6]N[6]H){3|H<1>,4|C<3>}	H(C[6]C[6]N[6])	119.7673	0.316	4	119.7673	0.100	4	119.3493	1.650	45	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(N[6]C[6]H)(H)	C[6](C[5a]N[5a]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[5a]C[6])(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>,2|N<3>}	C[6](C[5a]N[5a]2)(C[6]C[6]H)(C[6]N[6]H){1|C<3>,2|N<2>,3|H<1>}	H(C[6]C[6]N[6])	121.2430	2.426	3	120.2511	2.368	9	119.3493	1.650	45	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(N[6]C[6]H)(H)	C[6](C[5a]N[5a]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[5a]C[6])(N[6]C[6]H)(H){1|C<3>,1|N<2>,1|N<3>,2|H<1>}	C[6](C[5a]N[5a]2)(C[6]C[6]H)(C[6]N[6]H){1|C<3>,2|N<2>,3|H<1>}	H(C[6]C[6]N[6])	120.0115	0.028	2	120.2511	2.368	9	119.3493	1.650	45	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(N[6]C[6]H)(H)	C[6](C[5a]N[5a]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[5a]C[6])(N[6]C[6]H)(H){1|C<3>,1|N<2>,1|N<3>,2|H<1>}	C[6](C[5a]N[5a]2)(C[6]C[6]H)(C[6]N[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]N[6])	119.5980	0.000	1	120.2511	2.368	9	119.3493	1.650	45	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(N[6]C[6]H)(H)	C[6](C[5a]N[5a]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[5a]C[6])(N[6]C[6]H)(H){1|C<3>,2|H<1>,2|N<2>}	C[6](C[5a]N[5a]2)(C[6]C[6]H)(C[6]N[6]H){1|C<3>,1|N<2>,1|N<3>,2|H<1>}	H(C[6]C[6]N[6])	120.5990	0.000	1	120.2511	2.368	9	119.3493	1.650	45	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(N[6]C[6]H)(H)	C[6](C[5a]N[5a]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[5a]C[6])(N[6]C[6]H)(H){1|C<3>,2|H<1>,2|N<2>}	C[6](C[5a]N[5a]2)(C[6]C[6]H)(C[6]N[6]H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]N[6])	119.9160	0.000	1	120.2511	2.368	9	119.3493	1.650	45	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(N[6]C[6]H)(H)	C[6](C[5a]N[5a]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[5a]C[6])(N[6]C[6]H)(H){1|C<3>,2|H<1>,2|N<2>}	C[6](C[5a]N[5a]2)(C[6]C[6]H)(C[6]N[6]H){1|S<2>,2|C<3>,2|H<1>}	H(C[6]C[6]N[6])	118.3950	0.000	1	120.2511	2.368	9	119.3493	1.650	45	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(N[6]C[6]H)(H)	C[6](C[5a]N[5a]O[5a])(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[5a]C[6])(N[6]C[6]H)(H){1|C<3>,1|N<2>,1|O<2>,2|H<1>}	C[6](C[5a]N[5a]O[5a])(C[6]C[6]H)(C[6]N[6]H){1|N<2>,2|C<3>,2|H<1>}	H(C[6]C[6]N[6])	120.5690	0.000	1	120.5690	0.000	1	119.3493	1.650	45	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(N[6]C[6]Mn)(H)	C[6](C[5a]N[5a]O[5a])(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[5a]C[6])(N[6]C[6]Mn)(H){1|C<3>,1|N<2>,1|O<2>,2|H<1>}	C[6](C[5a]N[5a]O[5a])(C[6]C[6]H)(C[6]N[6]H){1|Mn<6>,1|H<1>,1|N<2>,2|C<3>}	H(C[6]C[6]N[6])	118.3540	0.000	1	118.3540	0.000	1	119.3493	1.650	45	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(N[6]C[6]Ni)(H)	C[6](C[5a]N[5a]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[5a]C[6])(N[6]C[6]Ni)(H){1|C<3>,2|H<1>,2|N<2>}	C[6](C[5a]N[5a]2)(C[6]C[6]H)(C[6]N[6]H){1|Ni<6>,1|H<1>,1|S<2>,2|C<3>}	H(C[6]C[6]N[6])	118.6000	0.000	1	118.6000	0.000	1	119.3493	1.650	45	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(N[6]C[6]Ni)(H)	C[6](C[5a]N[5a]S[5a])(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[5a]C[6])(N[6]C[6]Ni)(H){1|C<3>,1|N<2>,1|S<2>,2|H<1>}	C[6](C[5a]N[5a]S[5a])(C[6]C[6]H)(C[6]N[6]H){1|Ni<6>,1|H<1>,1|N<2>,2|C<3>}	H(C[6]C[6]N[6])	118.8290	0.000	1	118.8290	0.000	1	119.3493	1.650	45	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(N[6]C[6]O)(H)	C[6](C[5a]N[5a]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[5a]C[6])(N[6]C[6]O)(H){1|C<3>,1|N<2>,1|N<3>,2|H<1>}	C[6](C[5a]N[5a]2)(C[6]C[6]H)(C[6]N[6]H){1|H<1>,1|N<2>,1|N<3>,1|O<1>,2|C<3>}	H(C[6]C[6]N[6])	119.3730	0.069	2	119.3730	0.005	2	119.3493	1.650	45	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(N[6]C[6]Zn)(H)	C[6](C[5a]N[5a]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[5a]C[6])(N[6]C[6]Zn)(H){1|C<3>,1|N<2>,1|N<3>,2|H<1>}	C[6](C[5a]N[5a]2)(C[6]C[6]H)(C[6]N[6]H){1|Zn<6>,1|H<1>,2|C<3>,2|N<2>}	H(C[6]C[6]N[6])	118.7190	0.000	1	118.7190	0.000	1	119.3493	1.650	45	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6,6a]-3:B[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]B[5])(N[6]B[5]C[6])(H)	C[6](C[6,6a]C[6,6a]C[6a])(B[5]O[5]2)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[6,6a]B[5])(N[6]B[5]C[6])(H){2|C<3>,2|H<1>,4|O<2>}	C[6](C[6,6a]C[6,6a]C[6a])(B[5]O[5]2)(C[6]N[6]H){1|B<3>,1|H<1>,2|C<3>,3|C<4>}	H(C[6]C[6]N[6])	117.9760	0.000	1	117.9760	0.000	1	117.9760	0.000	1	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6,6a]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]C)(N[6]C[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(CCH)	H(C[6]C[6]N[6])	C[6](C[6]C[6,6a]C)(N[6]C[6]H)(H){1|S<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(CCH){2|H<1>,3|C<3>}	H(C[6]C[6]N[6])	110.1360	0.000	1	110.1360	0.000	1	115.5718	14.339	4	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6,6a]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]C)(N[6]C[6]Mg)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(CNO)	H(C[6]C[6]N[6])	C[6](C[6]C[6,6a]C)(N[6]C[6]Mg)(H){2|C<3>,2|H<1>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(CNO){1|Mg<4>,1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6]N[6])	116.6075	0.071	2	116.6075	0.005	2	115.5718	14.339	4	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6,6a]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]C)(N[6]C[6]S)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(CCH)	H(C[6]C[6]N[6])	C[6](C[6]C[6,6a]C)(N[6]C[6]S)(H){1|C<4>,1|H<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(CCH){1|C<4>,1|H<1>,1|S<4>,2|C<3>}	H(C[6]C[6]N[6])	118.9360	0.000	1	118.9360	0.000	1	115.5718	14.339	4	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6,6a]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]C[6a])(N[6]C[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[6,6a]C[6a])(N[6]C[6]C)(H){1|C<4>,1|H<1>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2)(C[6]N[6]H){1|C<4>,3|H<1>,5|C<3>}	H(C[6]C[6]N[6])	118.4340	0.119	2	118.4340	0.014	2	119.1492	0.333	6	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6,6a]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]C[6a])(N[6]C[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[6,6a]C[6a])(N[6]C[6]H)(H){1|H<1>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2)(C[6]N[6]H){4|H<1>,5|C<3>}	H(C[6]C[6]N[6])	119.6033	0.040	3	119.6033	0.002	3	119.1492	0.333	6	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6,6a]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]C[6a])(N[6]C[6]O)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6a]C[6a,6a]C[6a])(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[6,6a]C[6a])(N[6]C[6]O)(H){1|H<1>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6a]C[6a,6a]C[6a])(C[6]N[6]H){1|O<1>,2|H<1>,6|C<3>}	H(C[6]C[6]N[6])	119.2170	0.000	1	119.2170	0.000	1	119.1492	0.333	6	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(N[6]C[6,6a]C)(H)	C[6](C[6]C[6,6a]H)(C[5]C[5]2)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[5]C[6])(N[6]C[6,6a]C)(H){1|H<1>,4|C<3>}	C[6](C[6]C[6,6a]H)(C[5]C[5]2)(C[6]N[6]H){1|C<4>,1|O<1>,1|O<2>,4|C<3>}	H(C[6]C[6]N[6])	118.5380	0.000	1	118.5380	0.000	1	118.5380	0.000	1	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:As-3:	C[6]-3:	C[6](C[6]C[6]As)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(AsCl2)	H(C[6]C[6]N[6])	C[6](C[6]C[6]As)(N[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(AsCl2){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	120.0310	0.000	1	120.0310	0.000	1	120.0310	0.000	1	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:B-3:	C[6]-3:	C[6](C[6]C[6]B)(N[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(BOO)	H(C[6]C[6]N[6])	C[6](C[6]C[6]B)(N[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(BOO){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	119.3040	0.000	1	119.3040	0.000	1	119.4645	0.023	14	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:B-3:	C[6]-3:	C[6](C[6]C[6]B)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(BOO)	H(C[6]C[6]N[6])	C[6](C[6]C[6]B)(N[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(BOO){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	119.4768	0.151	13	119.4768	0.023	13	119.4645	0.023	14	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]C)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(CNO)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(CNO){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	119.5885	3.497	2	119.5885	12.227	2	120.0108	2.756	191	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CCH)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CCH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	119.3985	0.500	2	119.3985	0.250	2	120.0108	2.756	191	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	119.1240	0.000	1	119.8102	2.425	41	120.0108	2.756	191	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	120.0522	1.712	20	119.8102	2.425	41	120.0108	2.756	191	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]N[6])	119.8900	0.000	1	119.8102	2.425	41	120.0108	2.756	191	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO){1|C<4>,2|C<3>}	H(C[6]C[6]N[6])	119.5786	1.553	17	119.8102	2.425	41	120.0108	2.756	191	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO){1|H<1>,2|C<3>}	H(C[6]C[6]N[6])	119.9100	0.000	1	119.8102	2.425	41	120.0108	2.756	191	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]C)(H){1|Rh<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]N[6])	119.4160	0.000	1	119.8102	2.425	41	120.0108	2.756	191	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CN[5]O)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CN[5]O){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	120.5215	0.827	2	120.5215	0.683	2	120.0108	2.756	191	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CN[6]O)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CN[6]O){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	130.8170	0.000	1	130.8170	0.000	1	120.0108	2.756	191	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|Br<1>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	119.8340	0.000	1	119.5303	0.629	23	120.0108	2.756	191	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]C)(H){1|C<3>,1|C<4>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|H<1>,2|C<4>}	H(C[6]C[6]N[6])	118.5585	0.112	2	119.5303	0.629	23	120.0108	2.756	191	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	119.9174	0.270	17	119.5303	0.629	23	120.0108	2.756	191	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]C)(H){1|C<4>,1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|H<1>,2|C<4>}	H(C[6]C[6]N[6])	117.8837	0.073	3	119.5303	0.629	23	120.0108	2.756	191	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]C)(H)	C[6](C[6]C[6]N[5])(C[6]N[6]H)(CN[5]O)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]C)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[5])(C[6]N[6]H)(CN[5]O){1|C<3>,1|H<1>,3|C<4>}	H(C[6]C[6]N[6])	118.4810	0.000	1	118.4810	0.000	1	120.0108	2.756	191	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]C)(H)	C[6](C[6]C[6]O)(C[6]N[6]H)(COO)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]C)(H){1|C<3>,1|C<4>,1|O<2>}	C[6](C[6]C[6]O)(C[6]N[6]H)(COO){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	117.9475	0.247	2	118.2493	0.304	3	120.0108	2.756	191	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]C)(H)	C[6](C[6]C[6]O)(C[6]N[6]H)(COO)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]C)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]O)(C[6]N[6]H)(COO){1|C<3>,2|C<4>}	H(C[6]C[6]N[6])	118.8530	0.000	1	118.2493	0.304	3	120.0108	2.756	191	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]C)(H)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(COO)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]C)(H){1|C<4>,1|H<1>,2|C<3>}	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(COO){1|H<1>,2|C<3>,2|C<4>}	H(C[6]C[6]N[6])	117.9410	0.089	2	117.9410	0.008	2	120.0108	2.756	191	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]C)(H)	C[6](C[6]C[6a]N[6])(C[6]N[6]H)(CC[6a]O)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]C)(H){1|C<3>,1|N<2>,1|S<1>}	C[6](C[6]C[6a]N[6])(C[6]N[6]H)(CC[6a]O){1|C<4>,3|C<3>}	H(C[6]C[6]N[6])	120.6080	1.877	2	120.6080	3.522	2	120.0108	2.756	191	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]H)(H)	C[6](C[6]C[6]2)(C[6]N[6]H)(COO)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]2)(C[6]N[6]H)(COO){2|H<1>,3|C<3>}	H(C[6]C[6]N[6])	119.8565	0.149	2	119.8565	0.022	2	120.0108	2.756	191	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(COO)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(COO){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	121.0580	1.392	4	121.0580	1.937	4	120.0108	2.756	191	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CBrC)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CBrC){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	119.4770	0.000	2	119.4770	0.000	2	120.0108	2.756	191	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CCN)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CCN){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	119.7535	0.070	2	119.7535	0.005	2	120.0108	2.756	191	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CC[5a]2)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CC[5a]2){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	120.0340	0.000	1	120.0340	0.000	1	120.0108	2.756	191	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CC[6]O)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CC[6]O){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	120.1420	0.000	1	120.1420	0.000	1	120.0108	2.756	191	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CClO)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CClO){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	120.4940	0.000	1	120.4940	0.000	1	120.0108	2.756	191	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CHN)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CHN){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	119.8553	0.183	3	119.8553	0.034	3	120.0108	2.756	191	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CNN)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CNN){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	118.0270	0.000	1	118.0270	0.000	1	120.0108	2.756	191	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO){1|Br<1>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	120.5220	0.000	1	120.3000	2.907	29	120.0108	2.756	191	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	120.2920	1.736	28	120.3000	2.907	29	120.0108	2.756	191	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CNS)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CNS){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	120.1100	0.163	2	120.1100	0.026	2	120.0108	2.756	191	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	119.6330	0.000	1	120.4985	1.401	40	120.0108	2.756	191	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	120.5350	0.000	1	120.4985	1.401	40	120.0108	2.756	191	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]N[6])	123.3070	0.489	2	120.4985	1.401	40	120.0108	2.756	191	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|C<3>,1|H<1>,1|P<4>}	H(C[6]C[6]N[6])	120.0240	0.000	1	120.4985	1.401	40	120.0108	2.756	191	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	120.3851	1.059	34	120.4985	1.401	40	120.0108	2.756	191	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|H<1>,2|C<3>}	H(C[6]C[6]N[6])	120.0380	0.000	1	120.4985	1.401	40	120.0108	2.756	191	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(COO)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(COO){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	118.6747	0.032	4	118.6747	0.001	4	120.0108	2.756	191	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]H)(H)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(COO)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(COO){2|H<1>,3|C<3>}	H(C[6]C[6]N[6])	119.2015	0.046	2	119.2015	0.002	2	120.0108	2.756	191	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]H)(H)	C[6](C[6]N[6]H)(C[6]N[6]O)(COO)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]H)(H){1|N<3>,1|O<1>,1|O<2>}	C[6](C[6]N[6]H)(C[6]N[6]O)(COO){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	119.6195	3.101	4	119.3926	4.893	7	120.0108	2.756	191	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]H)(H)	C[6](C[6]N[6]H)(C[6]N[6]O)(COO)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]H)(H){1|N<3>,1|O<1>,1|S<1>}	C[6](C[6]N[6]H)(C[6]N[6]O)(COO){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	119.0900	0.111	3	119.3926	4.893	7	120.0108	2.756	191	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]O)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO){1|O<1>,2|C<3>}	H(C[6]C[6]N[6])	119.5572	0.442	6	119.5572	0.195	6	120.0108	2.756	191	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]O)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]N[6])	119.8855	0.398	2	121.6875	9.298	4	120.0108	2.756	191	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]O)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]N[6])	123.4895	3.840	2	121.6875	9.298	4	120.0108	2.756	191	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(N[6]S[6]C)(H)	C[6](C[6]N[6]C)(C[6]N[6]H)(COO)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]S[6]C)(H){1|C<4>,1|N<2>,2|O<1>}	C[6](C[6]N[6]C)(C[6]N[6]H)(COO){1|C<4>,1|S<4>}	H(C[6]C[6]N[6])	118.0100	0.000	1	118.0100	0.000	1	120.0108	2.756	191	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(N[6]C[6]C)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]Ir)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]2)(N[6]C[6]C)(H){1|Ir<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]Ir)(C[6]N[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]N[6])	120.5580	1.414	4	120.5580	1.998	4	120.2601	0.839	9	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(N[6]C[6]H)(H)	C[6](C[6]C[6]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]2)(N[6]C[6]H)(H){2|H<1>,3|C<3>}	C[6](C[6]C[6]2)(C[6]C[6]H)(C[6]N[6]H){1|N<3>,2|C<3>,4|H<1>}	H(C[6]C[6]N[6])	120.1200	0.014	2	120.0218	0.020	5	120.2601	0.839	9	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(N[6]C[6]H)(H)	C[6](C[6]C[6]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]2)(N[6]C[6]H)(H){2|H<1>,3|C<3>}	C[6](C[6]C[6]2)(C[6]C[6]H)(C[6]N[6]H){2|C<2>,2|H<1>,3|C<3>}	H(C[6]C[6]N[6])	119.9563	0.154	3	120.0218	0.020	5	120.2601	0.839	9	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(N[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NCH)	H(C[6]C[6]N[6])	C[6](C[6]C[6]N)(N[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NCH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	119.7018	0.358	6	119.7018	0.128	6	120.1615	1.482	108	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(N[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NCoC)	H(C[6]C[6]N[6])	C[6](C[6]C[6]N)(N[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NCoC){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	119.4423	0.267	8	119.4423	0.071	8	120.1615	1.482	108	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(N[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NHH)	H(C[6]C[6]N[6])	C[6](C[6]C[6]N)(N[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NHH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	119.5311	0.207	7	119.5311	0.043	7	120.1615	1.482	108	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(N[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NIrC)	H(C[6]C[6]N[6])	C[6](C[6]C[6]N)(N[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NIrC){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	119.6050	0.000	1	119.6050	0.000	1	120.1615	1.482	108	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(N[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NNiC)	H(C[6]C[6]N[6])	C[6](C[6]C[6]N)(N[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NNiC){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	119.5480	0.229	4	119.5480	0.052	4	120.1615	1.482	108	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(N[6]C[6]C)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(NZnC)	H(C[6]C[6]N[6])	C[6](C[6]C[6]N)(N[6]C[6]C)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(NZnC){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	119.6280	0.000	1	119.6280	0.000	1	120.1615	1.482	108	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NCH)	H(C[6]C[6]N[6])	C[6](C[6]C[6]N)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NCH){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	119.9270	0.000	1	120.1240	0.098	22	120.1615	1.482	108	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NCH)	H(C[6]C[6]N[6])	C[6](C[6]C[6]N)(N[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NCH){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	120.1334	0.317	21	120.1240	0.098	22	120.1615	1.482	108	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NHH)	H(C[6]C[6]N[6])	C[6](C[6]C[6]N)(N[6]C[6]H)(H){1|C<2>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NHH){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	122.4480	0.000	1	120.2336	1.206	40	120.1615	1.482	108	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NHH)	H(C[6]C[6]N[6])	C[6](C[6]C[6]N)(N[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NHH){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	120.2398	1.087	35	120.2336	1.206	40	120.1615	1.482	108	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NHH)	H(C[6]C[6]N[6])	C[6](C[6]C[6]N)(N[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NHH){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	119.6255	0.398	4	120.2336	1.206	40	120.1615	1.482	108	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NOO)	H(C[6]C[6]N[6])	C[6](C[6]C[6]N)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NOO){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	120.9852	0.861	6	120.9852	0.740	6	120.1615	1.482	108	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(N[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(NHH)	H(C[6]C[6]N[6])	C[6](C[6]C[6]N)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(NHH){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	121.0952	3.294	8	121.0952	10.852	8	120.1615	1.482	108	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(N[6]C[6]H)(H)	C[6](C[6]C[6]O)(C[6]N[6]H)(NCH)	H(C[6]C[6]N[6])	C[6](C[6]C[6]N)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]O)(C[6]N[6]H)(NCH){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	119.2790	0.000	1	119.2790	0.000	1	120.1615	1.482	108	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(N[6]C[6]H)(H)	C[6](C[6]C[6]O)(C[6]N[6]H)(NOO)	H(C[6]C[6]N[6])	C[6](C[6]C[6]N)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]O)(C[6]N[6]H)(NOO){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	120.1460	0.000	1	120.1460	0.000	1	120.1615	1.482	108	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(N[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NCH)	H(C[6]C[6]N[6])	C[6](C[6]C[6]N)(N[6]C[6]O)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NCH){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]N[6])	119.8550	0.000	1	119.8550	0.000	1	120.1615	1.482	108	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(N[6]C[6]O)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(NHH)	H(C[6]C[6]N[6])	C[6](C[6]C[6]N)(N[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(NHH){1|C<3>,1|N<3>,1|O<1>}	H(C[6]C[6]N[6])	121.7635	0.841	2	121.7635	0.707	2	120.1615	1.482	108	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:N[5]-3:	C[6]-3:	C[6](C[6]C[6]N[5])(N[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(N[5]C[5]2)	H(C[6]C[6]N[6])	C[6](C[6]C[6]N[5])(N[6]C[6]C)(H){2|H<1>,3|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(N[5]C[5]2){1|Rh<6>,1|C<4>,1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]N[6])	120.2000	0.000	1	120.2000	0.000	1	119.5046	0.751	7	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:N[5]-3:	C[6]-3:	C[6](C[6]C[6]N[5])(N[6]C[6]C)(H)	C[6](C[6]C[6]Ir)(C[6]N[6]H)(N[5]C[5]2)	H(C[6]C[6]N[6])	C[6](C[6]C[6]N[5])(N[6]C[6]C)(H){1|Ir<6>,1|H<1>,3|C<3>}	C[6](C[6]C[6]Ir)(C[6]N[6]H)(N[5]C[5]2){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]N[6])	120.7670	0.000	1	120.4290	0.228	2	119.5046	0.751	7	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:N[5]-3:	C[6]-3:	C[6](C[6]C[6]N[5])(N[6]C[6]C)(H)	C[6](C[6]C[6]Ir)(C[6]N[6]H)(N[5]C[5]2)	H(C[6]C[6]N[6])	C[6](C[6]C[6]N[5])(N[6]C[6]C)(H){1|Ir<6>,1|H<1>,3|C<3>}	C[6](C[6]C[6]Ir)(C[6]N[6]H)(N[5]C[5]2){1|N<3>,2|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]N[6])	120.0910	0.000	1	120.4290	0.228	2	119.5046	0.751	7	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:N[5]-3:	C[6]-3:	C[6](C[6]C[6]N[5])(N[6]C[6]Pd)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(N[5]C[5]2)	H(C[6]C[6]N[6])	C[6](C[6]C[6]N[5])(N[6]C[6]Pd)(H){2|H<1>,3|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(N[5]C[5]2){1|Pd<4>,1|H<1>,2|O<1>,3|C<3>}	H(C[6]C[6]N[6])	118.8507	0.481	3	118.8507	0.232	3	119.5046	0.751	7	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:N[5]-3:	C[6]-3:	C[6](C[6]C[6]N[5])(N[6]C[6]Re)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(N[5]C[5]2)	H(C[6]C[6]N[6])	C[6](C[6]C[6]N[5])(N[6]C[6]Re)(H){2|H<1>,3|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(N[5]C[5]2){1|Re<6>,1|H<1>,2|O<1>,3|C<3>}	H(C[6]C[6]N[6])	118.9220	0.000	1	118.9220	0.000	1	119.5046	0.751	7	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(N[6]C[6]B)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(N[6]C[6]2)	H(C[6]C[6]N[6])	C[6](C[6]C[6]N[6])(N[6]C[6]B)(H){2|H<1>,3|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(N[6]C[6]2){1|B<4>,1|H<1>,2|O<1>,3|C<3>}	H(C[6]C[6]N[6])	119.2511	0.219	7	119.2511	0.048	7	119.4166	0.260	8	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(N[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(N[6]C[6]2)	H(C[6]C[6]N[6])	C[6](C[6]C[6]N[6])(N[6]C[6]C)(H){2|H<1>,3|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(N[6]C[6]2){1|C<4>,1|H<1>,2|O<1>,3|C<3>}	H(C[6]C[6]N[6])	120.5750	0.000	1	120.5750	0.000	1	119.4166	0.260	8	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(N[6]C[6,6a]Ir)(H)	C[6](C[6]C[6,6a]H)(C[6a]C[6a]2)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[6a]C[6])(N[6]C[6,6a]Ir)(H){1|H<1>,4|C<3>}	C[6](C[6]C[6,6a]H)(C[6a]C[6a]2)(C[6]N[6]H){1|Ir<6>,2|H<1>,4|C<3>}	H(C[6]C[6]N[6])	118.5055	0.060	2	118.5055	0.004	2	118.0867	0.113	8	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(N[6]C[6,6a]Ru)(H)	C[6](C[6]C[6,6a]H)(C[6a]C[6a]2)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[6a]C[6])(N[6]C[6,6a]Ru)(H){1|H<1>,4|C<3>}	C[6](C[6]C[6,6a]H)(C[6a]C[6a]2)(C[6]N[6]H){1|Ru<6>,2|H<1>,4|C<3>}	H(C[6]C[6]N[6])	117.9885	0.282	4	117.9885	0.080	4	118.0867	0.113	8	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(N[6]C[6]C)(H)	C[6](C[6]C[6a]C[6])(C[6a]C[6a]2)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[6a]C[6])(N[6]C[6]C)(H){1|N<2>,4|C<3>}	C[6](C[6]C[6a]C[6])(C[6a]C[6a]2)(C[6]N[6]H){1|C<2>,1|C<4>,2|H<1>,5|C<3>}	H(C[6]C[6]N[6])	117.6860	0.000	1	117.6860	0.000	1	118.0867	0.113	8	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(N[6]C[6a]B[6])(H)	C[6](C[6]C[6a]O[6])(C[6a]C[6a]2)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[6a]C[6])(N[6]C[6a]B[6])(H){1|O<2>,2|F<1>,5|C<3>}	C[6](C[6]C[6a]O[6])(C[6a]C[6a]2)(C[6]N[6]H){1|B<4>,2|H<1>,5|C<3>}	H(C[6]C[6]N[6])	118.0430	0.000	1	118.0430	0.000	1	118.0867	0.113	8	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:N[6]-3:C-3:	C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6]C)(H)	C[6](C[6]N[6]H)(N[6]C[6]C)(COO)	H(C[6]C[6]N[6])	C[6](C[6]N[6]C)(N[6]C[6]C)(H){1|C<3>,1|C<4>,1|H<1>,1|O<2>}	C[6](C[6]N[6]H)(N[6]C[6]C)(COO){2|C<4>,2|H<1>}	H(C[6]C[6]N[6])	119.5100	0.000	1	119.5100	0.000	1	118.3810	2.549	2	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:N[6]-3:C-3:	C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6]S)(H)	C[6](C[6]N[6]H)(N[6]C[6]S)(CCH)	H(C[6]C[6]N[6])	C[6](C[6]N[6]C)(N[6]C[6]S)(H){1|C<4>,1|S<4>,2|H<1>}	C[6](C[6]N[6]H)(N[6]C[6]S)(CCH){1|C<4>,1|S<4>,2|H<1>}	H(C[6]C[6]N[6])	117.2520	0.000	1	117.2520	0.000	1	118.3810	2.549	2	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(N[6]C[6,6a]C)(H)	C[6](C[6]C[6]N[6])(N[6]C[6,6a]H)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]N[6])(N[6]C[6,6a]C)(H){1|H<1>,1|N<2>,3|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6,6a]H)(C[6]N[6]H){1|C<4>,1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]N[6])	124.5960	0.000	1	124.5960	0.000	1	121.1820	8.876	3	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(N[6]C[6]Co)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Co)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]N[6])(N[6]C[6]Co)(H){1|Co<6>,1|N<3>,3|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Co)(C[6]N[6]H){1|Co<6>,2|H<1>,3|C<3>}	H(C[6]C[6]N[6])	119.8420	0.000	1	119.8420	0.000	1	121.1820	8.876	3	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(H){1|Cu<4>,1|N<3>,3|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Cu)(C[6]N[6]H){1|Cu<4>,2|H<1>,3|C<3>}	H(C[6]C[6]N[6])	119.1080	0.000	1	119.1080	0.000	1	121.1820	8.876	3	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:N[6]-3:N-3:	C[6]-3:	C[6](C[6]N[6]N)(N[6]C[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6]H)(NHH)	H(C[6]C[6]N[6])	C[6](C[6]N[6]N)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6]H)(N[6]C[6]H)(NHH){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	120.3460	0.000	1	120.3460	0.000	1	120.3460	0.000	1	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(N[6]C[6]C)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]C)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[6a]C[6])(N[6]C[6]C)(H){1|H<1>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]C)(C[6]N[6]H){1|H<1>,3|C<3>,3|C<4>}	H(C[6]C[6]N[6])	118.5080	0.000	1	118.5080	0.000	1	118.4546	0.422	115	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(N[6]C[6]C)(H)	C[6](C[6a]C[6a]2)(C[6]N[6]H)(C[6]N[6]O)	H(C[6]C[6]N[6])	C[6](C[6]C[6a]C[6])(N[6]C[6]C)(H){1|C<4>,1|H<1>,1|N<3>,1|O<1>,2|C<3>}	C[6](C[6a]C[6a]2)(C[6]N[6]H)(C[6]N[6]O){1|C<4>,3|C<3>,3|H<1>}	H(C[6]C[6]N[6])	118.9650	0.000	1	118.9650	0.000	1	118.4546	0.422	115	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(N[6]C[6]C)(H)	C[6](C[6a]C[6a]2)(C[6]N[6]H)(C[6]N[6]S)	H(C[6]C[6]N[6])	C[6](C[6]C[6a]C[6])(N[6]C[6]C)(H){1|N<3>,1|S<1>,2|C<3>,2|C<4>}	C[6](C[6a]C[6a]2)(C[6]N[6]H)(C[6]N[6]S){2|C<3>,2|C<4>,3|H<1>}	H(C[6]C[6]N[6])	117.2850	0.000	1	117.2850	0.000	1	118.4546	0.422	115	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(N[6]C[6]Cd)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[6a]C[6])(N[6]C[6]Cd)(H){1|H<1>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H){1|Cd<6>,2|H<1>,4|C<3>}	H(C[6]C[6]N[6])	118.4210	0.000	1	118.4210	0.000	1	118.4546	0.422	115	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(N[6]C[6]Co)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[6a]C[6])(N[6]C[6]Co)(H){1|H<1>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H){1|Co<4>,1|H<1>,2|C<4>,3|C<3>}	H(C[6]C[6]N[6])	117.9248	0.255	6	118.1133	0.165	9	118.4546	0.422	115	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(N[6]C[6]Co)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[6a]C[6])(N[6]C[6]Co)(H){1|H<1>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H){1|Co<6>,2|H<1>,4|C<3>}	H(C[6]C[6]N[6])	118.6710	0.399	2	118.1133	0.165	9	118.4546	0.422	115	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(N[6]C[6]Co)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[6a]C[6])(N[6]C[6]Co)(H){1|H<1>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H){1|Co<6>,3|C<3>,3|H<1>}	H(C[6]C[6]N[6])	118.1290	0.000	1	118.1133	0.165	9	118.4546	0.422	115	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(N[6]C[6]Co)(H)	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[6a]C[6])(N[6]C[6]Co)(H){1|N<2>,2|C<3>,2|H<1>}	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)(C[6]N[6]H){1|Co<6>,2|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.0370	0.000	1	118.0370	0.000	1	118.4546	0.422	115	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(N[6]C[6]Cu)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[6a]C[6])(N[6]C[6]Cu)(H){1|H<1>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H){1|Cu<4>,3|C<3>,3|H<1>}	H(C[6]C[6]N[6])	117.9556	0.569	9	117.9556	0.323	9	118.4546	0.422	115	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(N[6]C[6]Cu)(H)	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[6a]C[6])(N[6]C[6]Cu)(H){1|N<2>,2|C<3>,2|H<1>}	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)(C[6]N[6]H){1|Cu<5>,2|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.2180	0.000	1	118.2180	0.000	1	118.4546	0.422	115	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(N[6]C[6]Fe)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[6a]C[6])(N[6]C[6]Fe)(H){1|H<1>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H){1|Fe<6>,1|C<2>,2|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.4860	0.000	1	118.1180	0.106	3	118.4546	0.422	115	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(N[6]C[6]Fe)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[6a]C[6])(N[6]C[6]Fe)(H){2|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H){1|Fe<6>,1|N<2>,2|C<3>,3|H<1>}	H(C[6]C[6]N[6])	117.9340	0.093	2	118.1180	0.106	3	118.4546	0.422	115	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(N[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[6a]C[6])(N[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H){3|C<3>,4|H<1>}	H(C[6]C[6]N[6])	119.0325	0.275	2	119.3341	0.207	11	118.4546	0.422	115	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(N[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[6a]C[6])(N[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H){3|H<1>,4|C<3>}	H(C[6]C[6]N[6])	119.2880	0.030	2	119.3341	0.207	11	118.4546	0.422	115	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(N[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[6a]C[6])(N[6]C[6]H)(H){2|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H){1|Pd<4>,3|C<3>,3|H<1>}	H(C[6]C[6]N[6])	118.2860	0.000	1	119.3341	0.207	11	118.4546	0.422	115	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(N[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[6a]C[6])(N[6]C[6]H)(H){2|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H){3|C<3>,4|H<1>}	H(C[6]C[6]N[6])	119.6247	0.199	6	119.3341	0.207	11	118.4546	0.422	115	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(N[6]C[6]H)(H)	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[6a]C[6])(N[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<2>,2|C<3>}	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)(C[6]N[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]N[6])	119.7190	0.000	1	119.8713	0.044	4	118.4546	0.422	115	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(N[6]C[6]H)(H)	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[6a]C[6])(N[6]C[6]H)(H){1|N<2>,2|C<3>,2|H<1>}	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)(C[6]N[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]N[6])	119.9220	0.225	3	119.8713	0.044	4	118.4546	0.422	115	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(N[6]C[6]Ir)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]C)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[6a]C[6])(N[6]C[6]Ir)(H){1|C<4>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]C)(C[6]N[6]H){1|Ir<6>,3|C<3>,3|H<1>}	H(C[6]C[6]N[6])	117.4020	0.000	1	117.4020	0.000	1	118.4546	0.422	115	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(N[6]C[6]Ir)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[6a]C[6])(N[6]C[6]Ir)(H){1|H<1>,1|N<2>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H){1|Ir<8>,3|C<3>,3|H<1>}	H(C[6]C[6]N[6])	117.8360	0.222	2	118.0783	0.044	11	118.4546	0.422	115	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(N[6]C[6]Ir)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[6a]C[6])(N[6]C[6]Ir)(H){1|H<1>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H){1|Ir<6>,1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.0463	0.148	6	118.0783	0.044	11	118.4546	0.422	115	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(N[6]C[6]Ir)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[6a]C[6])(N[6]C[6]Ir)(H){1|H<1>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H){1|Ir<6>,3|C<3>,3|H<1>}	H(C[6]C[6]N[6])	118.3037	0.051	3	118.0783	0.044	11	118.4546	0.422	115	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(N[6]C[6]Mn)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[6a]C[6])(N[6]C[6]Mn)(H){1|C<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H){1|Mn<6>,1|H<1>,2|C<4>,3|C<3>}	H(C[6]C[6]N[6])	118.3530	0.554	2	118.0966	0.189	5	118.4546	0.422	115	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(N[6]C[6]Mn)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[6a]C[6])(N[6]C[6]Mn)(H){1|H<1>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H){1|Mn<6>,1|O<2>,2|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.1220	0.000	1	118.0966	0.189	5	118.4546	0.422	115	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(N[6]C[6]Mn)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[6a]C[6])(N[6]C[6]Mn)(H){1|H<1>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H){1|Mn<6>,2|H<1>,4|C<3>}	H(C[6]C[6]N[6])	118.1220	0.000	1	118.0966	0.189	5	118.4546	0.422	115	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(N[6]C[6]Mn)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[6a]C[6])(N[6]C[6]Mn)(H){1|H<1>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H){1|Mn<6>,3|C<3>,3|H<1>}	H(C[6]C[6]N[6])	117.5330	0.000	1	118.0966	0.189	5	118.4546	0.422	115	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(N[6]C[6]Mn)(H)	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[6a]C[6])(N[6]C[6]Mn)(H){1|N<2>,2|C<3>,2|H<1>}	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)(C[6]N[6]H){1|Mn<6>,2|H<1>,3|C<3>}	H(C[6]C[6]N[6])	117.9110	0.000	1	117.9110	0.000	1	118.4546	0.422	115	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(N[6]C[6]Ni)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[6a]C[6])(N[6]C[6]Ni)(H){1|C<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H){1|Ni<6>,3|C<3>,3|H<1>}	H(C[6]C[6]N[6])	118.3023	0.089	4	118.2190	0.058	10	118.4546	0.422	115	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(N[6]C[6]Ni)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[6a]C[6])(N[6]C[6]Ni)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H){1|Ni<6>,3|C<3>,3|H<1>}	H(C[6]C[6]N[6])	118.0545	0.312	4	118.2190	0.058	10	118.4546	0.422	115	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(N[6]C[6]Ni)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[6a]C[6])(N[6]C[6]Ni)(H){1|H<1>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H){1|Ni<6>,2|H<1>,4|C<3>}	H(C[6]C[6]N[6])	118.3030	0.000	1	118.2190	0.058	10	118.4546	0.422	115	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(N[6]C[6]Ni)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[6a]C[6])(N[6]C[6]Ni)(H){1|H<1>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H){1|Ni<6>,3|C<3>,3|H<1>}	H(C[6]C[6]N[6])	118.4600	0.000	1	118.2190	0.058	10	118.4546	0.422	115	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(N[6]C[6]Pd)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[6a]C[6])(N[6]C[6]Pd)(H){1|H<1>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H){1|Pd<4>,1|H<1>,2|C<4>,3|C<3>}	H(C[6]C[6]N[6])	118.4540	0.643	2	118.3430	0.393	8	118.4546	0.422	115	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(N[6]C[6]Pd)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[6a]C[6])(N[6]C[6]Pd)(H){2|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H){1|Pd<4>,3|C<3>,3|H<1>}	H(C[6]C[6]N[6])	118.3060	0.679	6	118.3430	0.393	8	118.4546	0.422	115	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(N[6]C[6]Pt)(H)	C[6](C[6a]C[6a,6a]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[6a]C[6])(N[6]C[6]Pt)(H){2|H<1>,3|C<3>}	C[6](C[6a]C[6a,6a]2)(C[6]C[6]H)(C[6]N[6]H){1|Pt<4>,1|H<1>,5|C<3>}	H(C[6]C[6]N[6])	118.6593	0.349	6	118.6593	0.122	6	118.4546	0.422	115	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(N[6]C[6]Pt)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[6a]C[6])(N[6]C[6]Pt)(H){1|H<1>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H){1|Pt<4>,3|C<3>,3|H<1>}	H(C[6]C[6]N[6])	118.8656	0.451	5	118.6904	0.225	7	118.4546	0.422	115	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(N[6]C[6]Pt)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[6a]C[6])(N[6]C[6]Pt)(H){2|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H){1|Pt<6>,3|C<3>,3|H<1>}	H(C[6]C[6]N[6])	118.2525	0.006	2	118.6904	0.225	7	118.4546	0.422	115	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(N[6]C[6]Pt)(H)	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[6a]C[6])(N[6]C[6]Pt)(H){1|H<1>,1|N<2>,3|C<3>}	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)(C[6]N[6]H){1|Pt<4>,2|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.5280	0.000	1	118.5280	0.000	1	118.4546	0.422	115	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(N[6]C[6]Re)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[6a]C[6])(N[6]C[6]Re)(H){1|H<1>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H){1|Re<6>,3|C<3>,3|H<1>}	H(C[6]C[6]N[6])	117.9020	0.000	1	117.9020	0.000	1	118.4546	0.422	115	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(N[6]C[6]Re)(H)	C[6](C[6a]N[6a]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[6a]C[6])(N[6]C[6]Re)(H){1|C<3>,2|H<1>,2|N<2>}	C[6](C[6a]N[6a]2)(C[6]C[6]H)(C[6]N[6]H){1|Re<6>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.6593	0.318	6	118.6593	0.101	6	118.4546	0.422	115	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(N[6]C[6]Ru)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[6a]C[6])(N[6]C[6]Ru)(H){1|H<1>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H){1|Ru<6>,3|C<3>,3|H<1>}	H(C[6]C[6]N[6])	118.5080	0.655	4	118.5080	0.430	4	118.4546	0.422	115	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(N[6]C[6]Ru)(H)	C[6](C[6a]N[6a]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[6a]C[6])(N[6]C[6]Ru)(H){1|C<3>,2|H<1>,2|N<2>}	C[6](C[6a]N[6a]2)(C[6]C[6]H)(C[6]N[6]H){1|Ru<9>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.6732	0.218	6	118.6732	0.047	6	118.4546	0.422	115	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(N[6]C[6]Zn)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[6a]C[6])(N[6]C[6]Zn)(H){2|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H){1|Zn<6>,1|C<3>,2|N<2>,3|H<1>}	H(C[6]C[6]N[6])	117.8940	0.000	1	117.8940	0.000	1	118.4546	0.422	115	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(N[6]C[6a]C[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[6a]C[6])(N[6]C[6a]C[6])(H){2|H<1>,5|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H){2|C<4>,5|C<3>}	H(C[6]C[6]N[6])	119.5940	0.027	2	119.5940	0.001	2	118.4546	0.422	115	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(N[6]C[6a]C[6])(H)	C[6](C[6a]C[6a]2)(C[6]N[6]H)2	H(C[6]C[6]N[6])	C[6](C[6]C[6a]C[6])(N[6]C[6a]C[6])(H){1|C<4>,1|H<1>,1|N<2>,5|C<3>}	C[6](C[6a]C[6a]2)(C[6]N[6]H)2{1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.9910	0.000	1	118.9910	0.000	1	118.4546	0.422	115	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(N[6]C[6a]P[6])(H)	C[6](C[6a]C[6a]2)(C[6]N[6]H)2	H(C[6]C[6]N[6])	C[6](C[6]C[6a]C[6])(N[6]C[6a]P[6])(H){1|H<1>,1|I<1>,1|N<3>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]N[6]H)2{1|P<3>,2|H<1>,4|C<3>}	H(C[6]C[6]N[6])	117.4030	0.284	2	117.4030	0.081	2	118.4546	0.422	115	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	N[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5a]C[6])(N[6]C[6]Cu)(H)	C[6](N[5a]C[5a,6a]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]N[5a]C[6])(N[6]C[6]Cu)(H){2|H<1>,3|C<3>}	C[6](N[5a]C[5a,6a]2)(C[6]C[6]H)(C[6]N[6]H){1|Cu<4>,1|N<3>,5|C<3>}	H(C[6]C[6]N[6])	118.6894	0.532	7	118.6894	0.283	7	118.6150	0.253	11	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	N[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5a]C[6])(N[6]C[6]Mn)(H)	C[6](N[5a]C[5a]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]N[5a]C[6])(N[6]C[6]Mn)(H){2|H<1>,3|C<3>}	C[6](N[5a]C[5a]2)(C[6]C[6]H)(C[6]N[6]H){1|Mn<6>,1|C<3>,2|N<2>,3|H<1>}	H(C[6]C[6]N[6])	118.8040	0.123	2	118.8040	0.015	2	118.6150	0.253	11	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	N[5a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5a]C[6])(N[6]C[6]Re)(H)	C[6](N[5a]C[5a,6a]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]N[5a]C[6])(N[6]C[6]Re)(H){1|H<1>,4|C<3>}	C[6](N[5a]C[5a,6a]2)(C[6]C[6]H)(C[6]N[6]H){1|Re<6>,1|H<1>,5|C<3>}	H(C[6]C[6]N[6])	118.1655	0.551	2	118.1655	0.303	2	118.6150	0.253	11	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	N[6,6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[6,6]C[6a])(N[6]C[6]S)(H)	C[6](N[6,6]C[6,6a]C[6,6])(C[6a]C[6a]2)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]N[6,6]C[6a])(N[6]C[6]S)(H){1|C<4>,2|H<1>,3|C<3>}	C[6](N[6,6]C[6,6a]C[6,6])(C[6a]C[6a]2)(C[6]N[6]H){1|S<4>,2|C<4>,3|H<1>,4|C<3>}	H(C[6]C[6]N[6])	118.4860	0.000	1	119.7568	3.922	4	119.7568	3.922	4	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	N[6,6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[6,6]C[6a])(N[6]C[6]S)(H)	C[6](N[6,6]C[6,6a]C[6,6])(C[6a]C[6a]2)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]N[6,6]C[6a])(N[6]C[6]S)(H){1|C<4>,4|C<3>}	C[6](N[6,6]C[6,6a]C[6,6])(C[6a]C[6a]2)(C[6]N[6]H){1|S<4>,3|H<1>,6|C<3>}	H(C[6]C[6]N[6])	120.1803	2.193	3	119.7568	3.922	4	119.7568	3.922	4	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6]O)(H)	C[6](N[6]C[6]Ni)(C[6]N[6]H)(CCN)	H(C[6]C[6]N[6])	C[6](C[6]N[6]C)(N[6]C[6]O)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]N[6]H)(CCN){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]N[6])	120.1590	0.000	1	120.1590	0.000	1	120.1590	0.000	1	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	N[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(N[6]C[6,6a]C)(H)	C[6](N[6]C[6,6a]Cd)(C[6]C[6]N[6])(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]N[6])(N[6]C[6,6a]C)(H){1|Cd<4>,1|N<3>,3|C<3>}	C[6](N[6]C[6,6a]Cd)(C[6]C[6]N[6])(C[6]N[6]H){1|C<4>,1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]N[6])	122.3790	3.718	2	122.3790	13.823	2	122.3790	13.823	2	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	N[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(N[6]C[6]S)(H)	C[6](N[6]C[6a]C[6])(C[6a]C[6a]2)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[6a]N[6])(N[6]C[6]S)(H){1|H<1>,5|C<3>}	C[6](N[6]C[6a]C[6])(C[6a]C[6a]2)(C[6]N[6]H){1|C<4>,1|S<4>,2|H<1>,5|C<3>}	H(C[6]C[6]N[6])	118.5020	0.000	1	118.5020	0.000	1	118.5020	0.000	1	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:N[6]-3:H-1:	N[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[6a]C[6])(N[6]C[6]B)(H)	C[6](N[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]N[6a]C[6])(N[6]C[6]B)(H){2|H<1>,3|C<3>}	C[6](N[6a]C[6a]2)(C[6]C[6]H)(C[6]N[6]H){1|B<4>,1|H<1>,2|O<1>,3|C<3>}	H(C[6]C[6]N[6])	119.1782	0.097	12	119.1782	0.009	12	119.1782	0.009	12	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:P[6]-3:H-1:	C[6,6a]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]C[6a])(P[6]C[6]Mo)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2)(C[6]P[6]H)	H(C[6]C[6]P[6])	C[6](C[6]C[6,6a]C[6a])(P[6]C[6]Mo)(H){5|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2)(C[6]P[6]H){1|Mo<6>,3|H<1>,5|C<3>}	H(C[6]C[6]P[6])	117.3215	0.603	2	117.3215	0.364	2	117.3215	0.364	2	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:Si[6]-3:H-1:	C[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(Si[6]Si[6]Si)(H)	C[6](C[6]C[6a]C[6])(C[6a]C[6a]2)(C[6]Si[6]H)	H(C[6]Si[6]C[6])	C[6](C[6]C[6a]C[6])(Si[6]Si[6]Si)(H){1|Si<4>,4|C<3>}	C[6](C[6]C[6a]C[6])(C[6a]C[6a]2)(C[6]Si[6]H){1|Si<3>,1|Si<4>,3|H<1>,4|C<3>}	H(C[6]Si[6]C[6])	113.3885	0.084	2	113.3885	0.007	2	113.3885	0.007	2	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	C[6]-3:Si[6]-3:H-1:	C[6a]-3:Si[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]Si[6])(Si[6]C[6]Si)(H)	C[6](C[6a]C[6a]2)(Si[6]C[6]Si)(C[6]Si[6]H)	H(C[6]Si[6]C[6])	C[6](C[6]C[6a]Si[6])(Si[6]C[6]Si)(H){1|Si<4>,4|C<3>}	C[6](C[6a]C[6a]2)(Si[6]C[6]Si)(C[6]Si[6]H){1|Si<4>,3|C<3>,3|H<1>}	H(C[6]Si[6]C[6])	119.8980	0.148	4	119.8980	0.022	4	119.8980	0.022	4	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:B-3:	C[6]-3:	C[6](N[5,6]C[5,6]B[5])(C[6]C[6]B)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(BC[6a]2)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]B[5])(C[6]C[6]B)(H){1|H<1>,5|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(BC[6a]2){1|B<4>,1|C<3>,1|H<1>}	H(C[6]N[5,6]C[6])	118.6765	0.115	2	118.6765	0.013	2	118.6765	0.013	2	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[5,6]C[5,6]B[5])(C[6]C[6]C)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(CCH)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]B[5])(C[6]C[6]C)(H){1|H<1>,5|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(CCH){1|B<4>,1|C<3>,1|H<1>}	H(C[6]N[5,6]C[6])	118.5240	0.000	1	118.5240	0.000	1	119.1830	0.496	3	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]C)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(CC[6a]O)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]C)(H){1|C<3>,1|C<4>,1|N<3>,3|H<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(CC[6a]O){1|C<3>,1|C<4>,1|N<3>}	H(C[6]N[5,6]C[6])	119.9250	0.000	1	119.9250	0.000	1	119.1830	0.496	3	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[5,6]C[5,6]In[5])(C[6]C[6]C)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(COO)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]In[5])(C[6]C[6]C)(H){3|Cl<1>,1|H<1>,1|O<2>,1|O<3>,2|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(COO){1|In<6>,1|C<3>,1|H<1>}	H(C[6]N[5,6]C[6])	119.1000	0.000	1	119.1000	0.000	1	119.1830	0.496	3	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]N)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(NOO)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]N)(H){1|C<3>,1|C<4>,1|N<2>,1|N<3>,2|H<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(NOO){1|C<3>,1|C<4>,1|H<1>}	H(C[6]N[5,6]C[6])	120.9080	0.000	1	120.8623	0.005	3	120.8623	0.005	3	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]N)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(NOO)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]N)(H){1|Si<5>,1|C<3>,1|O<2>,3|H<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(NOO){1|C<3>,1|C<4>,1|H<1>}	H(C[6]N[5,6]C[6])	120.8395	0.078	2	120.8623	0.005	3	120.8623	0.005	3	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](N[5,6]C[5,6]B[5])(C[6]C[6a]C[6])(H)	C[6](C[6]N[5,6]H)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]B[5])(C[6]C[6a]C[6])(H){1|H<1>,7|C<3>}	C[6](C[6]N[5,6]H)(C[6a]C[6a]2)(C[6]C[6]H){1|B<4>,3|C<3>,3|H<1>}	H(C[6]N[5,6]C[6])	118.5680	0.000	1	118.5680	0.000	1	118.5680	0.000	1	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[5a,6]-3:C[6]-3:H-1:	N[5a,6]-3:C[6]-3:C[6a]-3:	C[6]-3:	C[6](N[5a,6]C[5a,6]C[5a])(C[6]N[5a,6]C[6a])(H)	C[6](N[5a,6]C[5a,6a]C[5a,6])(C[6]N[5a,6]H)(C[6a]C[6a]2)	H(C[6]N[5a,6]C[6])	C[6](N[5a,6]C[5a,6]C[5a])(C[6]N[5a,6]C[6a])(H){1|H<1>,6|C<3>}	C[6](N[5a,6]C[5a,6a]C[5a,6])(C[6]N[5a,6]H)(C[6a]C[6a]2){1|N<2>,2|H<1>,6|C<3>}	H(C[6]N[5a,6]C[6])	119.0270	0.000	1	119.0270	0.000	1	119.0270	0.000	1	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]C)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]O)(CCO)	H(C[6]N[6,6]C[6])	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]C)(H){1|C<3>,1|O<1>,2|C<4>,3|H<1>}	C[6](C[6]N[6,6]H)(C[6]C[6]O)(CCO){2|C<4>,2|H<1>}	H(C[6]N[6,6]C[6])	116.9975	0.272	2	116.9975	0.074	2	116.9975	0.074	2	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](N[6,6]C[6,6]B[6])(C[6]C[6a]C[6])(H)	C[6](C[6]N[6,6]H)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]N[6,6]C[6])	C[6](N[6,6]C[6,6]B[6])(C[6]C[6a]C[6])(H){1|H<1>,1|N<3>,2|F<1>,4|C<3>}	C[6](C[6]N[6,6]H)(C[6a]C[6a]2)(C[6]C[6]H){1|B<4>,3|C<3>,3|H<1>}	H(C[6]N[6,6]C[6])	118.2390	0.000	1	118.2390	0.000	1	118.2390	0.000	1	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H)	C[6](C[6]N[6,6a]H)(C[6]C[6]H)(CC[6a]O)	H(C[6]N[6,6a]C[6])	C[6](N[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H){2|H<1>,3|C<3>}	C[6](C[6]N[6,6a]H)(C[6]C[6]H)(CC[6a]O){3|C<3>}	H(C[6]N[6,6a]C[6])	119.5480	0.000	1	119.5480	0.000	1	119.5480	0.000	1	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6a]-3:N[6]-3:	C[6]-3:	C[6](N[6,6a]C[6,6a]C[6a])(C[6]C[6a]N[6])(H)	C[6](C[6]N[6,6a]H)(C[6a]C[6a]2)(N[6]C[6]H)	H(C[6]N[6,6a]C[6])	C[6](N[6,6a]C[6,6a]C[6a])(C[6]C[6a]N[6])(H){2|H<1>,5|C<3>}	C[6](C[6]N[6,6a]H)(C[6a]C[6a]2)(N[6]C[6]H){1|O<1>,2|H<1>,4|C<3>}	H(C[6]N[6,6a]C[6])	119.4240	0.000	1	119.4240	0.000	1	119.4240	0.000	1	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:B-3:	C[6]-3:	C[6](N[6]C[6,6a]C)(C[6]C[6]B)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(BOO)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]C)(C[6]C[6]B)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(BOO){1|C<4>,2|C<3>}	H(C[6]C[6]N[6])	118.3840	0.000	1	118.3840	0.000	1	118.1383	0.047	3	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:B-3:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]B)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(BC[6a]2)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]B)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(BC[6a]2){1|Ir<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.9740	0.000	1	117.9740	0.000	1	118.1383	0.047	3	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:B-3:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]B)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(BC[6a]2)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]B)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(BC[6a]2){1|Pt<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.0570	0.000	1	118.0570	0.000	1	118.1383	0.047	3	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[4]C[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CC[6a]O)	H(C[6]C[6]N[6])	C[6](N[6]C[4]C[6])(C[6]C[6]C)(H){2|H<1>,3|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CC[6a]O){1|H<1>,2|C<3>}	H(C[6]C[6]N[6])	119.8170	0.000	1	119.8170	0.000	1	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[5]C[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO)	H(C[6]C[6]N[6])	C[6](N[6]C[5]C[6])(C[6]C[6]C)(H){1|C<3>,1|C<4>,1|O<2>,3|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	124.7690	2.606	2	124.7690	6.793	2	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6,6a]C)(C[6]C[6]C)(H)	C[6](C[6]C[6,6a]O)(C[6]N[6]H)(COO)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]C)(C[6]C[6]C)(H){1|C<3>,1|N<2>,1|O<2>}	C[6](C[6]C[6,6a]O)(C[6]N[6]H)(COO){1|C<4>,2|C<3>}	H(C[6]C[6]N[6])	117.1814	0.263	5	117.4035	0.140	27	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6,6a]C)(C[6]C[6]C)(H)	C[6](C[6]C[6,6a]O)(C[6]N[6]H)(COO)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]C)(C[6]C[6]C)(H){1|O<2>,2|C<3>}	C[6](C[6]C[6,6a]O)(C[6]N[6]H)(COO){1|C<4>,2|C<3>}	H(C[6]C[6]N[6])	117.4540	0.382	22	117.4035	0.140	27	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6,6a]C)(C[6]C[6]C)(H)	C[6](C[6]C[6,6a]S)(C[6]N[6]H)(COO)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]C)(C[6]C[6]C)(H){1|C<3>,1|N<2>,1|S<1>}	C[6](C[6]C[6,6a]S)(C[6]N[6]H)(COO){1|C<4>,2|C<3>}	H(C[6]C[6]N[6])	118.1320	0.402	2	117.8937	0.251	3	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6,6a]C)(C[6]C[6]C)(H)	C[6](C[6]C[6,6a]S)(C[6]N[6]H)(COO)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]C)(C[6]C[6]C)(H){1|C<3>,1|N<2>,1|S<2>}	C[6](C[6]C[6,6a]S)(C[6]N[6]H)(COO){1|C<4>,2|C<3>}	H(C[6]C[6]N[6])	117.4170	0.000	1	117.8937	0.251	3	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6,6a]C[3])(C[6]C[6]C)(H)	C[6](C[6]C[6,6a]C[6a])(C[6]N[6]H)(COO)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]C[3])(C[6]C[6]C)(H){1|H<1>,2|C<4>,3|C<3>}	C[6](C[6]C[6,6a]C[6a])(C[6]N[6]H)(COO){1|C<4>,4|C<3>}	H(C[6]C[6]N[6])	117.9130	0.000	1	117.9130	0.000	1	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6,6a]C[3])(C[6]C[6]C)(H)	C[6](C[6]C[6,6a]O)(C[6]N[6]H)(COO)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]C[3])(C[6]C[6]C)(H){1|H<1>,1|O<2>,2|C<3>,2|C<4>}	C[6](C[6]C[6,6a]O)(C[6]N[6]H)(COO){1|C<4>,2|C<3>}	H(C[6]C[6]N[6])	117.7832	0.545	10	117.7832	0.297	10	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6]Cd)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CCH)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cd)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CCH){1|Cd<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2040	0.000	1	118.2040	0.000	1	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6]Cd)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CC[6a]O)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cd)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CC[6a]O){1|Cd<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3028	0.075	4	118.3028	0.006	4	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6]Cd)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CHN)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cd)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CHN){1|Cd<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5520	0.000	1	118.5520	0.000	1	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6]Cd)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cd)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO){1|Cd<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.3885	1.754	2	119.3885	3.078	2	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6]Cd)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cd)(C[6]C[6]C)(H){1|C<2>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|Cd<6>,1|C<3>}	H(C[6]C[6]N[6])	119.9670	0.000	1	118.8204	0.276	7	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6]Cd)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cd)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|Cd<6>,1|C<3>,1|O<2>}	H(C[6]C[6]N[6])	118.8330	0.000	1	118.8204	0.276	7	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6]Cd)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cd)(C[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|Cd<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5886	0.136	5	118.8204	0.276	7	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CCH)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CCH){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.7370	0.265	4	117.7370	0.070	4	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CCO)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CCO){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4950	0.000	1	118.4950	0.000	1	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CHN)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CHN){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2640	0.000	1	118.2640	0.000	1	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO){1|Co<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6550	0.000	1	118.3586	0.052	33	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3402	0.221	28	118.3586	0.052	33	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4135	0.287	4	118.3586	0.052	33	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|Co<6>,1|C<3>,1|F<1>}	H(C[6]C[6]N[6])	118.0250	0.000	1	118.5554	0.185	10	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.0360	0.000	1	118.5554	0.185	10	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5616	0.406	8	118.5554	0.185	10	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6]Cr)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cr)(C[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|Cr<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.0260	0.000	1	119.0260	0.000	1	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CCO)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CCO){1|Cu<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.9325	0.298	2	117.9325	0.089	2	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CC[6a]O)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CC[6a]O){1|Cu<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.8780	0.000	1	117.8780	0.000	1	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CHO)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CHO){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5280	0.000	1	118.5280	0.000	1	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3470	0.177	8	118.3847	0.034	11	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO){1|Cu<8>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4870	0.000	1	118.3847	0.034	11	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4845	0.281	2	118.3847	0.034	11	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.9175	0.166	2	118.6497	0.289	16	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|Cu<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.4520	0.000	1	118.6497	0.289	16	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|Cu<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.7470	0.000	1	118.6497	0.289	16	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6365	0.617	4	118.6497	0.289	16	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|Cu<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.1930	0.213	4	118.6497	0.289	16	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.0110	0.145	4	118.6497	0.289	16	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6]Fe)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CHN)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Fe)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CHN){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.0750	0.000	1	118.0750	0.000	1	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6]Fe)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Fe)(C[6]C[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.0345	0.613	2	118.8313	0.132	15	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6]Fe)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Fe)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4740	0.000	1	118.8313	0.132	15	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6]Fe)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Fe)(C[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8272	0.339	12	118.8313	0.132	15	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6]Hg)(C[6]C[6]C)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(CNO)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Hg)(C[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(CNO){1|Hg<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6270	0.000	1	118.6270	0.000	1	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6]Hg)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CHN)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Hg)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CHN){1|Hg<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4871	1.185	7	118.4871	1.403	7	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6]Hg)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Hg)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO){1|Hg<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.0146	0.464	5	118.0146	0.215	5	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6]Hg)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Hg)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|Hg<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7605	0.423	19	118.7605	0.179	19	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|Ir<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6435	0.189	2	118.6435	0.036	2	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6]Mn)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CCH)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mn)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CCH){1|Mn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.3240	0.276	2	117.3240	0.076	2	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6]Mn)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CC[6a]O)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mn)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CC[6a]O){1|Mn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2100	0.000	1	118.2100	0.000	1	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6]Mn)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CHN)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mn)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CHN){1|Mn<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.8755	0.095	2	118.0033	0.054	3	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6]Mn)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CHN)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mn)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CHN){1|Mn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2590	0.000	1	118.0033	0.054	3	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6]Mn)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mn)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO){1|Mn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3050	0.161	7	118.2544	0.043	8	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6]Mn)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mn)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO){1|Mn<7>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.9000	0.000	1	118.2544	0.043	8	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6]Mn)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mn)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|Mn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.8150	0.000	1	118.3194	0.087	7	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6]Mn)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mn)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|Mn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.9940	0.000	1	118.3194	0.087	7	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6]Mn)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mn)(C[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|Mn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5370	0.113	2	118.3194	0.087	7	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6]Mn)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mn)(C[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|Mn<7>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4510	0.027	3	118.3194	0.087	7	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6]Mo)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mo)(C[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|Mo<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8400	0.008	2	118.8400	0.000	2	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CCH)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CCH){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.5810	0.642	2	117.5810	0.412	2	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CCO)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CCO){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2160	0.000	1	118.2160	0.000	1	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CHN)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CHN){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2830	0.000	1	118.2830	0.000	1	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3941	0.157	13	118.3941	0.025	13	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]C[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7858	0.233	4	118.6407	0.078	22	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3030	0.133	2	118.6407	0.078	22	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|Ni<6>,2|C<3>}	H(C[6]C[6]N[6])	118.3375	0.063	2	118.6407	0.078	22	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6908	0.265	14	118.6407	0.078	22	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CCH)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CCH){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4370	0.948	7	118.4143	0.719	9	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CCH)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CCH){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3350	0.580	2	118.4143	0.719	9	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7938	0.166	5	118.7938	0.028	5	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]C)(H){1|C<2>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|Pd<4>,1|C<3>}	H(C[6]C[6]N[6])	122.4190	0.000	1	119.2402	1.049	12	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.0476	0.250	5	119.2402	1.049	12	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|Pd<4>,2|C<3>}	H(C[6]C[6]N[6])	119.0195	0.110	2	119.2402	1.049	12	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7965	0.184	4	119.2402	1.049	12	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CCO)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CCO){1|Pt<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5290	0.000	1	118.5290	0.000	1	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO){1|Pt<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.0007	0.403	4	119.0007	0.162	4	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|Pt<6>,2|C<3>}	H(C[6]C[6]N[6])	118.5045	0.138	2	119.0844	3.088	14	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|Pt<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.0570	0.579	5	119.0844	3.088	14	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|Pt<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.9839	2.128	7	119.0844	3.088	14	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]C)(H)	C[6](C[6]N[6]H)2(COO)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]C)(H){1|N<2>,2|H<1>}	C[6](C[6]N[6]H)2(COO){1|Pt<4>,1|C<3>}	H(C[6]C[6]N[6])	119.6090	0.000	1	119.6090	0.000	1	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6]Re)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CC[6a]O)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Re)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CC[6a]O){1|Re<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5820	0.000	1	118.5820	0.000	1	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6]Re)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CHO)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Re)(C[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CHO){1|Re<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.0335	0.585	2	119.0335	0.342	2	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6]Re)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Re)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO){1|Re<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5131	0.473	10	118.5131	0.224	10	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6]Re)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Re)(C[6]C[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|Re<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6890	0.115	2	118.6375	0.029	8	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6]Re)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Re)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|Re<8>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7010	0.000	1	118.6375	0.029	8	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6]Re)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Re)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|Re<6>,2|C<3>}	H(C[6]C[6]N[6])	118.6628	0.190	4	118.6375	0.029	8	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6]Re)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Re)(C[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|Re<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3700	0.000	1	118.6375	0.029	8	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6]Rh)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Rh)(C[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|Rh<8>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8317	0.353	4	118.8317	0.124	4	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]C)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(COO)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]C)(H){3|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(COO){1|Ru<9>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6240	0.000	1	118.6240	0.000	1	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CCO)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CCO){1|Ru<9>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4105	0.938	2	118.4105	0.880	2	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO){1|Ru<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.1164	1.123	5	119.0280	0.768	8	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO){1|Ru<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8807	0.337	3	119.0280	0.768	8	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|Ru<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6309	0.278	12	118.6309	0.077	12	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CCH)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CCH){1|Zn<4>,2|C<3>}	H(C[6]C[6]N[6])	118.4153	0.597	6	118.2634	0.341	8	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CCH)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CCH){1|Zn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.8075	0.223	2	118.2634	0.341	8	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CCN)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CCN){1|Zn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5540	0.000	1	118.3875	0.055	2	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CCN)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CCN){1|Zn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2210	0.000	1	118.3875	0.055	2	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CHN)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CHN){1|Zn<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7740	0.000	1	118.7740	0.000	1	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CHO)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CHO){1|Zn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3610	0.020	2	118.3610	0.000	2	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO){1|Zn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4210	0.225	2	118.4729	0.045	10	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO){1|Zn<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5335	0.131	4	118.4729	0.045	10	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CNO){1|Zn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4382	0.307	4	118.4729	0.045	10	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|Br<1>,1|Zn<6>,1|C<3>}	H(C[6]C[6]N[6])	118.1360	0.132	2	118.4467	0.135	7	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|Zn<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6340	0.109	2	118.4467	0.135	7	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(COO){1|Zn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5290	0.497	3	118.4467	0.135	7	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6a]C[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(CC[6a]O)	H(C[6]C[6]N[6])	C[6](N[6]C[6a]C[6])(C[6]C[6]C)(H){2|C<4>,4|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(CC[6a]O){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6]N[6])	116.8120	0.000	1	116.8120	0.000	1	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6a]C[6])(C[6]C[6]C)(H)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(CC[6a]O)	H(C[6]C[6]N[6])	C[6](N[6]C[6a]C[6])(C[6]C[6]C)(H){6|C<3>}	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(CC[6a]O){1|C<4>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	117.9740	0.404	2	117.9740	0.164	2	118.4871	0.730	379	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]2)(H)	C[6](C[6]C[5a,6]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]2)(H){2|H<1>,3|C<3>}	C[6](C[6]C[5a,6]2)(C[6]C[6]H)(C[6]N[6]H){1|Co<6>,1|H<1>,2|N<3>,3|C<3>}	H(C[6]C[6]N[6])	118.9220	0.000	1	118.9220	0.000	1	118.4519	0.165	28	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]C[6]2)(H)	C[6](C[6]C[6]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]C[6]2)(H){1|H<1>,4|C<3>}	C[6](C[6]C[6]2)(C[6]C[6]H)(C[6]N[6]H){1|Ni<6>,1|N<3>,2|C<3>,3|H<1>}	H(C[6]C[6]N[6])	118.3979	0.344	17	118.3979	0.118	17	118.4519	0.165	28	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]2)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]Pt)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]2)(H){1|Pt<4>,1|N<3>,3|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]Pt)(C[6]N[6]H){1|Pt<4>,2|H<1>,3|C<3>}	H(C[6]C[6]N[6])	119.1170	0.472	2	119.1170	0.223	2	118.4519	0.165	28	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]2)(H)	C[6](C[6]C[6]2)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]2)(H){1|H<1>,4|C<3>}	C[6](C[6]C[6]2)(C[6]C[6]H)(C[6]N[6]H){1|Zn<6>,3|C<3>,3|H<1>}	H(C[6]C[6]N[6])	118.3415	0.393	8	118.3415	0.155	8	118.4519	0.165	28	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](N[6]C[6,6a]C)(C[6]C[6]N)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(NCH)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]C)(C[6]C[6]N)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(NCH){1|C<4>,2|C<3>}	H(C[6]C[6]N[6])	118.9147	0.141	3	118.9147	0.020	3	118.7642	0.491	167	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](N[6]C[6]Ag)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NCH)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ag)(C[6]C[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NCH){1|Ag<3>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4230	0.000	1	118.4230	0.000	1	118.7642	0.491	167	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](N[6]C[6]Cd)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NCH)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cd)(C[6]C[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NCH){1|Cd<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4209	0.204	8	118.4209	0.042	8	118.7642	0.491	167	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](N[6]C[6]Cd)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NHH)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cd)(C[6]C[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NHH){1|Cd<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.1470	0.356	2	118.1470	0.127	2	118.7642	0.491	167	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](N[6]C[6]Cd)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NHP)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cd)(C[6]C[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NHP){1|Cd<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2488	0.918	8	118.2488	0.844	8	118.7642	0.491	167	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NCH)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NCH){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7676	0.165	5	118.7676	0.027	5	118.7642	0.491	167	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NHH)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NHH){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	120.2620	0.000	1	118.8410	0.684	5	118.7642	0.491	167	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NHH)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NHH){1|Co<7>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5565	0.407	2	118.8410	0.684	5	118.7642	0.491	167	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NHH)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]N)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NHH){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4150	0.167	2	118.8410	0.684	5	118.7642	0.491	167	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NHP)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NHP){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7126	1.085	7	118.7126	1.177	7	118.7642	0.491	167	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NOO)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NOO){1|Co<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.8210	0.000	1	119.8210	0.000	1	118.7642	0.491	167	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NCH)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NCH){1|Cu<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2917	0.078	3	118.2917	0.006	3	118.7642	0.491	167	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NHH)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NHH){1|Cu<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2830	0.000	1	118.4005	0.028	2	118.7642	0.491	167	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NHH)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NHH){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5180	0.000	1	118.4005	0.028	2	118.7642	0.491	167	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](N[6]C[6]Fe)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NHH)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Fe)(C[6]C[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NHH){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.9670	0.000	1	118.7230	1.200	10	118.7642	0.491	167	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](N[6]C[6]Fe)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NHH)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Fe)(C[6]C[6]N)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NHH){1|Fe<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.4370	0.000	1	118.7230	1.200	10	118.7642	0.491	167	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](N[6]C[6]Fe)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NHH)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Fe)(C[6]C[6]N)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NHH){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7283	1.178	8	118.7230	1.200	10	118.7642	0.491	167	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](N[6]C[6]Hg)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NCH)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Hg)(C[6]C[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NCH){1|Hg<3>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.2120	0.000	1	118.7768	0.147	13	118.7642	0.491	167	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](N[6]C[6]Hg)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NCH)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Hg)(C[6]C[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NCH){1|Hg<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7406	0.377	12	118.7768	0.147	13	118.7642	0.491	167	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NC[6a]2)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]N)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NC[6a]2){1|Ir<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8230	0.000	1	118.8230	0.000	1	118.7642	0.491	167	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NIrN)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NIrN){1|Ir<8>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7810	1.165	2	118.7810	1.358	2	118.7642	0.491	167	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NOO)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]N)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NOO){1|Ir<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.2750	0.832	2	119.2750	0.691	2	118.7642	0.491	167	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](N[6]C[6]Mn)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NCH)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mn)(C[6]C[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NCH){1|Mn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8040	0.129	2	118.8040	0.017	2	118.7642	0.491	167	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](N[6]C[6]Mn)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NHH)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mn)(C[6]C[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NHH){1|Mn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.0620	0.000	1	118.0620	0.000	1	118.7642	0.491	167	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NCH)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]C[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NCH){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.1192	0.166	4	118.1192	0.028	4	118.7642	0.491	167	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NHH)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]C[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NHH){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.9235	1.890	2	119.9235	3.572	2	118.7642	0.491	167	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NOO)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]C[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NOO){1|Ni<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.4230	0.621	2	119.4230	0.385	2	118.7642	0.491	167	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NCH)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NCH){1|Pd<4>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	119.4875	0.126	4	118.9512	0.303	52	118.7642	0.491	167	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NCH)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NCH){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.9065	0.549	48	118.9512	0.303	52	118.7642	0.491	167	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NOO)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NOO){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	120.2560	0.000	1	120.2560	0.000	1	118.7642	0.491	167	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NCH)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]N)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NCH){1|Pt<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5030	0.000	1	118.4336	0.409	5	118.7642	0.491	167	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NCH)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]N)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NCH){1|Pt<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4163	0.737	4	118.4336	0.409	5	118.7642	0.491	167	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NOO)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]N)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NOO){1|Pt<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	120.2275	0.120	2	120.2275	0.014	2	118.7642	0.491	167	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](N[6]C[6]Re)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NHH)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Re)(C[6]C[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NHH){1|Re<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5776	0.310	5	118.5776	0.096	5	118.7642	0.491	167	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NHH)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NHH){1|Ru<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.1200	0.215	3	118.1200	0.046	3	118.7642	0.491	167	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NCH)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NCH){1|Zn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6634	0.641	11	118.5842	0.386	13	118.7642	0.491	167	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NCH)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NCH){1|Zn<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.1485	0.276	2	118.5842	0.386	13	118.7642	0.491	167	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NHH)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NHH){1|Zn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2780	0.000	1	118.2780	0.000	1	118.7642	0.491	167	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NOO)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NOO){1|Zn<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.7140	0.000	1	119.7140	0.000	1	118.7642	0.491	167	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-3:	C[6]-3:	C[6](N[6]B[5]C[6])(C[6]N[6]C)(H)	C[6](C[6]N[6]H)(N[6]C[6]B)(CHN)	H(C[6]C[6]N[6])	C[6](N[6]B[5]C[6])(C[6]N[6]C)(H){1|B<3>,1|C<3>,1|H<1>,2|O<2>}	C[6](C[6]N[6]H)(N[6]C[6]B)(CHN){1|B<3>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.0780	0.000	1	119.0780	0.000	1	119.0780	0.000	1	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-3:	C[6]-3:	C[6](N[6]C[6]Fe)(C[6]N[6]N)(H)	C[6](C[6]N[6]H)(N[6]C[6]H)(NHH)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Fe)(C[6]N[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]N[6]H)(N[6]C[6]H)(NHH){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7010	0.000	1	118.7010	0.000	1	118.7010	0.000	1	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](N[6]As[6]C[6a])(C[6]C[6a]C[6])(H)	C[6](C[6a]C[6a]2)(C[6]N[6]H)2	H(C[6]C[6]N[6])	C[6](N[6]As[6]C[6a])(C[6]C[6a]C[6])(H){1|As<2>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]N[6]H)2{1|As<3>,2|H<1>,4|C<3>}	H(C[6]C[6]N[6])	116.5690	0.464	2	116.7373	0.334	4	116.1417	0.595	22	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](N[6]As[6]C[6a])(C[6]C[6a]C[6])(H)	C[6](C[6a]C[6a]2)(C[6]N[6]H)2	H(C[6]C[6]N[6])	C[6](N[6]As[6]C[6a])(C[6]C[6a]C[6])(H){1|H<1>,1|N<3>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]N[6]H)2{1|As<2>,2|H<1>,4|C<3>}	H(C[6]C[6]N[6])	116.9055	0.821	2	116.7373	0.334	4	116.1417	0.595	22	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](N[6]C[6,6]C[6])(C[6]C[6a]C[6])(H)	C[6](C[6a]C[6a]2)(C[6]N[6]H)(C[6]N[6]N)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6]C[6])(C[6]C[6a]C[6])(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>,4|C<4>}	C[6](C[6a]C[6a]2)(C[6]N[6]H)(C[6]N[6]N){2|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]N[6])	118.0900	0.000	1	117.8940	0.077	2	116.1417	0.595	22	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](N[6]C[6,6]C[6])(C[6]C[6a]C[6])(H)	C[6](C[6a]C[6a]2)(C[6]N[6]H)(C[6]N[6]N)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6]C[6])(C[6]C[6a]C[6])(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>,4|C<4>}	C[6](C[6a]C[6a]2)(C[6]N[6]H)(C[6]N[6]N){2|C<3>,2|C<4>,3|H<1>}	H(C[6]C[6]N[6])	117.6980	0.000	1	117.8940	0.077	2	116.1417	0.595	22	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](N[6]C[6a]Ga[6])(C[6]C[6a]C[6])(H)	C[6](C[6a]C[6a]2)(C[6]N[6]H)2	H(C[6]C[6]N[6])	C[6](N[6]C[6a]Ga[6])(C[6]C[6a]C[6])(H){2|Cl<1>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]N[6]H)2{1|Ga<4>,2|H<1>,4|C<3>}	H(C[6]C[6]N[6])	116.2950	0.354	2	116.2950	0.125	2	116.1417	0.595	22	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](N[6]C[6a]In[6])(C[6]C[6a]C[6])(H)	C[6](C[6a]C[6a]2)(C[6]N[6]H)2	H(C[6]C[6]N[6])	C[6](N[6]C[6a]In[6])(C[6]C[6a]C[6])(H){1|Cl<1>,1|H<1>,1|N<3>,1|S<2>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]N[6]H)2{1|In<4>,2|H<1>,4|C<3>}	H(C[6]C[6]N[6])	115.7805	0.383	4	115.6658	0.076	12	116.1417	0.595	22	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](N[6]C[6a]In[6])(C[6]C[6a]C[6])(H)	C[6](C[6a]C[6a]2)(C[6]N[6]H)2	H(C[6]C[6]N[6])	C[6](N[6]C[6a]In[6])(C[6]C[6a]C[6])(H){1|Cl<1>,1|In<4>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]N[6]H)2{1|In<4>,2|H<1>,4|C<3>}	H(C[6]C[6]N[6])	115.5613	0.220	6	115.6658	0.076	12	116.1417	0.595	22	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](N[6]C[6a]In[6])(C[6]C[6a]C[6])(H)	C[6](C[6a]C[6a]2)(C[6]N[6]H)2	H(C[6]C[6]N[6])	C[6](N[6]C[6a]In[6])(C[6]C[6a]C[6])(H){1|H<1>,1|N<2>,2|N<3>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]N[6]H)2{1|In<4>,2|H<1>,4|C<3>}	H(C[6]C[6]N[6])	115.7500	0.153	2	115.6658	0.076	12	116.1417	0.595	22	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](N[6]In[4,6]C[6a])(C[6]C[6a]C[6])(H)	C[6](C[6a]C[6a]2)(C[6]N[6]H)2	H(C[6]C[6]N[6])	C[6](N[6]In[4,6]C[6a])(C[6]C[6a]C[6])(H){1|Cl<1>,1|H<1>,1|N<3>,2|O<3>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]N[6]H)2{1|In<5>,2|H<1>,4|C<3>}	H(C[6]C[6]N[6])	115.9000	0.079	2	115.9000	0.006	2	116.1417	0.595	22	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]N[6]H)(CNO)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]N[6]C)(H){1|Co<6>,2|C<3>}	C[6](N[6]C[6]Co)(C[6]N[6]H)(CNO){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.8943	0.470	6	119.8943	0.221	6	119.1304	0.912	14	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]N[6]H)(CCN)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]N[6]C)(H){1|Cu<4>,2|C<3>}	C[6](N[6]C[6]Cu)(C[6]N[6]H)(CCN){1|Cu<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.0820	0.000	1	119.0820	0.000	1	119.1304	0.912	14	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]N[6]H)(COO)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]N[6]C)(H){1|Cu<6>,2|C<3>}	C[6](N[6]C[6]Cu)(C[6]N[6]H)(COO){1|Cu<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7690	0.000	1	118.7690	0.000	1	119.1304	0.912	14	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6]Fe)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]N[6]H)(CHP)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Fe)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]N[6]H)(CHP){1|Fe<6>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	117.6113	0.106	3	117.6113	0.011	3	119.1304	0.912	14	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6]Re)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]N[6]H)(COO)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Re)(C[6]N[6]C)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]N[6]H)(COO){1|Re<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.0770	0.000	1	119.0770	0.000	1	119.1304	0.912	14	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]N[6]H)(COO)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]N[6]C)(H){1|Ru<9>,2|C<3>}	C[6](N[6]C[6]Ru)(C[6]N[6]H)(COO){1|Ru<9>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.5340	0.000	1	119.5340	0.000	1	119.1304	0.912	14	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]N[6]H)(COO)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]N[6]C)(H){1|Zn<6>,2|C<3>}	C[6](N[6]C[6]Zn)(C[6]N[6]H)(COO){1|Zn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.1630	0.000	1	119.1630	0.000	1	119.1304	0.912	14	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]N[6]N)(H)	C[6](N[6]C[6]Pt)(C[6]N[6]H)(NC[6]C)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]N[6]N)(H){1|Pt<4>,1|C<3>,1|N<3>}	C[6](N[6]C[6]Pt)(C[6]N[6]H)(NC[6]C){1|Ir<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6470	0.000	1	118.6470	0.000	1	118.9945	0.242	2	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	N[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ir)(C[6]N[6]H)(NC[6]C)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]N[6]N)(H){1|Ir<6>,1|C<3>,1|N<3>}	C[6](N[6]C[6]Ir)(C[6]N[6]H)(NC[6]C){1|Pt<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.3420	0.000	1	119.3420	0.000	1	118.9945	0.242	2	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	P[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](P[6]C[6]Cu)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]P[6]H)(COO)	H(C[6]C[6]P[6])	C[6](P[6]C[6]Cu)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]P[6]H)(COO){1|Cu<4>,1|C<3>,1|H<1>}	H(C[6]C[6]P[6])	117.8660	0.000	1	117.8660	0.000	1	117.3830	0.467	2	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:3:	3:	P[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](P[6]C[6]Sm)(C[6]C[6]C)(H)	C[6](C[6]C[6]C)(C[6]P[6]H)(CHH)	H(C[6]C[6]P[6])	C[6](P[6]C[6]Sm)(C[6]C[6]C)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6]C)(C[6]P[6]H)(CHH){1|Sm<12>,1|C<3>,1|H<1>}	H(C[6]C[6]P[6])	116.9000	0.000	1	116.9000	0.000	1	117.3830	0.467	2	120.1213	0.981	32705	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[3x6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[3x6]C[3x6]C[6,6])(C[6]N[6]C)(H)	C[6](C[6]C[3x6]H)(N[6]C[6]Fe)(CN[5]HH)	H(C[6]C[3x6]C[6])	C[6](C[3x6]C[3x6]C[6,6])(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[3x6]H)(N[6]C[6]Fe)(CN[5]HH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[3x6]C[6])	120.0050	0.485	4	120.0050	0.235	4	120.0050	0.235	4	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[5,6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[5,6]C[5,6a]N[5,6])(C[6]C[5,6]C)(H)	C[6](C[5,6]C[5,6a]C[5,6])(C[6]C[5,6]H)(CH3)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6a]N[5,6])(C[6]C[5,6]C)(H){1|C<4>,4|C<3>}	C[6](C[5,6]C[5,6a]C[5,6])(C[6]C[5,6]H)(CH3){1|C<4>,1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[5,6]C[6])	119.4620	0.000	1	119.5605	0.019	2	119.5605	0.019	2	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[5,6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[5,6]C[5,6a]N[5,6])(C[6]C[5,6]C)(H)	C[6](C[5,6]C[5,6a]C[5,6])(C[6]C[5,6]H)(CH3)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6a]N[5,6])(C[6]C[5,6]C)(H){1|C<4>,4|C<3>}	C[6](C[5,6]C[5,6a]C[5,6])(C[6]C[5,6]H)(CH3){1|N<3>,2|C<4>,3|C<3>}	H(C[6]C[5,6]C[6])	119.6590	0.000	1	119.5605	0.019	2	119.5605	0.019	2	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[5,6]C[5,6,6a]C[5])(C[6]C[6]C)(H)	C[6](C[6]C[6,6a]O)(C[6]C[5,6]H)(CCHO)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6,6a]C[5])(C[6]C[6]C)(H){1|C<4>,1|O<1>,3|C<3>}	C[6](C[6]C[6,6a]O)(C[6]C[5,6]H)(CCHO){3|C<3>}	H(C[6]C[5,6]C[6])	119.6610	0.011	2	119.6610	0.000	2	119.8687	0.142	22	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[5,6]C[5,6,6a]C[5])(C[6]C[6]C)(H)	C[6](C[6]C[6,6a]O)(C[6]C[5,6]H)(CHHO)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6,6a]C[5])(C[6]C[6]C)(H){1|C<4>,1|O<1>,3|C<3>}	C[6](C[6]C[6,6a]O)(C[6]C[5,6]H)(CHHO){3|C<3>}	H(C[6]C[5,6]C[6])	119.8700	0.000	1	119.8700	0.000	1	119.8687	0.142	22	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]C)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(CH3)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]C)(H){1|C<4>,1|O<1>,3|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]O)(CH3){1|C<4>,2|C<3>}	H(C[6]C[5,6]C[6])	119.7810	0.000	1	119.7810	0.000	1	119.8687	0.142	22	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[5,6]C[5,6]N[5,6])(C[6]C[6]C)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(CC3)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]N[5,6])(C[6]C[6]C)(H){1|Ga<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(CC3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[5,6]C[6])	120.1640	0.120	2	119.6855	0.194	6	119.8687	0.142	22	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[5,6]C[5,6]N[5,6])(C[6]C[6]C)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(CC3)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]N[5,6])(C[6]C[6]C)(H){1|In<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(CC3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[5,6]C[6])	119.4462	0.300	4	119.6855	0.194	6	119.8687	0.142	22	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[5,6]C[5,6]N[5,6])(C[6]C[6]C)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(CH3)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]N[5,6])(C[6]C[6]C)(H){1|In<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[5,6]C[6])	119.9308	0.081	4	119.9308	0.007	4	119.8687	0.142	22	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[5,6]C[5,6a]C[5,6])(C[6]C[6]C)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(CC3)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6a]C[5,6])(C[6]C[6]C)(H){1|Zr<12>,1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(CC3){1|Zr<12>,1|C<3>,2|C<4>}	H(C[6]C[5,6]C[6])	120.2720	0.000	1	120.0572	0.023	5	119.8687	0.142	22	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[5,6]C[5,6a]C[5,6])(C[6]C[6]C)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(CC3)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6a]C[5,6])(C[6]C[6]C)(H){1|Zr<8>,1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(CC3){1|C<3>,2|C<4>}	H(C[6]C[5,6]C[6])	119.9640	0.000	1	120.0572	0.023	5	119.8687	0.142	22	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[5,6]C[5,6a]C[5,6])(C[6]C[6]C)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(CC3)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6a]C[5,6])(C[6]C[6]C)(H){1|Zr<9>,1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(CC3){1|Zr<9>,1|C<3>,2|C<4>}	H(C[6]C[5,6]C[6])	120.0875	0.036	2	120.0572	0.023	5	119.8687	0.142	22	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[5,6]C[5,6a]C[5,6])(C[6]C[6]C)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(CC3)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6a]C[5,6])(C[6]C[6]C)(H){1|Zr<9>,1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(CC3){1|C<3>,2|C<4>}	H(C[6]C[5,6]C[6])	119.8750	0.000	1	120.0572	0.023	5	119.8687	0.142	22	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[5,6]N[5,5,6]C[5,6])(C[6]C[6]C)(H)	C[6](C[6]C[5,6]H)2(CC3)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,5,6]C[5,6])(C[6]C[6]C)(H){1|Ga<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[5,6]H)2(CC3){1|N<3>,2|C<3>}	H(C[6]C[5,6]C[6])	119.9060	1.141	2	119.9060	1.302	2	119.8687	0.142	22	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[5,6]N[5,6]N[5])(C[6]C[6]C)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(CH3)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]N[5])(C[6]C[6]C)(H){1|Cu<4>,1|H<1>,1|S<2>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(CH3){1|H<1>,2|N<3>}	H(C[6]C[5,6]C[6])	120.2050	0.000	1	120.2050	0.000	1	119.8687	0.142	22	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6a]-3:C[6]-4:	C[6]-3:	C[6](C[5,6]C[5,6]C[5])(C[6]C[6a]C[6])(H)	C[6](C[6]C[5,6]H)(C[6a]C[6a]2)(C[6]C[6]CH)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5])(C[6]C[6a]C[6])(H){1|O<2>,2|C<4>,2|H<1>,4|C<3>}	C[6](C[6]C[5,6]H)(C[6a]C[6a]2)(C[6]C[6]CH){1|C<4>,3|H<1>,4|C<3>}	H(C[6]C[5,6]C[6])	118.4820	0.000	1	118.4820	0.000	1	118.4820	0.000	1	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[5a,6]C[5a,6]N[5a,6])(C[6]C[6]C)(H)	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(CC3)	H(C[6]C[5a,6]C[6])	C[6](C[5a,6]C[5a,6]N[5a,6])(C[6]C[6]C)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(CC3){1|C<3>,1|N<3>,1|S<2>}	H(C[6]C[5a,6]C[6])	119.6240	0.255	2	119.6190	0.032	3	119.8532	0.522	6	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[5a,6]C[5a,6]N[5a,6])(C[6]C[6]C)(H)	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(CC3)	H(C[6]C[5a,6]C[6])	C[6](C[5a,6]C[5a,6]N[5a,6])(C[6]C[6]C)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(CC3){1|C<3>,1|N<3>,1|S<3>}	H(C[6]C[5a,6]C[6])	119.6090	0.000	1	119.6190	0.032	3	119.8532	0.522	6	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[5a,6]N[5a,6]C[5a])(C[6]C[6]C)(H)	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(CH3)	H(C[6]C[5a,6]C[6])	C[6](C[5a,6]N[5a,6]C[5a])(C[6]C[6]C)(H){1|H<1>,4|C<3>}	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[5a,6]C[6])	119.4800	0.066	2	119.4800	0.004	2	119.8532	0.522	6	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[5a,6]N[5a,6]O[5a])(C[6]C[6]C)(H)	C[6](C[6]C[5a,6]H)(C[6]C[6]C)(CH3)	H(C[6]C[5a,6]C[6])	C[6](C[5a,6]N[5a,6]O[5a])(C[6]C[6]C)(H){1|C<4>,3|C<3>}	C[6](C[6]C[5a,6]H)(C[6]C[6]C)(CH3){1|C<4>,1|N<3>,1|O<2>}	H(C[6]C[5a,6]C[6])	121.3020	0.000	1	121.3020	0.000	1	119.8532	0.522	6	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6a]-3:C[6]-4:	C[6]-3:	C[6](C[5a,6]C[5a,6]N[5a])(C[6]C[6a]C[6])(H)	C[6](C[6]C[5a,6]H)(C[6a]C[6a]2)(C[6]C[6]HH)	H(C[6]C[5a,6]C[6])	C[6](C[5a,6]C[5a,6]N[5a])(C[6]C[6a]C[6])(H){1|C<4>,1|N<2>,1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[5a,6]H)(C[6a]C[6a]2)(C[6]C[6]HH){1|N<2>,3|C<3>,4|H<1>}	H(C[6]C[5a,6]C[6])	119.6020	0.000	1	119.6020	0.000	1	119.6020	0.000	1	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6,6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-3:C[6]-4:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[5a]C[6])(H)	C[6](C[5a]C[5a]S[5a])(C[6]C[6,6]H)(C[6]C[6]HH)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[5a]C[6])(H){1|S<2>,2|C<3>,2|C<4>,4|H<1>}	C[6](C[5a]C[5a]S[5a])(C[6]C[6,6]H)(C[6]C[6]HH){1|C<4>,3|C<3>,3|H<1>}	H(C[6]C[6,6]C[6])	117.5670	0.000	1	117.5670	0.000	1	117.5670	0.000	1	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]C[6,6a]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(CCHH)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]C[6,6a]C)(H){1|B<4>,1|H<1>,3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(CCHH){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6,6]C[6])	119.0970	0.059	4	119.0970	0.003	4	118.9453	0.067	14	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]C[6,6a]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(CH3)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]C[6,6a]C)(H){1|B<4>,1|H<1>,3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(CH3){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6,6]C[6])	118.8846	0.285	10	118.8846	0.081	10	118.9453	0.067	14	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6,6]C[3x6]C[6])(C[6]C[6]C)(H)	C[6](C[6]C[6,6]H)2(CC3)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[3x6]C[6])(C[6]C[6]C)(H){1|C<2>,1|H<1>,2|C<3>,2|C<4>}	C[6](C[6]C[6,6]H)2(CC3){1|C<4>,2|C<3>}	H(C[6]C[6,6]C[6])	119.0855	0.231	2	118.7521	0.084	7	118.8849	0.375	31	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6,6]C[3x6]C[6])(C[6]C[6]C)(H)	C[6](C[6]C[6,6]H)2(CC3)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[3x6]C[6])(C[6]C[6]C)(H){2|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[6,6]H)2(CC3){1|C<4>,2|C<3>}	H(C[6]C[6,6]C[6])	118.6188	0.187	5	118.7521	0.084	7	118.8849	0.375	31	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6,6]C[4x6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[3x6]O)(C[6]C[6,6]H)(CH3)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[4x6]N[6])(C[6]C[6]C)(H){1|C<4>,1|O<1>,2|C<3>}	C[6](C[6]C[3x6]O)(C[6]C[6,6]H)(CH3){1|C<3>,1|C<4>,1|N<2>}	H(C[6]C[6,6]C[6])	118.5180	0.000	1	118.5180	0.000	1	118.8849	0.375	31	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]C)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(CC3)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]C)(H){1|Th<17>,1|C<3>,1|H<1>,1|O<3>,3|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(CC3){1|Th<17>,1|N<3>,2|C<4>}	H(C[6]C[6,6]C[6])	118.7830	0.423	2	118.7830	0.179	2	118.8849	0.375	31	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]C)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(CCCH)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]C)(H){1|C<4>,1|H<1>,1|O<1>,2|C<3>}	C[6](C[6]C[6,6]H)(C[6]C[6]O)(CCCH){1|O<2>,2|C<3>}	H(C[6]C[6,6]C[6])	118.3290	0.000	1	118.3290	0.000	1	118.8849	0.375	31	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]C)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(CH3)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]C)(H){1|C<3>,1|C<4>,1|H<1>,2|N<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]C)(CH3){1|Ru<5>,2|C<3>}	H(C[6]C[6,6]C[6])	118.3440	0.344	2	118.3440	0.118	2	118.8849	0.375	31	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]C)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]C)(H){1|Os<8>,1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(CH3){1|Os<8>,1|C<3>,1|C<4>}	H(C[6]C[6,6]C[6])	119.7310	0.129	2	119.7310	0.017	2	118.8849	0.375	31	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]C)(H)	C[6](C[6]C[6a]N[6])(C[6]C[6,6]H)(CH3)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]C)(H){1|C<3>,1|N<3>,2|C<4>,2|H<1>}	C[6](C[6]C[6a]N[6])(C[6]C[6,6]H)(CH3){1|C<4>,1|N<2>,1|O<1>,2|C<3>}	H(C[6]C[6,6]C[6])	119.8910	0.055	2	119.8910	0.003	2	118.8849	0.375	31	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6,6]C[6,6]N[6,6])(C[6]C[6]C)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(CH3)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]N[6,6])(C[6]C[6]C)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6,6]C[6])	119.4100	0.431	2	119.4100	0.186	2	118.8849	0.375	31	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6,6]C[6,6a]C[3x6])(C[6]C[6]C)(H)	C[6](C[6]C[6,6]H)2(CC3)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]C[3x6])(C[6]C[6]C)(H){1|H<1>,2|C<4>,3|C<3>}	C[6](C[6]C[6,6]H)2(CC3){1|C<4>,2|C<3>}	H(C[6]C[6,6]C[6])	118.1152	0.216	5	118.1152	0.046	5	118.8849	0.375	31	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6,6]C[6,6a]N[6,6])(C[6]C[6]C)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(CH3)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]N[6,6])(C[6]C[6]C)(H){1|B<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6,6]C[6])	119.5010	0.000	1	119.3628	0.027	6	118.8849	0.375	31	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6,6]C[6,6a]N[6,6])(C[6]C[6]C)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(CH3)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]N[6,6])(C[6]C[6]C)(H){1|C<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6,6]C[6])	119.3352	0.168	5	119.3628	0.027	6	118.8849	0.375	31	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(CH3)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]N[6])(C[6]C[6]C)(H){1|H<1>,1|S<4>,2|C<3>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(CH3){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6,6]C[6])	118.2500	0.000	1	118.2500	0.000	1	118.8849	0.375	31	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-4:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]S)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(SC[6a]OO)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]S)(H){1|C<3>,1|C<4>,1|H<1>,1|O<1>,2|O<2>}	C[6](C[6]C[6,6]H)(C[6]C[6]O)(SC[6a]OO){1|C<3>,1|C<4>,2|O<2>}	H(C[6]C[6,6]C[6])	118.9650	0.000	1	118.9650	0.000	1	118.9650	0.000	1	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6a]-3:C[6]-4:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6a]C[6])(H)	C[6](C[6]C[6,6]H)(C[6a]C[6a]2)(C[6]C[6]HH)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6a]C[6])(H){2|C<4>,3|C<3>,4|H<1>}	C[6](C[6]C[6,6]H)(C[6a]C[6a]2)(C[6]C[6]HH){1|C<4>,3|C<3>,4|H<1>}	H(C[6]C[6,6]C[6])	117.4350	0.000	1	117.4350	0.000	1	117.4350	0.000	1	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6a]-3:S[6]-4:	C[6]-3:	C[6](C[6,6]C[6,6]S[6])(C[6]C[6a]S[6])(H)	C[6](C[6]C[6,6]H)(C[6a]C[6a]2)(S[6]O[6]OO)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]S[6])(C[6]C[6a]S[6])(H){1|C<4>,1|O<2>,3|C<3>,4|O<1>}	C[6](C[6]C[6,6]H)(C[6a]C[6a]2)(S[6]O[6]OO){1|S<4>,2|H<1>,3|C<3>}	H(C[6]C[6,6]C[6])	118.1830	0.000	1	118.1830	0.000	1	118.1830	0.000	1	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6,6]N[6,6]C[6])(C[6]N[6]C)(H)	C[6](C[6]C[6,6]H)(N[6]B[6]H)(CH3)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6])(C[6]N[6]C)(H){1|B<4>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6]H)(N[6]B[6]H)(CH3){1|N<3>,3|C<3>}	H(C[6]C[6,6]C[6])	119.3630	0.000	1	119.3630	0.000	1	119.3630	0.000	1	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[5a]-3:C[6]-4:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5a]C[6])(H)	C[6](C[6]C[6,6a]H)(C[5a]N[5a]2)(C[6]O[6]HH)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5a]C[6])(H){1|O<2>,2|C<3>,2|N<2>,3|H<1>}	C[6](C[6]C[6,6a]H)(C[5a]N[5a]2)(C[6]O[6]HH){1|O<2>,3|C<3>}	H(C[6]C[6,6a]C[6])	119.9840	0.000	1	119.9840	0.000	1	119.9840	0.000	1	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6,6a]C[5,6a]C[6,6a])(C[6]C[6]C)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(CH3)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[5,6a]C[6,6a])(C[6]C[6]C)(H){1|C<4>,1|O<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(CH3){1|O<1>,2|C<3>}	H(C[6]C[6,6a]C[6])	117.8060	0.525	2	117.8060	0.275	2	118.7501	0.933	27	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6,6a]C[6,6,6a]C[6a])(C[6]C[6]C)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6,6]O)(CHHO)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6,6a]C[6a])(C[6]C[6]C)(H){1|C<4>,1|H<1>,1|O<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6,6]O)(CHHO){1|O<2>,3|C<3>}	H(C[6]C[6,6a]C[6])	118.8510	0.000	1	118.8510	0.000	1	118.7501	0.933	27	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H)	C[6](C[6]C[6,6a]H)(C[6]C[5,6]O)(CH3)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H){1|C<4>,1|H<1>,1|O<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[5,6]O)(CH3){1|C<4>,1|O<2>,2|C<3>}	H(C[6]C[6,6a]C[6])	117.5150	0.000	1	117.5150	0.000	1	118.7501	0.933	27	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6,6]O)(CBrHH)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H){1|C<4>,1|H<1>,1|O<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6,6]O)(CBrHH){1|C<4>,1|O<2>,2|C<3>}	H(C[6]C[6,6a]C[6])	121.5260	0.000	1	121.5260	0.000	1	118.7501	0.933	27	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(CC[6a]2O)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H){1|H<1>,1|O<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(CC[6a]2O){3|C<3>}	H(C[6]C[6,6a]C[6])	118.4390	0.000	1	118.4390	0.000	1	118.7501	0.933	27	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(CH3)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H){1|C<4>,1|H<1>,1|O<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(CH3){1|C<4>,3|C<3>}	H(C[6]C[6,6a]C[6])	117.7722	0.254	4	117.8628	0.156	6	118.7501	0.933	27	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(CH3)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H){1|C<4>,1|H<1>,1|O<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(CH3){2|C<3>,2|C<4>}	H(C[6]C[6,6a]C[6])	118.0440	0.697	2	117.8628	0.156	6	118.7501	0.933	27	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(CHHS)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H){1|H<1>,1|O<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(CHHS){3|C<3>}	H(C[6]C[6,6a]C[6])	118.0775	0.859	2	118.0775	0.738	2	118.7501	0.933	27	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(CH3)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(CH3){1|C<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.2820	0.000	1	119.4547	0.173	7	118.7501	0.933	27	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(CH3)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(CH3){1|Cu<5>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.1343	0.208	3	119.4547	0.173	7	118.7501	0.933	27	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(CH3)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(CH3){1|O<1>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.0850	0.000	1	119.4547	0.173	7	118.7501	0.933	27	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(CH3)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(CH3){1|Zn<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.7065	0.302	2	119.4547	0.173	7	118.7501	0.933	27	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]N)(CH3)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]N)(CH3){1|O<1>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.5520	0.000	1	119.5520	0.000	1	118.7501	0.933	27	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H)	C[6](C[6]C[6,6a]H)(C[6]O[6]N)(CHHO)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H){1|H<1>,1|N<2>,1|O<2>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]O[6]N)(CHHO){2|C<3>}	H(C[6]C[6,6a]C[6])	119.2110	0.049	2	119.2110	0.002	2	118.7501	0.933	27	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H)	C[6](C[6]C[6,6a]H)(C[6]O[6]Ru)(CHHN)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H){1|Ru<8>,1|H<1>,1|O<2>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]O[6]Ru)(CHHN){2|C<3>}	H(C[6]C[6,6a]C[6])	118.8210	0.000	1	118.8210	0.000	1	118.7501	0.933	27	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6,6a]C[6a,6a]N[6,6a])(C[6]C[6]C)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(CH3)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6a,6a]N[6,6a])(C[6]C[6]C)(H){1|B<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6,6a]C[6])	118.9995	0.059	2	118.9995	0.003	2	118.7501	0.933	27	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6]-4:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]2)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(C[6]C[6]RhH)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]2)(H){1|Rh<5>,1|N<3>,2|H<1>,4|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(C[6]C[6]RhH){2|H<1>,4|C<3>}	H(C[6]C[6,6a]C[6])	119.2250	0.000	1	119.2250	0.000	1	119.2250	0.000	1	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Si-4:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]Si)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(SiC[6a]3)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]Si)(H){1|H<1>,1|O<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(SiC[6a]3){3|C<3>}	H(C[6]C[6,6a]C[6])	117.9430	0.000	1	117.9430	0.000	1	117.9430	0.000	1	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6a]-3:C[6]-4:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]C[6])(H)	C[6](C[6]C[6,6a]H)(C[6a]C[6a]2)(C[6]C[6]CH)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]C[6])(H){2|C<4>,2|H<1>,4|C<3>}	C[6](C[6]C[6,6a]H)(C[6a]C[6a]2)(C[6]C[6]CH){4|C<3>,4|H<1>}	H(C[6]C[6,6a]C[6])	118.5940	0.000	1	118.5940	0.000	1	118.9553	0.103	3	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6a]-3:C[6]-4:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]C[6])(H)	C[6](C[6]C[6,6a]H)(C[6a]C[6a]2)(C[6]C[6]HH)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]C[6])(H){1|C<2>,1|C<4>,2|H<1>,4|C<3>}	C[6](C[6]C[6,6a]H)(C[6a]C[6a]2)(C[6]C[6]HH){3|H<1>,5|C<3>}	H(C[6]C[6,6a]C[6])	119.2080	0.000	1	119.1360	0.010	2	118.9553	0.103	3	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6a]-3:C[6]-4:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]C[6])(H)	C[6](C[6]C[6,6a]H)(C[6a]C[6a]2)(C[6]C[6]HH)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]C[6])(H){1|C<4>,3|H<1>,4|C<3>}	C[6](C[6]C[6,6a]H)(C[6a]C[6a]2)(C[6]C[6]HH){1|C<4>,2|H<1>,5|C<3>}	H(C[6]C[6,6a]C[6])	119.0640	0.000	1	119.1360	0.010	2	118.9553	0.103	3	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6a]-3:P[6]-4:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]P[6])(H)	C[6](C[6]C[6,6a]H)(C[6a]C[6a]2)(P[6]N[6]OO)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]P[6])(H){1|H<1>,1|N<3>,1|O<1>,1|O<2>,4|C<3>}	C[6](C[6]C[6,6a]H)(C[6a]C[6a]2)(P[6]N[6]OO){3|H<1>,4|C<3>}	H(C[6]C[6,6a]C[6])	117.5643	1.593	4	117.5643	2.539	4	117.5643	2.539	4	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6a]-3:S[6]-4:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]S[6])(H)	C[6](C[6]C[6,6a]H)(C[6a]C[6a]2)(S[6]N[6]OO)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]S[6])(H){1|H<1>,1|N<3>,2|O<1>,4|C<3>}	C[6](C[6]C[6,6a]H)(C[6a]C[6a]2)(S[6]N[6]OO){3|H<1>,4|C<3>}	H(C[6]C[6,6a]C[6])	117.1370	0.000	1	117.1370	0.000	1	117.1370	0.000	1	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]C)(H)	C[6](C[6]C[6,6a]H)(N[6]C[6]Ag)(CH3)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]C)(H){1|Ag<5>,1|H<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(N[6]C[6]Ag)(CH3){1|H<1>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.4900	0.208	2	119.4900	0.043	2	119.3599	0.656	9	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]C)(H)	C[6](C[6]C[6,6a]H)(N[6]C[6]Co)(CHHN)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]C)(H){1|Co<6>,1|H<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(N[6]C[6]Co)(CHHN){1|H<1>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.9200	0.000	1	120.0840	0.054	2	119.3599	0.656	9	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]C)(H)	C[6](C[6]C[6,6a]H)(N[6]C[6]Co)(CHHN)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]C)(H){1|Co<6>,1|H<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(N[6]C[6]Co)(CHHN){3|C<3>}	H(C[6]C[6,6a]C[6])	120.2480	0.000	1	120.0840	0.054	2	119.3599	0.656	9	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]C)(H)	C[6](C[6]C[6,6a]H)(N[6]C[6]Mn)(CN[5]HH)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]C)(H){1|Mn<6>,1|H<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(N[6]C[6]Mn)(CN[5]HH){1|H<1>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.9305	0.131	2	119.9305	0.017	2	119.3599	0.656	9	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]C)(H)	C[6](C[6]C[6,6a]H)(N[6]C[6]O)(CH3)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]C)(H){1|H<1>,1|O<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(N[6]C[6]O)(CH3){1|H<1>,2|C<3>}	H(C[6]C[6,6a]C[6])	118.2050	0.000	1	118.2050	0.000	1	119.3599	0.656	9	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]C)(H)	C[6](C[6]C[6,6a]H)(N[6]S[6]C)(CCHH)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]C)(H){1|C<4>,1|H<1>,1|S<4>,2|C<3>}	C[6](C[6]C[6,6a]H)(N[6]S[6]C)(CCHH){2|C<3>,2|O<1>}	H(C[6]C[6,6a]C[6])	117.9510	0.000	1	117.9510	0.000	1	119.3599	0.656	9	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]N[6]C)(H)	C[6](C[6]C[6,6a]H)(N[6]C[6]S)(CHHS)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]N[6]C)(H){1|C<4>,1|S<4>,3|C<3>}	C[6](C[6]C[6,6a]H)(N[6]C[6]S)(CHHS){2|C<3>,2|H<1>}	H(C[6]C[6,6a]C[6])	119.0740	0.000	1	119.0740	0.000	1	119.3599	0.656	9	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6a]-3:C[6]-3:S[6]-4:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]S[6])(H)	C[6](C[6a]C[6a]N[6a])(C[6]C[6,6a]H)(S[6]N[6]OO)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]S[6])(H){1|H<1>,1|N<2>,1|N<3>,2|O<1>,3|C<3>}	C[6](C[6a]C[6a]N[6a])(C[6]C[6,6a]H)(S[6]N[6]OO){2|H<1>,4|C<3>}	H(C[6]C[6,6a]C[6])	116.8450	0.000	1	116.8450	0.000	1	116.8450	0.000	1	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6,6a]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[5,6]C)(H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6,6a]H)(CH3)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[5,6]C)(H){1|H<1>,2|C<3>,2|C<4>}	C[6](N[5,6]C[5,6]C[5])(C[6]C[6,6a]H)(CH3){1|O<2>,3|C<3>,3|C<4>}	H(C[6]C[6,6a]C[6])	119.0050	0.049	2	119.0050	0.002	2	119.0050	0.002	2	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6,6a]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6,6]C)(H)	C[6](N[6,6]C[6,6]C[6])(C[6]C[6,6a]H)(CHHN)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6,6]C)(H){1|C<4>,1|H<1>,3|C<3>}	C[6](N[6,6]C[6,6]C[6])(C[6]C[6,6a]H)(CHHN){1|C<4>,1|N<2>,2|C<3>,2|H<1>}	H(C[6]C[6,6a]C[6])	119.1730	0.000	1	119.1730	0.000	1	119.1730	0.000	1	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6,6a]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]C)(H)	C[6](N[6]C[6a]S[6])(C[6]C[6,6a]H)(CCHH)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]C)(H){1|H<1>,1|S<4>,3|C<3>}	C[6](N[6]C[6a]S[6])(C[6]C[6,6a]H)(CCHH){2|O<1>,4|C<3>}	H(C[6]C[6,6a]C[6])	117.7000	0.000	1	117.7000	0.000	1	118.0484	0.122	5	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6,6a]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]C)(H)	C[6](N[6]C[6a]S[6])(C[6]C[6,6a]H)(CHHO)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]C)(H){1|H<1>,1|S<4>,3|C<3>}	C[6](N[6]C[6a]S[6])(C[6]C[6,6a]H)(CHHO){2|O<1>,4|C<3>}	H(C[6]C[6,6a]C[6])	117.8465	0.028	2	117.8465	0.001	2	118.0484	0.122	5	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6,6a]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]C)(H)	C[6](N[6]C[6a]S[6])(C[6]C[6,6a]H)(CHHP)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]C)(H){1|H<1>,1|S<4>,3|C<3>}	C[6](N[6]C[6a]S[6])(C[6]C[6,6a]H)(CHHP){2|O<1>,4|C<3>}	H(C[6]C[6,6a]C[6])	118.4245	0.042	2	118.4245	0.002	2	118.0484	0.122	5	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6,6a]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C[3]-4:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[3]N[6])(H)	C[6](N[6]C[6a]S[6])(C[6]C[6,6a]H)(C[3]C[3]2H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[3]N[6])(H){1|S<4>,2|C<4>,2|H<1>,3|C<3>}	C[6](N[6]C[6a]S[6])(C[6]C[6,6a]H)(C[3]C[3]2H){2|O<1>,4|C<3>,4|H<1>}	H(C[6]C[6,6a]C[6])	117.8630	0.000	1	117.8630	0.000	1	117.8630	0.000	1	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6,6a]-3:C[6]-3:H-1:	P[6]-3:C[6]-3:Si-4:	C[6]-3:	C[6](C[6,6a]C[5,6,6a]C[6a])(C[6]P[6]Si)(H)	C[6](P[6]P[5,6]C[6a])(C[6]C[6,6a]H)(SiC[6a]CC)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[5,6,6a]C[6a])(C[6]P[6]Si)(H){1|H<1>,1|P<4>,3|C<3>}	C[6](P[6]P[5,6]C[6a])(C[6]C[6,6a]H)(SiC[6a]CC){1|W<6>,5|C<3>}	H(C[6]C[6,6a]C[6])	116.3630	0.000	1	116.3630	0.000	1	116.3630	0.000	1	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[3x6]H)(C[6]C[5,6]C)(H)	C[6](C[5,6]C[5,3x6]C[5,6a])(C[6]C[6]H)(CCCH)	H(C[6]C[6]2)	C[6](C[6]C[3x6]H)(C[6]C[5,6]C)(H){1|Ge<4>,1|C<3>,1|C<4>,1|H<1>}	C[6](C[5,6]C[5,3x6]C[5,6a])(C[6]C[6]H)(CCCH){1|Ge<4>,1|H<1>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	118.2930	0.000	1	118.2930	0.000	1	118.6149	0.375	10	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[6]C)(H)	C[6](C[5,6]C[5,5]N[5,6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[6]C)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[5,6]C[5,5]N[5,6])(C[6]C[6]H)(CH3){1|Fe<10>,1|B<4>,1|C<3>,3|C<4>}	H(C[6]C[6]2)	118.7895	0.134	2	118.7895	0.018	2	118.6149	0.375	10	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[6]C)(H)	C[6](C[5,6]C[5,6]N[5])(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[6]C)(H){1|C<4>,1|H<1>,1|N<2>}	C[6](C[5,6]C[5,6]N[5])(C[6]C[6]H)(CC3){1|C<3>,1|O<2>,1|P<4>,2|C<4>}	H(C[6]C[6]2)	117.4460	0.000	1	117.4460	0.000	1	118.6149	0.375	10	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[6]C)(H)	C[6](C[5,6]C[5,6]N[5])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[6]C)(H){1|C<4>,1|H<1>,1|N<2>}	C[6](C[5,6]C[5,6]N[5])(C[6]C[6]H)(CH3){2|C<4>,3|C<3>}	H(C[6]C[6]2)	118.4650	0.000	1	118.4650	0.000	1	118.6149	0.375	10	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6a]C[5,6])(C[6]C[6]H)(CCCH)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H){1|Al<5>,1|C<3>,1|C<5>,1|H<1>}	C[6](C[5,6]C[5,6a]C[5,6])(C[6]C[6]H)(CCCH){1|Al<5>,1|H<1>,1|N<3>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	119.3650	0.000	1	119.3650	0.000	1	118.6149	0.375	10	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[6]O)(H)	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[6]O)(H){1|C<4>,1|H<1>,2|C<3>}	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(CH3){1|H<1>,1|O<1>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	117.8690	0.000	1	117.8690	0.000	1	118.6149	0.375	10	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]N[6]N)(H)	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]N[6]N)(H){1|Co<4>,1|C<3>,1|C<4>}	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(CH3){1|N<2>,1|N<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.0115	0.360	2	119.0440	0.068	3	118.6149	0.375	10	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]N[6]N)(H)	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]N[6]N)(H){1|Ir<8>,1|C<3>,1|C<4>}	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(CH3){1|N<2>,1|N<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.1090	0.000	1	119.0440	0.068	3	118.6149	0.375	10	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[5a,6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5a,6]C)(C[6]C[5a,6]H)(H)	C[6](C[5a,6]N[5a,5a,6]C[5a])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]C)(C[6]C[5a,6]H)(H){1|C<3>,1|N<2>,1|N<3>}	C[6](C[5a,6]N[5a,5a,6]C[5a])(C[6]C[6]H)(CH3){1|H<1>,4|C<3>}	H(C[6]C[6]2)	117.3120	0.000	1	117.3120	0.000	1	118.3744	1.002	5	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[5a,6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5a,6]C)(C[6]C[6]H)(H)	C[6](C[5a,6]N[5a,6]N[5a])(C[6]C[6]H)(CF3)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]C)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[5a,6]N[5a,6]N[5a])(C[6]C[6]H)(CF3){1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.9180	0.000	1	119.9180	0.000	1	118.3744	1.002	5	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[5a,6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5a,6]C)(C[6]C[6]H)(H)	C[6](C[5a,6]N[5a,6]N[5a])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]C)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[5a,6]N[5a,6]N[5a])(C[6]C[6]H)(CH3){1|C<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	118.7280	0.000	1	118.7280	0.000	1	118.3744	1.002	5	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[5a,6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5a,6]C)(C[6]N[6]C)(H)	C[6](C[5a,6]C[5a,6]O[5a])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]C)(C[6]N[6]C)(H){1|C<3>,1|O<1>,1|O<2>}	C[6](C[5a,6]C[5a,6]O[5a])(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	118.0650	0.000	1	118.0650	0.000	1	118.3744	1.002	5	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[5a,6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5a,6]C)(C[6]N[6]C)(H)	C[6](C[5a,6]N[5a,6]C[5a])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]C)(C[6]N[6]C)(H){1|Ir<6>,1|C<3>,1|N<3>}	C[6](C[5a,6]N[5a,6]C[5a])(C[6]C[6]H)(CH3){1|C<4>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	117.8490	0.000	1	117.8490	0.000	1	118.3744	1.002	5	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[6,6]C)(H)	C[6](C[6,6]C[5,6,6]C[6,6a])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[6,6]C)(H){1|B<3>,1|C<3>,1|C<4>,1|H<1>}	C[6](C[6,6]C[5,6,6]C[6,6a])(C[6]C[6]H)(CH3){1|N<3>,2|C<3>,3|C<4>}	H(C[6]C[6]2)	117.9270	0.314	4	117.9270	0.098	4	117.5599	2.844	20	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6,6]C)(H)	C[6](C[6,6]C[5,6,6]N[5,6])(C[6]C[6]H)(CCCH)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6,6]C)(H){1|Si<4>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6,6]C[5,6,6]N[5,6])(C[6]C[6]H)(CCCH){1|Si<4>,1|H<1>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	119.0820	0.000	1	119.0820	0.000	1	117.5599	2.844	20	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6]C)(C[6]C[6]C)(H)	C[6](C[6,6]C[6,6]B[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6]C)(C[6]C[6]C)(H){1|B<3>,1|C<4>,1|H<1>}	C[6](C[6,6]C[6,6]B[6])(C[6]C[6]H)(CH3){2|C<4>,4|C<3>}	H(C[6]C[6]2)	119.4060	0.000	1	119.4060	0.000	1	117.5599	2.844	20	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6]C)(C[6]C[6]C)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(CCCH)	H(C[6]C[6]2)	C[6](C[6]C[6,6]C)(C[6]C[6]C)(H){2|C<4>,2|H<1>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(CCCH){2|H<1>,5|C<4>}	H(C[6]C[6]2)	118.3980	0.000	1	118.3980	0.000	1	117.5599	2.844	20	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6]C)(C[6]C[6]C)(H)	C[6](C[6,6]C[6,6]O[6])(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6,6]C)(C[6]C[6]C)(H){1|Nd<21>,1|C<4>,2|O<2>}	C[6](C[6,6]C[6,6]O[6])(C[6]C[6]H)(CC3){1|Nd<21>,1|C<3>,1|N<3>,2|C<4>}	H(C[6]C[6]2)	115.6960	0.407	5	115.7946	0.900	8	117.5599	2.844	20	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6]C)(C[6]C[6]C)(H)	C[6](C[6,6]C[6,6]O[6])(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6,6]C)(C[6]C[6]C)(H){1|W<14>,1|C<4>,2|O<2>}	C[6](C[6,6]C[6,6]O[6])(C[6]C[6]H)(CC3){1|W<14>,1|C<3>,1|N<3>,2|C<4>}	H(C[6]C[6]2)	115.9590	1.660	3	115.7946	0.900	8	117.5599	2.844	20	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6]C)(C[6]C[6]C)(H)	C[6](C[6,6]C[6,6]O[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6]C)(C[6]C[6]C)(H){1|H<1>,1|O<2>,2|C<4>}	C[6](C[6,6]C[6,6]O[6])(C[6]C[6]H)(CH3){2|C<3>,3|C<4>}	H(C[6]C[6]2)	118.5000	0.000	1	118.5000	0.000	1	117.5599	2.844	20	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6]C)(C[6]C[6]H)(H)	C[6](C[6,6]C[6,6a]N[6,6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6,6]C[6,6a]N[6,6])(C[6]C[6]H)(CH3){1|B<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.1040	0.000	1	119.1040	0.000	1	117.5599	2.844	20	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6]C)(C[6]N[6]C)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6]C)(C[6]N[6]C)(H){1|Co<6>,2|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	119.2905	0.148	2	119.5477	0.209	3	117.5599	2.844	20	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6]C)(C[6]N[6]C)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6]C)(C[6]N[6]C)(H){1|Cu<3>,2|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.0620	0.000	1	119.5477	0.209	3	117.5599	2.844	20	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6,6a]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6,6a]C)(H){1|Ir<6>,1|S<2>,3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CH3){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	119.3738	0.259	4	119.3738	0.067	4	119.4266	0.645	62	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]C[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]C[6]H)(H){2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CHHN){1|C<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.0640	0.000	1	119.0640	0.000	1	119.4266	0.645	62	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]C[6]H)(H)	C[6](C[6,6a]C[6a,6a]N[6,6a])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6,6a]C[6a,6a]N[6,6a])(C[6]C[6]H)(CH3){1|B<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.4960	0.000	1	119.4960	0.000	1	119.4266	0.645	62	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]C[6]H)(H)	C[6](C[6,6a]N[6,6a]N[6a])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6,6a]N[6,6a]N[6a])(C[6]C[6]H)(CH3){1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.6730	0.000	1	119.6730	0.000	1	119.4266	0.645	62	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]C[6]N[6])(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]C[6]N[6])(H){1|Pt<4>,1|N<3>,3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CH3){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.4320	0.000	1	120.4320	0.000	1	119.4266	0.645	62	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]C[6]O)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CCCH)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]C[6]O)(H){1|C<4>,1|O<2>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CCCH){1|C<4>,1|H<1>,1|O<1>,2|C<3>}	H(C[6]C[6]2)	118.7980	0.000	1	118.7980	0.000	1	119.4266	0.645	62	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]N[5a,6]H)(H)	C[6](C[6,6a]C[5a,6,6a]C[6a])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]N[5a,6]H)(H){1|B<4>,2|C<3>}	C[6](C[6,6a]C[5a,6,6a]C[6a])(C[6]C[6]H)(CH3){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.2750	0.324	2	119.2750	0.105	2	119.4266	0.645	62	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]N[6]C)(H){1|C<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CH3){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	118.4440	0.000	1	119.0482	0.138	11	119.4266	0.645	62	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]N[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	119.0810	0.109	2	119.0482	0.138	11	119.4266	0.645	62	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]N[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CH3){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.1100	0.400	7	119.0482	0.138	11	119.4266	0.645	62	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]N[6]C)(H){1|Rh<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	119.1540	0.000	1	119.0482	0.138	11	119.4266	0.645	62	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CN[6]HH)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]N[6]C)(H){1|Pd<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CN[6]HH){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.4813	0.145	3	119.4813	0.021	3	119.4266	0.645	62	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H){1|Cd<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CH3){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.6555	0.363	2	119.5887	0.147	20	119.4266	0.645	62	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H){1|Co<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CH3){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.3555	0.057	2	119.5887	0.147	20	119.4266	0.645	62	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H){1|Cr<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CH3){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7825	0.284	2	119.5887	0.147	20	119.4266	0.645	62	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H){1|Cu<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CH3){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.5880	0.399	2	119.5887	0.147	20	119.4266	0.645	62	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H){1|Fe<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CH3){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.5350	0.107	2	119.5887	0.147	20	119.4266	0.645	62	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CH3){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6660	0.000	1	119.5887	0.147	20	119.4266	0.645	62	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H){1|Ir<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CH3){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7470	0.151	2	119.5887	0.147	20	119.4266	0.645	62	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H){1|O<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CH3){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.1090	0.000	1	119.5887	0.147	20	119.4266	0.645	62	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H){1|Os<5>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CH3){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9270	0.000	1	119.5887	0.147	20	119.4266	0.645	62	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H){1|Pt<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CH3){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.1427	0.107	3	119.5887	0.147	20	119.4266	0.645	62	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H){1|Zn<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CH3){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.6585	0.033	2	119.5887	0.147	20	119.4266	0.645	62	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CHOO)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H){1|C<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CHOO){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8630	0.000	1	119.8630	0.000	1	119.4266	0.645	62	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CN[6]HH)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H){1|Pd<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CN[6]HH){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9880	0.000	1	119.9880	0.000	1	119.4266	0.645	62	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H){1|Ru<6>,2|C<3>}	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(CH3){1|H<1>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.5603	0.495	3	119.5603	0.245	3	119.4266	0.645	62	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]O[6]S)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]O[6]S)(H){2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CH3){1|H<1>,1|O<2>,1|S<1>,2|C<3>}	H(C[6]C[6]2)	124.5690	0.000	1	124.5690	0.000	1	119.4266	0.645	62	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]C)(H){1|Cu<4>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CH3){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	118.7765	0.153	2	118.8293	0.092	7	119.4266	0.645	62	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]C)(H){1|Ir<6>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CH3){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	118.9337	0.485	3	118.8293	0.092	7	119.4266	0.645	62	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6,6a]C)(H){1|Pt<4>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CH3){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	118.7255	0.015	2	118.8293	0.092	7	119.4266	0.645	62	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6a]O[6])(C[6]C[6,6a]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6a]O[6])(C[6]C[6,6a]C)(H){4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CH3){1|H<1>,1|O<2>,3|C<3>}	H(C[6]C[6]2)	119.0720	0.111	4	119.0720	0.012	4	119.4266	0.645	62	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:S-4:	C[6]-3:	C[6](C[6]C[6,6a]S)(C[6]C[6]I)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(SO3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]S)(C[6]C[6]I)(H){1|O<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(SO3){1|H<1>,1|I<1>,1|N<2>,2|C<3>}	H(C[6]C[6]2)	119.4980	0.000	1	119.4980	0.000	1	119.4980	0.000	1	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:As-4:	C[6]-3:	C[6](C[6]C[6]As)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(AsO3)	H(C[6]C[6]2)	C[6](C[6]C[6]As)(C[6]C[6]H)(H){1|C<2>,2|H<1>}	C[6](C[6]C[6]H)2(AsO3){1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.8810	0.000	1	120.8810	0.000	1	120.8810	0.000	1	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:B-4:	C[6]-3:	C[6](C[6]C[6]B)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(BN[6]CC)	H(C[6]C[6]2)	C[6](C[6]C[6]B)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(BN[6]CC){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	117.8025	0.319	2	117.8025	0.102	2	118.4735	0.951	29	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:B-4:	C[6]-3:	C[6](C[6]C[6]B)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(BO3)	H(C[6]C[6]2)	C[6](C[6]C[6]B)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(BO3){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.4520	0.000	1	119.4520	0.000	1	118.4735	0.951	29	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:B-4:	C[6]-3:	C[6](C[6]C[6]B)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]O[6]C)(BC[6a]3)	H(C[6]C[6]2)	C[6](C[6]C[6]B)(C[6]C[6]H)(H){1|C<4>,2|O<2>}	C[6](C[6]C[6]H)(C[6]O[6]C)(BC[6a]3){1|C<3>,1|H<1>}	H(C[6]C[6]2)	118.0220	0.000	1	118.0220	0.000	1	118.4735	0.951	29	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:B-4:	C[6]-3:	C[6](C[6]C[6]B)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(BC[6a]3)	H(C[6]C[6]2)	C[6](C[6]C[6]B)(C[6]C[6]H)(H){1|C<2>,2|H<1>}	C[6](C[6]C[6]H)2(BC[6a]3){1|C<3>,1|H<1>}	H(C[6]C[6]2)	118.1085	1.829	4	118.0079	2.348	7	118.4735	0.951	29	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:B-4:	C[6]-3:	C[6](C[6]C[6]B)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(BC[6a]3)	H(C[6]C[6]2)	C[6](C[6]C[6]B)(C[6]C[6]H)(H){1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(BC[6a]3){1|C<3>,3|H<1>}	H(C[6]C[6]2)	118.7470	0.000	1	118.0079	2.348	7	118.4735	0.951	29	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:B-4:	C[6]-3:	C[6](C[6]C[6]B)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(BC[6a]3)	H(C[6]C[6]2)	C[6](C[6]C[6]B)(C[6]C[6]H)(H){1|Sc<13>,1|C<4>,1|H<1>,1|H<2>}	C[6](C[6]C[6]H)2(BC[6a]3){1|Sc<13>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	116.2500	0.000	1	118.0079	2.348	7	118.4735	0.951	29	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:B-4:	C[6]-3:	C[6](C[6]C[6]B)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(BC[6a]3)	H(C[6]C[6]2)	C[6](C[6]C[6]B)(C[6]C[6]H)(H){1|Ti<12>,1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(BC[6a]3){1|Ti<12>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	118.6240	0.000	1	118.0079	2.348	7	118.4735	0.951	29	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:B-4:	C[6]-3:	C[6](C[6]C[6]B)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(BN[5]CO)	H(C[6]C[6]2)	C[6](C[6]C[6]B)(C[6]C[6]H)(H){1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(BN[5]CO){1|Fe<5>,1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.1210	0.000	1	119.1210	0.000	1	118.4735	0.951	29	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:B-4:	C[6]-3:	C[6](C[6]C[6]B)(C[6]C[6]H)(H)	C[6](C[6]C[6a]O[6])(C[6]C[6]H)(BC[6a]3)	H(C[6]C[6]2)	C[6](C[6]C[6]B)(C[6]C[6]H)(H){1|C<3>,2|O<2>}	C[6](C[6]C[6a]O[6])(C[6]C[6]H)(BC[6a]3){1|H<1>,3|C<3>}	H(C[6]C[6]2)	117.7360	0.100	2	117.7360	0.010	2	118.4735	0.951	29	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:B-4:	C[6]-3:	C[6](C[6]C[6]B)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(BF3)	H(C[6]C[6]2)	C[6](C[6]C[6]B)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(BF3){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.0180	0.000	1	119.0180	0.000	1	118.4735	0.951	29	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:B-4:	C[6]-3:	C[6](C[6]C[6]B)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(BF3)	H(C[6]C[6]2)	C[6](C[6]C[6]B)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(BF3){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8540	0.000	1	119.8540	0.000	1	118.4735	0.951	29	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:B-4:	C[6]-3:	C[6](C[6]C[6]B)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(BN[6]CC)	H(C[6]C[6]2)	C[6](C[6]C[6]B)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(BN[6]CC){1|N<3>,2|H<1>}	H(C[6]C[6]2)	118.8449	0.119	9	118.8449	0.014	9	118.4735	0.951	29	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:B-4:	C[6]-3:	C[6](C[6]C[6]B)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(BO3)	H(C[6]C[6]2)	C[6](C[6]C[6]B)(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(BO3){1|N<3>,2|H<1>}	H(C[6]C[6]2)	118.3822	1.117	4	118.3822	1.248	4	118.4735	0.951	29	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]B[6]H)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CCCH)	H(C[6]C[6]2)	C[6](C[6]B[6]H)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(CCCH){1|B<3>,2|H<1>}	H(C[6]C[6]2)	118.3557	0.098	3	118.3557	0.010	3	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[3,5,6]C)(C[6]C[6]C)(H)	C[6](C[6]C[3,6]H)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[3,5,6]C)(C[6]C[6]C)(H){1|C<4>,1|H<1>,1|N<3>,1|P<3>}	C[6](C[6]C[3,6]H)(C[6]C[6]H)(CH3){1|P<3>,3|C<4>}	H(C[6]C[6]2)	118.5150	0.000	1	118.5150	0.000	1	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[3,6,6]H)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[3,6,6]H)(C[6]C[6]C)(H){1|H<1>,1|N<3>,2|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(CH3){2|C<4>,2|H<1>}	H(C[6]C[6]2)	117.4600	0.000	1	117.4600	0.000	1	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[3,6]C)(C[6]C[6]C)(H)	C[6](C[6]C[3,5,6]H)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[3,6]C)(C[6]C[6]C)(H){2|C<4>,2|H<1>}	C[6](C[6]C[3,5,6]H)(C[6]C[6]H)(CH3){4|C<4>}	H(C[6]C[6]2)	118.2910	0.000	1	118.2910	0.000	1	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[3,6]O)(C[6]C[6]C)(H)	C[6](C[6]C[3,6]O)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[3,6]O)(C[6]C[6]C)(H){1|O<1>,3|C<4>}	C[6](C[6]C[3,6]O)(C[6]C[6]H)(CH3){1|H<1>,1|O<1>,2|C<4>}	H(C[6]C[6]2)	118.6890	0.000	1	118.6890	0.000	1	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[3x6]C[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[3x6]C[6])(C[6]C[6]C)(H){1|Dy<12>,1|C<3>,1|H<1>,1|O<2>,3|C<4>}	C[6](C[6]C[6]H)2(CH3){3|C<4>}	H(C[6]C[6]2)	118.0063	0.024	3	118.0892	0.056	10	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[3x6]C[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[3x6]C[6])(C[6]C[6]C)(H){1|Er<12>,1|C<3>,1|H<1>,1|O<2>,3|C<4>}	C[6](C[6]C[6]H)2(CH3){3|C<4>}	H(C[6]C[6]2)	118.1040	0.199	2	118.0892	0.056	10	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[3x6]C[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[3x6]C[6])(C[6]C[6]C)(H){1|Gd<12>,1|C<3>,1|H<1>,1|O<2>,3|C<4>}	C[6](C[6]C[6]H)2(CH3){3|C<4>}	H(C[6]C[6]2)	118.2367	0.320	3	118.0892	0.056	10	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[3x6]C[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[3x6]C[6])(C[6]C[6]C)(H){1|Ti<7>,1|C<3>,1|H<1>,1|O<2>,3|C<4>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,2|C<4>}	H(C[6]C[6]2)	117.9775	0.388	2	118.0892	0.056	10	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[4,6]C)(C[6]C[6]C)(H)	C[6](C[6]C[4,6]H)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[4,6]C)(C[6]C[6]C)(H){2|C<4>,2|H<1>}	C[6](C[6]C[4,6]H)(C[6]C[6]H)(CH3){4|C<4>}	H(C[6]C[6]2)	118.2410	0.000	1	118.2410	0.000	1	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[4x6]O)(C[6]C[6]C)(H)	C[6](C[6]C[3x6]O)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[4x6]O)(C[6]C[6]C)(H){1|C<3>,1|C<4>,1|N<3>,1|O<1>}	C[6](C[6]C[3x6]O)(C[6]C[6]H)(CH3){1|O<1>,3|C<4>}	H(C[6]C[6]2)	119.1020	0.040	2	119.1020	0.002	2	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6,6]H)(C[6]C[6]C)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5,6,6]H)(C[6]C[6]C)(H){1|C<4>,1|H<1>,2|N<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(CH3){2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.4140	0.000	1	118.4140	0.000	1	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6,6]O)(C[6]C[6]C)(H)	C[6](C[6]C[5,6,6]O)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5,6,6]O)(C[6]C[6]C)(H){1|O<1>,3|C<4>}	C[6](C[6]C[5,6,6]O)(C[6]C[6]H)(CH3){1|H<1>,1|O<1>,2|C<4>}	H(C[6]C[6]2)	117.2890	0.000	1	117.2890	0.000	1	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[6]C)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[6]C)(H){1|C<4>,1|H<1>,1|N<2>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(CC3){1|C<3>,1|O<2>,2|C<4>}	H(C[6]C[6]2)	117.4960	0.000	1	118.2867	0.571	3	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[6]C)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[6]C)(H){1|Zr<8>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(CC3){1|C<3>,2|C<4>}	H(C[6]C[6]2)	118.3630	0.000	1	118.2867	0.571	3	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[6]C)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[6]C)(H){1|Zr<9>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(CC3){1|C<3>,2|C<4>}	H(C[6]C[6]2)	119.0010	0.000	1	118.2867	0.571	3	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[6]C)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[6]C)(H){1|C<4>,1|H<1>,1|N<2>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(CH3){2|C<3>,2|C<4>}	H(C[6]C[6]2)	118.1440	0.000	1	118.1970	0.006	2	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[6]C)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[6]C)(H){1|H<1>,1|O<2>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(CH3){1|N<2>,1|O<2>,2|C<4>}	H(C[6]C[6]2)	118.2500	0.000	1	118.1970	0.006	2	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[6]C)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[6]C)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(CH3){1|B<4>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	118.8345	0.074	2	118.8345	0.006	2	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]C)(H)	C[6](C[6]C[5,5,6]H)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]C)(H){1|H<1>,1|O<2>,2|C<4>}	C[6](C[6]C[5,5,6]H)(C[6]C[6]H)(CH3){1|H<1>,1|N<3>,2|C<4>}	H(C[6]C[6]2)	119.0260	0.000	1	119.0260	0.000	1	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]C)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]C)(H){1|Hf<13>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(CC3){1|Hf<13>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	118.2295	0.125	10	118.4271	0.102	34	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]C)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]C)(H){1|Zr<13>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(CC3){1|Zr<13>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	118.5095	0.341	24	118.4271	0.102	34	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]C)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]C)(H){1|C<3>,1|C<4>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(CH3){1|C<4>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	118.7050	0.000	1	118.7830	0.012	2	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]C)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]C)(H){1|Ru<7>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(CH3){1|Ru<7>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	118.8610	0.000	1	118.7830	0.012	2	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]C)(H)	C[6](C[6]C[5,6]N[5a])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]C)(H){1|Zr<13>,1|N<3>,2|C<4>}	C[6](C[6]C[5,6]N[5a])(C[6]C[6]H)(CH3){1|Zr<13>,1|H<1>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	118.4415	0.013	2	118.4415	0.000	2	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]C)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]C)(H){1|O<2>,3|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(CH3){1|H<1>,3|C<4>}	H(C[6]C[6]2)	120.5610	0.000	1	120.5610	0.000	1	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]C)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(CF3)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(CF3){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9650	0.000	1	119.6025	0.263	2	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]C)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(CF3)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]C)(H){1|H<1>,2|N<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(CF3){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.2400	0.000	1	119.6025	0.263	2	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]C)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(CH3){1|In<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.7896	0.157	5	119.7896	0.025	5	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]N)(C[6]C[6]C)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5,6]N)(C[6]C[6]C)(H){1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	119.2357	0.414	4	119.2357	0.172	4	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]O)(C[6]C[6]C)(H)	C[6](C[6]C[5,6]C[6a])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5,6]O)(C[6]C[6]C)(H){1|C<4>,3|C<3>}	C[6](C[6]C[5,6]C[6a])(C[6]C[6]H)(CH3){1|C<4>,1|O<1>,1|O<2>,2|C<3>}	H(C[6]C[6]2)	118.7320	0.040	2	118.7320	0.002	2	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]O)(C[6]C[6]C)(H)	C[6](C[6]C[5,6]O)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5,6]O)(C[6]C[6]C)(H){1|O<1>,1|O<2>,2|C<4>}	C[6](C[6]C[5,6]O)(C[6]C[6]H)(CH3){1|O<1>,1|O<2>,2|C<4>}	H(C[6]C[6]2)	118.1720	0.000	1	118.1720	0.000	1	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]O)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5,6]O)(C[6]C[6]C)(H){1|O<1>,1|O<2>,2|C<4>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CH3){1|C<4>,1|O<1>,2|H<1>}	H(C[6]C[6]2)	119.6890	2.722	2	119.6890	7.411	2	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6]C)(H){1|C<4>,1|H<1>,1|O<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CC3){1|C<4>,2|C<3>}	H(C[6]C[6]2)	118.2210	0.472	6	118.4193	0.202	10	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6]C)(H){1|H<1>,1|N<2>,1|O<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CC3){1|C<4>,2|C<3>}	H(C[6]C[6]2)	118.8115	0.059	2	118.4193	0.202	10	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6]C)(H){1|Si<4>,1|C<4>,1|H<1>,1|O<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CC3){1|C<3>,2|C<4>}	H(C[6]C[6]2)	118.6220	0.284	2	118.4193	0.202	10	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6]C)(H){1|H<1>,1|N<3>,1|O<1>,2|C<3>}	C[6](C[6]C[6]H)2(CC3){1|C<4>,2|C<3>}	H(C[6]C[6]2)	119.1590	0.000	1	119.7567	0.174	7	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6]C)(H){1|Ti<11>,1|C<3>,1|H<1>,1|O<2>,2|C<4>}	C[6](C[6]C[6]H)2(CC3){3|C<4>}	H(C[6]C[6]2)	120.0805	0.091	4	119.7567	0.174	7	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6]C)(H){1|Zr<13>,1|C<3>,1|H<1>,1|O<2>,2|C<4>}	C[6](C[6]C[6]H)2(CC3){3|C<4>}	H(C[6]C[6]2)	119.4080	0.000	2	119.7567	0.174	7	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6]C)(H){1|C<3>,1|C<4>,1|N<3>,2|H<1>,2|N<2>}	C[6](C[6]C[6]H)2(CCHH){1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.0270	0.000	1	119.0270	0.000	1	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6]C)(H){1|Ti<8>,1|C<3>,1|H<1>,1|N<3>,1|O<2>,1|S<2>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,2|C<4>}	H(C[6]C[6]2)	118.9280	0.460	4	118.9280	0.211	4	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]C)(H){1|Pt<4>,1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(CC3){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	118.9640	0.000	1	118.9640	0.000	1	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]C)(H){1|Re<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.6990	0.000	1	119.6990	0.000	1	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5a,6]H)(C[6]C[6]C)(H)	C[6](C[6]C[5a,6]O)(C[6]C[6]H)(CC[6a]CH)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)(C[6]C[6]C)(H){1|C<3>,1|N<2>,1|O<1>}	C[6](C[6]C[5a,6]O)(C[6]C[6]H)(CC[6a]CH){1|H<1>,2|C<3>}	H(C[6]C[6]2)	117.3110	0.000	1	117.3110	0.000	1	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5a,6]H)(C[6]C[6]C)(H)	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)(C[6]C[6]C)(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(CH3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.0420	0.000	1	119.0420	0.000	1	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]C)(H){1|C<4>,1|S<2>,3|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(CH3){1|O<1>,2|C<3>}	H(C[6]C[6]2)	118.5640	0.000	1	118.5640	0.000	1	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]C)(H){1|H<1>,1|N<2>,1|O<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CC3){1|C<4>,2|C<3>}	H(C[6]C[6]2)	118.3650	0.130	2	118.4527	0.029	4	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]C)(H){1|H<1>,1|N<3>,1|O<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CC3){1|C<4>,2|C<3>}	H(C[6]C[6]2)	118.5405	0.196	2	118.4527	0.029	4	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]C)(H){1|Ir<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CC3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.2650	0.000	1	119.2630	0.028	3	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]C)(H){1|Pt<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CC3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.2620	0.236	2	119.2630	0.028	3	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5a]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5a]N[6])(C[6]C[6]C)(H){1|Cu<4>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7900	0.000	1	119.7900	0.000	1	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5x3,5x5,21x6]C)(C[6]C[6]C)(H)	C[6](C[6]C[5x3,5x5,21x6]H)(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[5x3,5x5,21x6]C)(C[6]C[6]C)(H){1|C<6>,1|H<1>,4|B<6>}	C[6](C[6]C[5x3,5x5,21x6]H)(C[6]C[6]H)(CC3){1|C<4>,1|C<6>,4|B<6>}	H(C[6]C[6]2)	115.3985	0.122	2	115.3985	0.015	2	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6]C)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6]C)(C[6]C[6]C)(H){1|B<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(CH3){2|C<3>,2|C<4>}	H(C[6]C[6]2)	119.2460	0.000	1	119.2460	0.000	1	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]C)(H){2|C<4>,2|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(CH3){2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.3270	0.000	1	118.3270	0.000	1	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]C)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6,6]H)(C[6]C[6]H)(CH3){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.5930	0.000	1	119.6733	0.033	3	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]C)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6,6]H)(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.7135	0.237	2	119.6733	0.033	3	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6]N)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6]N)(C[6]C[6]C)(H){1|C<3>,1|C<4>,1|O<1>}	C[6](C[6]C[6,6]O)(C[6]C[6]H)(CH3){1|C<3>,1|N<2>,2|C<4>}	H(C[6]C[6]2)	119.1330	0.000	1	119.1330	0.000	1	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(CCCH)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]C)(H){1|H<1>,1|O<1>,2|C<4>}	C[6](C[6]C[6,6]O)(C[6]C[6]H)(CCCH){1|H<1>,1|O<1>,2|C<4>}	H(C[6]C[6]2)	117.7750	0.000	1	117.7750	0.000	1	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]C)(H){1|C<3>,1|C<4>,1|O<1>}	C[6](C[6]C[6,6]O)(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|O<1>}	H(C[6]C[6]2)	122.1130	0.000	1	120.1980	7.334	2	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]C)(H){1|O<1>,3|C<4>}	C[6](C[6]C[6,6]O)(C[6]C[6]H)(CH3){1|H<1>,1|O<1>,2|C<4>}	H(C[6]C[6]2)	118.2830	0.000	1	120.1980	7.334	2	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]C[6])(C[6]C[6]C)(H)	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C[6])(C[6]C[6]C)(H){1|O<1>,4|C<3>}	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(CH3){3|C<3>}	H(C[6]C[6]2)	118.0510	0.083	2	118.0510	0.007	2	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]C)(H)	C[6](C[6]N[6,6a]C[6a])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]C)(H){1|N<3>,2|C<3>}	C[6](C[6]N[6,6a]C[6a])(C[6]C[6]H)(CH3){1|H<1>,4|C<3>}	H(C[6]C[6]2)	119.7380	0.000	1	119.7380	0.000	1	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]N)(C[6]C[6]C)(H)	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(CN[6]HH)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]N)(C[6]C[6]C)(H){1|O<1>,2|C<3>}	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(CN[6]HH){1|N<2>,2|C<3>}	H(C[6]C[6]2)	118.4205	0.183	4	118.4205	0.033	4	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]C)(H)	C[6](C[6]C[6,6a]C)(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]C)(H){3|C<3>}	C[6](C[6]C[6,6a]C)(C[6]C[6]H)(CC3){1|O<1>,2|C<3>}	H(C[6]C[6]2)	118.1095	0.965	2	118.1095	0.932	2	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]C)(H)	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]C)(H){1|O<1>,2|C<3>}	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(CC3){1|O<1>,2|C<3>}	H(C[6]C[6]2)	118.0090	0.364	3	118.0090	0.132	3	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]C)(H)	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]C)(H){1|O<1>,2|C<3>}	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(CH3){1|O<1>,2|C<3>}	H(C[6]C[6]2)	119.1363	1.795	9	119.0843	2.891	10	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]C)(H)	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]C)(H){1|O<1>,2|C<3>}	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(CH3){1|O<2>,2|C<3>}	H(C[6]C[6]2)	118.6160	0.000	1	119.0843	2.891	10	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]C)(H)	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(CN[5a]2C)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]C)(H){1|O<1>,2|C<3>}	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(CN[5a]2C){1|O<1>,2|C<3>}	H(C[6]C[6]2)	118.6720	0.000	1	118.6720	0.000	1	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6]C)(H){1|C<4>,1|H<1>,1|O<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CC3){1|C<4>,2|C<3>}	H(C[6]C[6]2)	117.8635	0.244	2	117.9034	0.026	5	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6]C)(H){1|C<4>,1|O<1>,3|C<3>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CC3){1|O<1>,2|C<3>}	H(C[6]C[6]2)	117.7700	0.000	1	117.9034	0.026	5	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6]C)(H){1|H<1>,1|O<1>,3|C<3>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CC3){1|C<4>,2|C<3>}	H(C[6]C[6]2)	118.0100	0.051	2	117.9034	0.026	5	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6]C)(H){1|H<1>,1|N<3>,1|O<2>,1|V<7>,2|C<3>}	C[6](C[6]C[6]H)2(CC3){1|C<3>,2|C<4>}	H(C[6]C[6]2)	119.0080	0.147	2	118.9707	0.110	13	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6]C)(H){1|H<1>,1|N<3>,1|O<2>,1|V<8>,2|C<3>}	C[6](C[6]C[6]H)2(CC3){1|C<3>,2|C<4>}	H(C[6]C[6]2)	118.9385	0.202	2	118.9707	0.110	13	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6]C)(H){1|N<3>,1|O<1>,2|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(CC3){1|C<3>,2|C<4>}	H(C[6]C[6]2)	119.1080	0.000	1	118.9707	0.110	13	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6]C)(H){1|Ta<8>,1|H<1>,1|N<3>,1|O<2>,2|C<3>}	C[6](C[6]C[6]H)2(CC3){1|C<3>,2|C<4>}	H(C[6]C[6]2)	119.1348	0.288	6	118.9707	0.110	13	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6]C)(H){1|Zr<8>,1|C<4>,1|H<1>,1|O<2>,2|C<3>}	C[6](C[6]C[6]H)2(CC3){1|C<3>,2|C<4>}	H(C[6]C[6]2)	118.4045	0.112	2	118.9707	0.110	13	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6]C)(H){1|Ti<12>,1|C<4>,1|H<1>,1|O<2>,2|C<3>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,2|C<4>}	H(C[6]C[6]2)	119.4095	0.305	2	119.1541	0.095	7	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6]C)(H){1|Ti<7>,1|H<1>,1|N<3>,1|O<2>,2|C<3>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,2|C<4>}	H(C[6]C[6]2)	119.2535	0.223	2	119.1541	0.095	7	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6]C)(H){1|Zr<10>,1|H<1>,1|N<3>,1|O<2>,2|C<3>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,2|C<4>}	H(C[6]C[6]2)	119.1090	0.000	1	119.1541	0.095	7	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6]C)(H){1|Zr<14>,1|C<4>,1|H<1>,1|O<2>,2|C<3>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,2|C<4>}	H(C[6]C[6]2)	118.8220	0.236	2	119.1541	0.095	7	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]B)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CF3)	H(C[6]C[6]2)	C[6](C[6]C[6]B)(C[6]C[6]C)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CF3){1|B<4>,1|C<2>,1|C<4>}	H(C[6]C[6]2)	119.4920	0.000	1	119.4920	0.000	1	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]Bi)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]Bi)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CC3){1|Bi<4>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	118.4840	0.000	1	118.4840	0.000	1	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CHHN){1|Br<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	118.9400	0.000	1	118.9400	0.000	1	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(CC3){1|Br<1>,2|C<3>}	H(C[6]C[6]2)	119.0300	0.148	2	119.0300	0.022	2	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CC[6a]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(CC[6a]HH){2|Br<1>,1|C<3>}	H(C[6]C[6]2)	120.7445	0.387	2	120.7445	0.150	2	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]C)(H){1|C<2>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(CH3){1|Br<1>,1|C<3>}	H(C[6]C[6]2)	114.0820	0.000	1	114.0820	0.000	1	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]F)(H)	C[6](C[6]C[6]F)(C[6]C[6]H)(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]F)(H){1|C<2>,2|F<1>}	C[6](C[6]C[6]F)(C[6]C[6]H)(CHHO){1|C<3>,1|F<1>}	H(C[6]C[6]2)	125.0350	0.000	1	125.0350	0.000	1	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]O)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<1>}	C[6](C[6]C[5,6]O)(C[6]C[6]H)(CH3){1|H<1>,3|C<3>}	H(C[6]C[6]2)	117.9130	0.000	1	117.9130	0.000	1	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5a]N[6])(C[6]C[6]H)(CH3){1|Mg<6>,1|C<3>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	119.6450	0.115	2	119.6450	0.013	2	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]2)(C[6]C[6]H)(CCHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){2|C<3>}	C[6](C[6]C[6]2)(C[6]C[6]H)(CCHN){1|C<2>,1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	115.3470	0.000	1	115.3470	0.000	1	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]2)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]2)(C[6]C[6]H)(CHHN){1|H<1>,4|C<3>}	H(C[6]C[6]2)	114.0950	0.000	1	114.0950	0.000	1	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(CCCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(CCCH){1|C<2>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.1380	0.000	1	119.1380	0.000	1	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]C[6]N)(CH3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.4340	0.095	2	119.0898	0.210	5	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(CH3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.3890	0.000	1	119.0898	0.210	5	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]C[6]N)(CH3){1|C<3>,1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	118.5020	0.000	1	119.0898	0.210	5	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(CH3){1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	118.6900	0.000	1	119.0898	0.210	5	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CC3){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	118.8410	0.068	2	118.8410	0.005	2	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CC[6]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CC[6]HH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.3798	0.179	6	119.3798	0.032	6	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CC[6a]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CC[6a]HH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.2580	0.246	34	119.2580	0.060	34	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CH3){1|C<2>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.1890	0.000	1	118.6715	0.536	2	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CH3){1|C<3>,1|H<1>,2|O<2>}	H(C[6]C[6]2)	118.1540	0.000	1	118.6715	0.536	2	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<2>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CHHN){1|C<3>,1|H<1>}	H(C[6]C[6]2)	118.9990	0.000	1	118.9990	0.000	1	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]S)(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|S<2>}	C[6](C[6]C[6]H)(C[6]C[6]S)(CHHO){1|C<2>,2|H<1>}	H(C[6]C[6]2)	115.9100	0.000	1	115.9100	0.000	1	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]2)(CC[6a]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]2)(CC[6a]HH){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.0490	0.000	1	119.0490	0.000	1	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(CCHH){1|Ir<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.6945	0.321	4	119.3511	0.264	12	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(CCHH){1|Ni<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.5738	0.172	4	119.3511	0.264	12	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(CCHH){1|Co<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	118.6070	0.294	3	119.3511	0.264	12	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(CCHH){1|Cr<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.3190	0.000	1	119.3511	0.264	12	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(CH3){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.2245	0.220	2	119.4695	0.182	26	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(CH3){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.7167	0.232	4	119.4695	0.182	26	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(CH3){1|Zn<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0660	0.205	2	119.4695	0.182	26	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(CH3){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.9700	0.000	1	119.4695	0.182	26	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(CH3){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.2177	0.339	13	119.4695	0.182	26	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(CH3){1|Cu<3>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0700	0.195	2	119.4695	0.182	26	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|C<4>}	C[6](C[6]C[6]H)(C[6]N[6]C)(CH3){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.4100	0.109	2	119.4695	0.182	26	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CCHH){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9100	0.000	1	119.9023	0.127	29	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CCHH){1|Cu<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9470	0.000	1	119.9023	0.127	29	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CCHH){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8500	0.192	2	119.9023	0.127	29	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CCHH){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2610	0.250	2	119.9023	0.127	29	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CCHH){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.7760	0.301	4	119.9023	0.127	29	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CCHH){1|Zn<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9040	0.151	2	119.9023	0.127	29	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CCHH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.0200	0.000	1	119.9023	0.127	29	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CCHH){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.7357	0.308	9	119.9023	0.127	29	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CCHH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.4490	0.482	2	119.9023	0.127	29	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CCHH){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4360	0.000	1	119.9023	0.127	29	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CCHH){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4415	0.117	2	119.9023	0.127	29	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CCHH){1|Ru<9>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4370	0.000	1	119.9023	0.127	29	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CCHH){1|Zn<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8810	0.000	1	119.9023	0.127	29	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CCHP)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CCHP){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	121.0820	0.000	1	121.0820	0.000	1	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CC[5]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CC[5]HH){1|Re<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7270	0.000	1	120.7270	0.000	1	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CClHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CClHH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9040	0.000	1	119.5947	0.260	3	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CClHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CClHH){1|Re<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.4400	0.614	2	119.5947	0.260	3	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CF3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|As<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CF3){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.8450	0.000	1	120.2599	0.262	37	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CF3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CF3){1|Au<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2410	0.167	2	120.2599	0.262	37	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CF3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CF3){1|Ir<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2934	0.603	9	120.2599	0.262	37	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CF3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CF3){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7510	0.000	1	120.2599	0.262	37	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CF3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CF3){1|Pt<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3628	0.338	12	120.2599	0.262	37	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CF3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CF3){1|Ru<9>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3795	0.299	2	120.2599	0.262	37	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CF3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CF3){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.5468	0.085	5	120.2599	0.262	37	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CF3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|O<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CF3){1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5790	0.000	1	120.2599	0.262	37	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CF3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|S<4>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CF3){1|Pd<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.8255	0.080	2	120.2599	0.262	37	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CF3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CF3){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5530	0.000	1	120.2599	0.262	37	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CF3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Ir<9>,1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CF3){1|Ir<9>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.2680	0.000	1	120.2599	0.262	37	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Al<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Ca<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1040	0.189	6	119.6409	1.471	338	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Al<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Li<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1517	0.342	3	119.6409	1.471	338	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Br<1>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.0570	0.000	1	119.6409	1.471	338	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.4030	0.000	1	119.6409	1.471	338	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Co<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.3230	0.000	1	119.6409	1.471	338	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Cr<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.6105	0.026	2	119.6409	1.471	338	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Cu<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9897	0.577	14	119.6409	1.471	338	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8433	0.158	7	119.6409	1.471	338	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Eu<13>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.7270	0.079	2	119.6409	1.471	338	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0332	0.219	13	119.6409	1.471	338	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Hg<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.6805	0.231	2	119.6409	1.471	338	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Ir<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.5460	0.290	7	119.6409	1.471	338	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Ni<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0950	0.000	2	119.6409	1.471	338	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.7920	0.187	2	119.6409	1.471	338	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Os<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2469	1.056	9	119.6409	1.471	338	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0510	0.000	1	119.6409	1.471	338	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Pt<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8294	0.259	19	119.6409	1.471	338	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Pt<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.7130	0.346	3	119.6409	1.471	338	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Re<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9821	0.208	12	119.6409	1.471	338	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Ru<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.6389	0.545	11	119.6409	1.471	338	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Zn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.4453	0.169	4	119.6409	1.471	338	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Zn<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.5430	0.194	2	119.6409	1.471	338	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Zn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2607	0.957	3	119.6409	1.471	338	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.6660	0.000	1	119.6409	1.471	338	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.2694	2.141	7	119.6409	1.471	338	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Cu<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.6700	0.000	1	119.6409	1.471	338	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9798	0.384	5	119.6409	1.471	338	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Fe<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9300	0.000	1	119.6409	1.471	338	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Ni<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	115.5240	0.000	1	119.6409	1.471	338	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0745	0.037	2	119.6409	1.471	338	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.2970	0.000	1	119.6409	1.471	338	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|C<3>,2|H<1>}	H(C[6]C[6]2)	118.2205	0.518	2	119.6409	1.471	338	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Mn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.6260	0.098	2	119.6409	1.471	338	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Al<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.1190	0.152	3	119.6409	1.471	338	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.1670	0.000	1	119.6409	1.471	338	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|C<3>,2|H<1>}	H(C[6]C[6]2)	118.7895	0.834	40	119.6409	1.471	338	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Cu<3>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8273	0.194	3	119.6409	1.471	338	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9050	0.050	6	119.6409	1.471	338	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Li<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	117.2077	2.483	3	119.6409	1.471	338	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Mn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.5810	0.000	1	119.6409	1.471	338	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Zn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.5080	0.000	1	119.6409	1.471	338	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Al<3>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2500	0.000	1	119.6409	1.471	338	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|B<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	112.7890	0.000	1	119.6409	1.471	338	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.3193	1.801	10	119.6409	1.471	338	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|C<3>,1|D<1>,1|H<1>}	H(C[6]C[6]2)	119.3090	0.000	1	119.6409	1.471	338	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.3840	0.000	1	119.6409	1.471	338	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	120.1081	0.217	8	119.6409	1.471	338	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.3500	0.000	1	119.6409	1.471	338	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|C<3>,1|H<1>,1|O<3>}	H(C[6]C[6]2)	120.0940	0.075	2	119.6409	1.471	338	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.2415	1.300	29	119.6409	1.471	338	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Cd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.7887	0.079	4	119.6409	1.471	338	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Cu<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	118.9620	1.485	3	119.6409	1.471	338	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8656	0.310	8	119.6409	1.471	338	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Fe<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	118.6920	0.000	1	119.6409	1.471	338	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Fe<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	118.8000	0.000	1	119.6409	1.471	338	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.6330	0.000	1	119.6409	1.471	338	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Mn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0210	0.144	4	119.6409	1.471	338	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8285	0.439	8	119.6409	1.471	338	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.9090	0.000	1	119.6409	1.471	338	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Pt<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8375	0.032	2	119.6409	1.471	338	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Re<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8868	0.413	12	119.6409	1.471	338	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Rh<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5600	0.000	1	119.6409	1.471	338	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Ru<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	122.2925	6.389	4	119.6409	1.471	338	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Ru<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1663	0.954	4	119.6409	1.471	338	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Si<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0540	0.393	2	119.6409	1.471	338	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|U<16>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	116.6210	0.000	1	119.6409	1.471	338	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Zn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9783	0.196	3	119.6409	1.471	338	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Zn<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9900	0.000	1	119.6409	1.471	338	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Sn<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Li<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9165	0.357	12	119.6409	1.471	338	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Sn<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Eu<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1500	0.100	3	119.6409	1.471	338	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHN){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1551	0.271	8	119.8780	0.375	78	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHN){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8586	0.368	8	119.8780	0.375	78	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHN){1|Ru<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4020	0.184	2	119.8780	0.375	78	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHN){1|Zn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9225	0.253	11	119.8780	0.375	78	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHN){1|Ag<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0585	0.585	2	119.8780	0.375	78	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHN){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.8680	0.277	3	119.8780	0.375	78	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.6096	0.788	33	119.8780	0.375	78	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHN){1|Cd<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2590	0.000	1	119.8780	0.375	78	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHN){1|Co<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7340	0.000	1	119.8780	0.375	78	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHN){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3310	0.000	1	119.8780	0.375	78	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHN){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2990	0.341	4	119.8780	0.375	78	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHN){1|Zn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2707	0.112	3	119.8780	0.375	78	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHN){1|Zn<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2520	0.000	1	119.8780	0.375	78	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHO){1|Ir<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8688	0.468	9	120.0142	0.180	48	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHO){1|Pt<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9349	0.213	13	120.0142	0.180	48	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHO){1|Re<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9980	0.000	1	120.0142	0.180	48	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHO){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1340	0.000	1	120.0142	0.180	48	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHO){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.0471	0.127	7	120.0142	0.180	48	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.1225	1.244	2	120.0142	0.180	48	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHO){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7490	0.000	1	120.0142	0.180	48	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHO){1|Ir<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2410	0.000	1	120.0142	0.180	48	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHO){1|Ir<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4960	0.000	1	120.0142	0.180	48	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHO){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2553	0.418	7	120.0142	0.180	48	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHO){1|Pt<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2600	0.479	2	120.0142	0.180	48	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHO){1|Re<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0070	0.000	1	120.0142	0.180	48	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHO){1|Rh<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1000	0.069	2	120.0142	0.180	48	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHP){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.4890	0.000	1	119.4890	0.000	1	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHS)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHS){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8157	1.938	3	119.8157	3.756	3	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CN[5]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CN[5]HH){1|Cu<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4010	1.058	2	120.3057	0.211	7	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CN[5]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CN[5]HH){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2803	0.239	3	120.3057	0.211	7	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CN[5]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CN[5]HH){1|Zn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2485	0.090	2	120.3057	0.211	7	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CN[5a]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CN[5a]HH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.2760	0.000	1	119.9703	0.364	3	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CN[5a]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CN[5a]HH){1|Zn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2670	0.000	1	119.9703	0.364	3	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CN[5a]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CN[5a]HH){1|Zn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3680	0.000	1	119.9703	0.364	3	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CN[6]CH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CN[6]CH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.5600	0.721	4	119.5600	0.520	4	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CN[6a]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CN[6a]HH){1|Cd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4380	1.048	2	120.4380	1.098	2	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(CH3){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.0490	1.495	3	118.9534	0.434	38	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(CH3){1|Cu<3>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.7955	0.177	2	118.9534	0.434	38	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(CH3){1|C<3>,2|H<1>}	H(C[6]C[6]2)	118.6241	0.490	21	118.9534	0.434	38	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(CH3){1|Co<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.1210	0.369	2	118.9534	0.434	38	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(CH3){1|Cu<3>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.2085	0.064	2	118.9534	0.434	38	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(CH3){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8095	0.317	2	118.9534	0.434	38	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(CH3){1|Ir<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.2435	0.022	2	118.9534	0.434	38	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(CH3){1|Li<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.5030	0.134	2	118.9534	0.434	38	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(CH3){1|Mn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.5090	0.000	1	118.9534	0.434	38	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(CH3){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.1060	0.000	1	118.9534	0.434	38	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(CHHO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	118.6200	0.000	1	118.6200	0.000	1	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]S)(CF3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]S)(CF3){1|Cd<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8377	0.180	3	119.6842	0.049	6	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]S)(CF3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]S)(CF3){1|Zn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.5020	0.190	2	119.6842	0.049	6	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]S)(CF3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|S<3>}	C[6](C[6]C[6]H)(C[6]N[6]S)(CF3){1|Cd<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.5880	0.000	1	119.6842	0.049	6	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]P[6]P)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Si<4>,1|P<2>,1|P<3>}	C[6](C[6]C[6]H)(C[6]P[6]P)(CH3){1|C<3>,1|H<1>}	H(C[6]C[6]2)	117.5640	0.000	1	117.1644	0.351	5	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]P[6]P)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Si<4>,1|P<2>,1|P<4>}	C[6](C[6]C[6]H)(C[6]P[6]P)(CH3){1|C<3>,1|H<1>}	H(C[6]C[6]2)	117.4140	0.000	1	117.1644	0.351	5	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]P[6]P)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Si<4>,1|P<3>,1|P<4>}	C[6](C[6]C[6]H)(C[6]P[6]P)(CH3){1|Ru<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	116.9480	0.721	3	117.1644	0.351	5	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(CC3){1|C<3>,2|H<1>}	H(C[6]C[6]2)	118.7230	0.139	2	119.2361	0.575	7	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CC3){1|C<2>,2|H<1>}	H(C[6]C[6]2)	120.0383	0.030	3	119.2361	0.575	7	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Ta<13>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(CC3){1|C<4>,1|H<1>,1|S<3>}	H(C[6]C[6]2)	118.5460	0.140	2	119.2361	0.575	7	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CCHH){1|C<3>,1|H<1>}	H(C[6]C[6]2)	117.4390	0.000	1	116.5481	19.353	10	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<2>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(CCHH){1|C<3>,1|H<1>}	H(C[6]C[6]2)	116.7300	0.000	1	116.5481	19.353	10	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<2>,2|H<1>}	C[6](C[6]C[6]H)2(CCHH){1|C<3>,1|H<1>}	H(C[6]C[6]2)	123.2930	0.000	1	116.5481	19.353	10	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(CCHH){1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.4820	0.000	1	116.5481	19.353	10	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(CCHH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.3470	1.130	2	116.5481	19.353	10	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CCHH){1|C<2>,2|H<1>}	H(C[6]C[6]2)	114.4525	0.951	2	116.5481	19.353	10	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Cl<1>,1|C<2>,1|H<1>}	C[6](C[6]C[6]H)2(CCHH){1|C<3>,1|H<1>}	H(C[6]C[6]2)	110.4690	4.325	2	116.5481	19.353	10	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CCHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(CCHN){1|C<3>,3|H<1>}	H(C[6]C[6]2)	120.1210	0.000	1	120.1210	0.000	1	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CCHO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<2>,2|H<1>}	C[6](C[6]C[6]H)2(CCHO){1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.6642	2.010	4	120.5282	13.571	14	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CCHO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(CCHO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.3330	0.133	2	120.5282	13.571	14	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CCHO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CCHO){1|C<2>,2|H<1>}	H(C[6]C[6]2)	120.7165	5.099	6	120.5282	13.571	14	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CCHO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(CCHO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	118.8865	4.545	2	120.5282	13.571	14	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CC[3]CP)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CC[3]CP){1|C<2>,2|H<1>}	H(C[6]C[6]2)	117.6350	3.845	2	117.6350	14.786	2	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CC[5]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<2>,2|H<1>}	C[6](C[6]C[6]H)2(CC[5]HH){1|C<3>,1|H<1>}	H(C[6]C[6]2)	123.7940	0.000	1	123.7940	0.000	1	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CC[6]CH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CC[6]CH){1|C<2>,2|H<1>}	H(C[6]C[6]2)	120.8500	6.682	2	120.8500	44.651	2	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CC[6]CO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CC[6]CO){1|C<2>,2|H<1>}	H(C[6]C[6]2)	119.5055	5.998	2	119.4130	18.016	3	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CC[6]CO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Cl<1>,1|C<2>,1|H<1>}	C[6](C[6]C[6]H)2(CC[6]CO){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.2280	0.000	1	119.4130	18.016	3	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CC[6]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(CC[6]HH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.0090	0.281	2	119.0090	0.079	2	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CC[6]HO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<2>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(CC[6]HO){1|C<3>,1|H<1>}	H(C[6]C[6]2)	117.6910	0.000	1	117.6910	0.000	1	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CC[6a]2C)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(CC[6a]2C){1|C<3>,2|H<1>}	H(C[6]C[6]2)	118.9485	0.131	11	118.9485	0.017	11	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CC[6a]2H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(CC[6a]2H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.2195	0.316	2	119.2195	0.100	2	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CC[6a]2N)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<2>,2|H<1>}	C[6](C[6]C[6]H)2(CC[6a]2N){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.5260	0.000	1	119.5260	0.000	1	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CC[6a]CC)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(CC[6a]CC){1|C<3>,2|H<1>}	H(C[6]C[6]2)	118.8070	0.098	2	118.8070	0.010	2	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CCuCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<2>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(CCuCH){1|C<3>,1|H<1>}	H(C[6]C[6]2)	118.8420	0.000	1	118.8420	0.000	1	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CF3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(CF3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.9300	0.000	1	119.9300	0.000	1	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Al<4>,1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(CH3){1|C<4>,2|H<1>}	H(C[6]C[6]2)	118.9765	1.193	4	119.4740	3.878	88	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<2>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2630	0.000	1	119.4740	3.878	88	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<2>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7310	0.000	1	119.4740	3.878	88	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<2>,1|H<1>,1|S<4>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.5277	2.975	4	119.4740	3.878	88	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<2>,2|H<1>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|H<1>}	H(C[6]C[6]2)	114.3720	0.000	1	119.4740	3.878	88	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,3|H<1>}	H(C[6]C[6]2)	119.2060	0.000	1	119.4740	3.878	88	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|Ir<7>,1|C<3>,1|H<1>,1|H<2>}	H(C[6]C[6]2)	118.7320	0.000	1	119.4740	3.878	88	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>,1|V<8>}	C[6](C[6]C[6]H)2(CH3){1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.3450	0.107	2	119.4740	3.878	88	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.0690	0.000	1	119.4740	3.878	88	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|H<1>,1|P<4>}	H(C[6]C[6]2)	118.5070	0.000	1	119.4740	3.878	88	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(CH3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	118.7873	0.285	6	119.4740	3.878	88	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>,1|V<6>}	C[6](C[6]C[6]H)2(CH3){1|C<4>,1|H<1>,1|N<4>}	H(C[6]C[6]2)	114.0170	0.000	1	119.4740	3.878	88	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>,1|V<8>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.0910	0.000	1	119.4740	3.878	88	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(CH3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	122.3250	0.000	1	119.4740	3.878	88	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|C<2>,2|H<1>}	H(C[6]C[6]2)	122.6372	5.653	6	119.4740	3.878	88	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<4>,1|V<9>}	C[6](C[6]C[6]H)2(CH3){1|C<4>,1|H<1>,1|N<3>,1|V<9>}	H(C[6]C[6]2)	119.4790	0.154	4	119.4740	3.878	88	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Er<10>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(CH3){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.3227	0.364	4	119.4740	3.878	88	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Mo<10>,1|Si<4>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|Mo<10>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.3230	0.000	1	119.4740	3.878	88	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Ni<3>,1|Ni<4>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|Ni<4>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.0360	0.000	1	119.4740	3.878	88	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Ni<4>,1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(CH3){1|Ni<4>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.7210	0.000	1	119.4740	3.878	88	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Pd<6>,1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(CH3){1|Pd<6>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	118.7800	0.000	1	119.4740	3.878	88	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Sc<9>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(CH3){1|C<4>,1|H<1>,1|P<4>}	H(C[6]C[6]2)	119.1800	0.000	1	119.4740	3.878	88	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Si<4>,1|W<10>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|W<10>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	118.8660	0.000	1	119.4740	3.878	88	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Ta<10>,1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.6390	0.191	2	119.4740	3.878	88	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Ta<7>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(CH3){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	118.8300	0.000	1	119.4740	3.878	88	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Th<14>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(CH3){1|Th<14>,1|C<4>,1|H<1>,1|H<2>}	H(C[6]C[6]2)	118.9860	0.000	1	119.4740	3.878	88	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Th<16>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(CH3){1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.3965	0.279	2	119.4740	3.878	88	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Ti<11>,1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(CH3){1|Ti<11>,1|C<4>,1|H<1>,1|H<2>}	H(C[6]C[6]2)	118.6570	0.000	1	119.4740	3.878	88	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Ti<6>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(CH3){1|C<4>,1|H<1>,1|P<3>}	H(C[6]C[6]2)	119.8340	0.000	1	119.4740	3.878	88	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Ti<7>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(CH3){1|C<4>,1|H<1>,1|P<4>}	H(C[6]C[6]2)	120.8540	1.169	3	119.4740	3.878	88	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Ti<8>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(CH3){1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.2788	0.136	4	119.4740	3.878	88	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Ti<8>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(CH3){1|C<4>,1|H<1>,1|S<3>}	H(C[6]C[6]2)	119.0860	0.000	1	119.4740	3.878	88	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Ti<9>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(CH3){1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.2240	0.027	2	119.4740	3.878	88	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|U<11>,1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)2(CH3){1|C<4>,2|H<1>}	H(C[6]C[6]2)	118.8585	0.104	2	119.4740	3.878	88	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Y<10>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(CH3){1|C<4>,1|H<1>,1|P<4>}	H(C[6]C[6]2)	119.1460	0.000	1	119.4740	3.878	88	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Y<11>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(CH3){1|Y<11>,1|C<4>,1|H<1>,1|P<4>}	H(C[6]C[6]2)	119.3800	0.000	1	119.4740	3.878	88	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Yb<10>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(CH3){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.3931	0.363	8	119.4740	3.878	88	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Zr<14>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|Zr<14>,1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.2180	0.000	2	119.4740	3.878	88	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){2|Fe<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.4343	0.124	8	119.4740	3.878	88	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){2|Li<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.5715	0.011	2	119.4740	3.878	88	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<2>,2|H<1>}	C[6](C[6]C[6]H)2(CHHN){1|C<3>,1|H<1>}	H(C[6]C[6]2)	122.5260	0.000	1	121.7513	5.662	3	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CHHN){1|C<2>,2|H<1>}	H(C[6]C[6]2)	121.3640	3.229	2	121.7513	5.662	3	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<2>,2|H<1>}	C[6](C[6]C[6]H)2(CHHO){1|C<3>,1|H<1>}	H(C[6]C[6]2)	118.2397	2.454	3	118.5110	7.978	7	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CHHO){1|C<2>,2|H<1>}	H(C[6]C[6]2)	118.7145	3.437	4	118.5110	7.978	7	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CHHS)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<2>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(CHHS){1|C<3>,1|H<1>}	H(C[6]C[6]2)	117.9200	0.000	1	117.9200	0.000	1	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CN[5]CH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<2>,2|H<1>}	C[6](C[6]C[6]H)2(CN[5]CH){1|C<3>,1|H<1>}	H(C[6]C[6]2)	108.3570	0.000	1	108.3570	0.000	1	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CN[5]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,3|H<1>}	C[6](C[6]C[6]H)2(CN[5]HH){1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.6615	0.145	2	119.6615	0.021	2	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CN[5a]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CN[5a]HH){1|C<2>,2|H<1>}	H(C[6]C[6]2)	119.0120	0.241	4	119.0120	0.058	4	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CNiHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CNiHH){1|C<2>,2|H<1>}	H(C[6]C[6]2)	120.7115	5.602	2	120.7115	31.387	2	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]N[5])(C[6]C[6]H)(CCCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|N<3>}	C[6](C[6]C[6]N[5])(C[6]C[6]H)(CCCH){1|C<2>,1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	114.7940	0.000	1	114.7940	0.000	1	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(CCCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(CCCH){1|Li<5>,1|Si<5>,1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.3000	0.000	1	119.3000	0.000	1	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(CH3){1|Ru<6>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.3135	0.111	2	119.5226	0.034	7	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(CH3){1|Cr<9>,1|Ir<8>,1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.4010	0.000	1	119.5226	0.034	7	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(CH3){1|Cr<9>,1|Mn<6>,1|C<3>,1|C<4>,1|C<5>,1|H<1>}	H(C[6]C[6]2)	119.7030	0.000	1	119.5226	0.034	7	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(CH3){1|Cr<9>,1|Re<6>,1|C<3>,1|C<4>,1|C<5>,1|H<1>}	H(C[6]C[6]2)	119.6530	0.000	1	119.5226	0.034	7	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(CH3){1|Cr<9>,1|Rh<8>,1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.6370	0.124	2	119.5226	0.034	7	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(CCCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Pd<4>,1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(CCCH){1|Pd<4>,1|H<1>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	119.2150	0.000	1	119.2150	0.000	1	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(CH3){1|Au<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.0185	0.100	2	119.2350	0.099	9	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(CH3){1|H<1>,1|O<1>,3|C<3>}	H(C[6]C[6]2)	119.8890	0.000	1	119.2350	0.099	9	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(CH3){1|Ir<6>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.1315	0.238	4	119.2350	0.099	9	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(CH3){1|Re<6>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.2160	0.000	1	119.2350	0.099	9	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6a]N[6])(C[6]C[6]H)(CH3){1|Rh<6>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.4470	0.000	1	119.2350	0.099	9	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(CH3){1|Ir<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.1360	0.000	1	119.1364	0.206	5	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(CH3){1|Ir<7>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.5615	0.269	2	119.1364	0.206	5	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[6]N[5]N[6])(C[6]C[6]H)(CH3){1|Pd<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	118.7115	0.165	2	119.1364	0.206	5	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]N[6]Ir)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Ir<6>,1|H<1>,1|N<3>}	C[6](C[6]N[6]Ir)(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.3420	0.000	1	119.3420	0.000	1	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CC3){1|C<3>,1|C<4>,1|N<2>}	H(C[6]C[6]2)	118.4694	0.332	8	118.4694	0.110	8	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CC[6a]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]N)(H){1|C<3>,1|C<4>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CC[6a]HH){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	118.7810	0.000	1	118.7810	0.000	1	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CH3){1|C<3>,1|C<4>,1|N<2>}	H(C[6]C[6]2)	119.1590	0.233	4	119.0540	0.096	5	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]N)(H){1|C<3>,1|N<3>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CH3){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	118.6340	0.000	1	119.0540	0.096	5	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CHHN){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9355	0.100	2	119.9355	0.010	2	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CHHO){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.2190	0.000	1	120.2190	0.000	1	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|C<3>,1|N<3>,1|O<1>}	H(C[6]C[6]2)	122.6650	0.000	1	120.1265	1.842	6	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]N)(H){1|Cl<1>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	118.6930	0.000	1	120.1265	1.842	6	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Pd<4>,1|C<3>,1|N<3>}	H(C[6]C[6]2)	119.8503	0.367	4	120.1265	1.842	6	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(CC3){1|C<3>,1|C<4>,1|N<2>}	H(C[6]C[6]2)	119.6663	1.821	3	119.6825	2.212	4	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(CC3){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	119.7310	0.000	1	119.6825	2.212	4	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<2>,1|V<6>}	C[6](C[6]C[6]H)2(CH3){1|C<4>,1|H<1>,1|N<4>}	H(C[6]C[6]2)	121.2010	0.000	1	121.2010	0.000	1	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|Cl<1>,2|C<3>}	C[6](C[6]C[6]Cl)(C[6]C[6]H)(CH3){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	120.8475	1.945	2	120.8475	3.784	2	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(CC[6a]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|N<2>}	C[6](C[6]C[6]H)(C[6]C[6]N)(CC[6a]HH){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	118.2800	0.000	1	118.2800	0.000	1	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CC3){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	118.3634	1.894	7	118.3596	1.922	13	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CC3){1|C<3>,1|C<4>,1|O<1>}	H(C[6]C[6]2)	118.2040	0.000	1	118.3596	1.922	13	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CC3){1|C<3>,1|N<3>,1|O<1>}	H(C[6]C[6]2)	118.5280	0.000	1	118.3596	1.922	13	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CC3){1|O<2>,2|C<3>}	H(C[6]C[6]2)	118.8080	0.000	1	118.3596	1.922	13	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|C<3>,1|O<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CC3){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	118.6300	0.280	2	118.3596	1.922	13	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|O<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CC3){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	117.3310	0.000	1	118.3596	1.922	13	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CCCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|O<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CCCH){1|C<3>,1|C<4>,1|O<1>}	H(C[6]C[6]2)	118.9225	0.677	2	118.9225	0.458	2	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|C<4>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CCHH){1|C<3>,1|O<2>,2|C<4>}	H(C[6]C[6]2)	117.9065	0.142	2	117.9065	0.020	2	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CCHO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|C<4>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CCHO){1|C<3>,1|O<2>,2|C<4>}	H(C[6]C[6]2)	119.7565	2.271	4	119.7565	5.156	4	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CC[6]CH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CC[6]CH){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	118.2955	0.323	4	118.2955	0.104	4	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CC[6]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CC[6]HH){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	118.6421	0.181	8	118.5347	0.059	11	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CC[6]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|C<3>,1|N<3>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CC[6]HH){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	118.2483	0.105	3	118.5347	0.059	11	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CC[6a]CH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CC[6a]CH){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	118.2400	0.000	1	118.2400	0.000	1	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CC[6a]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CC[6a]HH){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	118.5056	0.250	25	118.6954	0.444	42	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CC[6a]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CC[6a]HH){1|C<3>,1|C<4>,1|O<1>}	H(C[6]C[6]2)	118.9968	0.978	16	118.6954	0.444	42	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CC[6a]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|C<3>,1|O<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CC[6a]HH){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	118.6190	0.000	1	118.6954	0.444	42	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CH3){1|C<3>,1|C<4>,1|O<1>}	H(C[6]C[6]2)	119.2120	0.000	1	118.7195	0.140	4	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CH3){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	118.5553	0.219	3	118.7195	0.140	4	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CN[5]2H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CN[5]2H){1|C<3>,1|C<4>,1|O<1>}	H(C[6]C[6]2)	119.4520	0.000	1	119.4520	0.000	1	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CN[5a]2C)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CN[5a]2C){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	118.6890	0.000	1	118.8150	0.032	2	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CN[5a]2C)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|C<3>,1|O<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CN[5a]2C){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	118.9410	0.000	1	118.8150	0.032	2	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(CC3){1|C<3>,1|C<4>,1|O<1>}	H(C[6]C[6]2)	120.4937	0.937	3	120.4937	0.878	3	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(CCHH){1|O<2>,2|C<3>}	H(C[6]C[6]2)	119.5100	0.000	1	119.5100	0.000	1	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(CH3){1|O<1>,2|C<4>}	H(C[6]C[6]2)	119.7335	0.217	2	119.7573	0.044	6	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|Dy<15>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(CH3){1|O<2>,2|C<4>}	H(C[6]C[6]2)	119.4850	0.000	1	119.7573	0.044	6	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|Eu<15>,1|C<3>,1|H<1>,1|O<3>}	C[6](C[6]C[6]H)2(CH3){1|O<3>,2|C<4>}	H(C[6]C[6]2)	119.8140	0.218	2	119.7573	0.044	6	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|Y<15>,1|C<3>,1|H<1>,1|O<3>}	C[6](C[6]C[6]H)2(CH3){1|O<3>,2|C<4>}	H(C[6]C[6]2)	119.9640	0.000	1	119.7573	0.044	6	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]P)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]P)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CC3){1|C<3>,1|C<4>,1|P<3>}	H(C[6]C[6]2)	118.8295	0.267	2	118.8295	0.071	2	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]P)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]P)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CH3){1|P<3>,2|C<3>}	H(C[6]C[6]2)	118.8725	4.682	2	118.8725	21.919	2	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]P)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]P)(H){1|Ce<11>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(CH3){1|P<4>,2|C<4>}	H(C[6]C[6]2)	119.5607	0.140	3	119.1806	0.356	10	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]P)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]P)(H){1|Sc<9>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(CH3){1|C<4>,1|H<1>,1|P<4>}	H(C[6]C[6]2)	119.3450	0.000	1	119.1806	0.356	10	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]P)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]P)(H){1|Ti<6>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(CH3){1|C<4>,1|H<1>,1|P<3>}	H(C[6]C[6]2)	118.5180	0.000	1	119.1806	0.356	10	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]P)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]P)(H){1|Ti<7>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(CH3){1|C<4>,1|H<1>,1|P<4>}	H(C[6]C[6]2)	118.8347	0.875	3	119.1806	0.356	10	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]P)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]P)(H){1|U<12>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(CH3){1|P<4>,2|C<4>}	H(C[6]C[6]2)	119.7630	0.000	1	119.1806	0.356	10	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]P)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]P)(H){1|Y<10>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(CH3){1|C<4>,1|H<1>,1|P<4>}	H(C[6]C[6]2)	118.9940	0.000	1	119.1806	0.356	10	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]S)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]S)(H){1|C<4>,1|H<1>,1|O<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(CC3){1|C<3>,1|C<4>,1|O<2>,1|S<2>}	H(C[6]C[6]2)	118.9860	0.000	1	118.9860	0.000	1	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]S)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]S)(H){1|C<4>,1|H<1>,1|O<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(CC3){1|C<3>,1|C<4>,2|S<2>}	H(C[6]C[6]2)	118.5680	0.000	1	118.5680	0.000	1	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]S)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]S)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CC3){1|C<3>,1|C<4>,1|S<2>}	H(C[6]C[6]2)	119.2318	0.297	4	119.1015	0.094	6	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]S)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]S)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CC3){1|C<3>,1|C<4>,1|S<3>}	H(C[6]C[6]2)	118.8410	0.014	2	119.1015	0.094	6	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]S)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]S)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(CC3){1|C<3>,2|S<2>}	H(C[6]C[6]2)	118.8445	0.245	4	119.0460	0.095	12	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]S)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]S)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(CC3){1|C<3>,2|S<4>}	H(C[6]C[6]2)	118.8880	0.037	2	119.0460	0.095	12	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]S)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]S)(H){1|Ta<13>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(CC3){1|C<4>,1|H<1>,1|S<3>}	H(C[6]C[6]2)	119.5720	0.055	2	119.0460	0.095	12	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]S)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]S)(H){1|Ti<9>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(CC3){1|C<4>,2|S<2>}	H(C[6]C[6]2)	119.0635	0.174	4	119.0460	0.095	12	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]S)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]S)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,2|S<4>}	H(C[6]C[6]2)	118.7345	0.122	2	119.4100	0.397	5	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]S)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]S)(H){1|Ti<8>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(CH3){1|C<4>,1|H<1>,1|S<3>}	H(C[6]C[6]2)	119.7150	0.000	1	119.4100	0.397	5	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]S)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]S)(H){1|Zr<12>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(CH3){1|S<3>,2|C<4>}	H(C[6]C[6]2)	119.9330	0.136	2	119.4100	0.397	5	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(CC[6a]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(CC[6a]HH){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	119.9860	0.000	1	119.9860	0.000	1	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]S)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|N<3>,1|S<1>}	C[6](C[6]C[6]H)(C[6]N[6]S)(CH3){1|B<4>,1|C<4>,1|N<2>}	H(C[6]C[6]2)	120.2965	0.689	2	119.5941	0.217	19	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]S)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|N<3>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]S)(CH3){1|B<4>,1|C<4>,1|N<2>}	H(C[6]C[6]2)	119.6486	0.286	13	119.5941	0.217	19	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]S)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|N<3>,1|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]S)(CH3){1|C<4>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	119.0655	0.319	4	119.5941	0.217	19	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(C[6]S[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|S<4>}	C[6](C[6]C[6]H)(C[6]S[6]H)(CH3){1|C<4>,1|N<3>,2|O<1>}	H(C[6]C[6]2)	118.2510	0.000	1	118.2510	0.000	1	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(CC3){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	119.6925	0.482	6	119.5504	0.117	37	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(CC3){1|N<3>,2|C<4>}	H(C[6]C[6]2)	119.3483	0.406	6	119.5504	0.117	37	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|Co<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CC3){1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.7000	0.147	4	119.5504	0.117	37	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CC3){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8110	0.373	3	119.5504	0.117	37	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|Fe<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CC3){1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.5366	0.114	11	119.5504	0.117	37	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CC3){1|N<3>,2|C<4>}	H(C[6]C[6]2)	119.3465	0.128	2	119.5504	0.117	37	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CC3){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	119.4578	0.485	5	119.5504	0.117	37	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(CF3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(CF3){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	119.4230	0.000	1	120.3970	0.248	7	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(CF3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CF3){1|N<3>,2|C<4>}	H(C[6]C[6]2)	120.5460	0.308	5	120.3970	0.248	7	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(CF3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CF3){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.6260	0.000	1	120.3970	0.248	7	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	118.5330	0.218	2	119.4790	0.284	121	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|N<3>,2|C<4>}	H(C[6]C[6]2)	118.9595	0.125	8	119.4790	0.284	121	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)2(CH3){1|N<3>,2|C<4>}	H(C[6]C[6]2)	119.7190	0.000	2	119.4790	0.284	121	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	119.5925	0.111	2	119.4790	0.284	121	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(CH3){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.3790	0.684	15	119.4790	0.284	121	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(CH3){1|C<4>,2|N<3>}	H(C[6]C[6]2)	119.8460	0.290	2	119.4790	0.284	121	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(CH3){1|N<3>,2|C<4>}	H(C[6]C[6]2)	119.5878	0.496	29	119.4790	0.284	121	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|Cu<3>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.6440	0.488	2	119.4790	0.284	121	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|Cu<3>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|N<3>,2|C<4>}	H(C[6]C[6]2)	119.4928	0.044	4	119.4790	0.284	121	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8530	0.000	1	119.4790	0.284	121	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|N<3>,2|C<4>}	H(C[6]C[6]2)	119.6030	0.206	4	119.4790	0.284	121	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1310	0.000	1	119.4790	0.284	121	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|N<3>,2|C<4>}	H(C[6]C[6]2)	119.7795	0.211	4	119.4790	0.284	121	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|Ir<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8670	0.000	1	119.4790	0.284	121	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|Li<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|N<3>,2|C<4>}	H(C[6]C[6]2)	119.6320	0.190	2	119.4790	0.284	121	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|Mo<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|N<3>,2|C<4>}	H(C[6]C[6]2)	119.1887	0.444	4	119.4790	0.284	121	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|Ni<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.3234	0.519	5	119.4790	0.284	121	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.3210	0.000	1	119.4790	0.284	121	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|N<3>,2|C<4>}	H(C[6]C[6]2)	119.6230	0.000	1	119.4790	0.284	121	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0500	0.000	1	119.4790	0.284	121	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|Pt<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|N<3>,2|C<4>}	H(C[6]C[6]2)	119.3285	0.630	20	119.4790	0.284	121	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|Rh<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|C<4>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	119.8837	0.182	3	119.4790	0.284	121	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|Y<16>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|Y<16>,1|C<4>,1|C<5>,1|N<3>}	H(C[6]C[6]2)	119.9090	0.000	1	119.4790	0.284	121	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|N<3>,2|C<4>}	H(C[6]C[6]2)	119.6293	0.356	6	119.4790	0.284	121	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(CHHO){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.6610	0.000	1	120.9690	0.958	2	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)2(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|Ir<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CHHO){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2770	0.000	1	120.9690	0.958	2	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]Br)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Br<1>,1|C<3>,1|H<1>}	C[6](C[6]C[6]Br)(C[6]C[6]H)(CH3){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.8560	0.000	1	119.8560	0.000	1	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<2>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(CH3){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.2830	0.000	1	120.1245	1.386	34	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]C[6]H)(CH3){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.3192	1.382	23	120.1245	1.386	34	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,2|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(CH3){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.4050	0.068	2	120.1245	1.386	34	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Co<5>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(CH3){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.7775	0.396	4	120.1245	1.386	34	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(CH3){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.7130	0.000	1	120.1245	1.386	34	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(CH3){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.6330	0.000	1	120.1245	1.386	34	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Si<4>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(CH3){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.6000	0.000	1	120.1245	1.386	34	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ti<6>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(CH3){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.7420	0.000	1	120.1245	1.386	34	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(CH3){1|H<1>,2|N<3>}	H(C[6]C[6]2)	119.8850	0.381	3	119.8850	0.146	3	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CN[6]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CN[6]HH){1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	119.6870	0.000	1	119.6870	0.000	1	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]S)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|S<4>}	C[6](C[6]C[6]H)(C[6]C[6]S)(CCHH){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.6090	0.127	2	119.6090	0.016	2	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CBrHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CBrHH){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.2320	0.021	2	120.2320	0.000	2	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ag<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CC3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8480	0.093	4	119.7897	0.533	484	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CC3){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.6399	0.242	16	119.7897	0.533	484	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|W<6>}	C[6](C[6]C[6]H)2(CC3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8185	0.424	4	119.7897	0.533	484	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(CC3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3337	0.535	7	119.7897	0.533	484	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(CC3){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.7997	0.200	6	119.7897	0.533	484	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CC3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0670	0.071	3	119.7897	0.533	484	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CC3){1|N<3>,2|H<1>}	H(C[6]C[6]2)	121.3260	4.023	10	119.7897	0.533	484	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cr<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CC3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8042	0.370	4	119.7897	0.533	484	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cr<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CC3){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.4890	0.607	2	119.7897	0.533	484	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CC3){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0070	0.140	3	119.7897	0.533	484	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CC3){1|H<1>,1|N<3>,1|P<4>}	H(C[6]C[6]2)	119.8810	0.197	2	119.7897	0.533	484	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CC3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7011	0.216	14	119.7897	0.533	484	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CC3){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.8220	0.025	2	119.7897	0.533	484	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Fe<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CC3){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.7177	0.196	10	119.7897	0.533	484	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ga<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CC3){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.3514	0.147	5	119.7897	0.533	484	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ge<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CC3){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.6280	0.129	2	119.7897	0.533	484	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ir<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CC3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.6020	0.078	2	119.7897	0.533	484	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CC3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7374	0.358	53	119.7897	0.533	484	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ir<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CC3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.4050	0.103	2	119.7897	0.533	484	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CC3){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0840	0.000	1	119.7897	0.533	484	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CC3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9926	0.411	16	119.7897	0.533	484	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Mo<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CC3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9867	0.208	6	119.7897	0.533	484	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Mo<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CC3){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.6760	0.045	2	119.7897	0.533	484	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Mo<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CC3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.0200	0.414	2	119.7897	0.533	484	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ni<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CC3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1261	0.957	19	119.7897	0.533	484	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ni<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CC3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8685	0.179	2	119.7897	0.533	484	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CC3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1690	0.000	1	119.7897	0.533	484	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Os<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CC3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8374	0.652	5	119.7897	0.533	484	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Os<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CC3){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	119.6910	0.144	2	119.7897	0.533	484	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CC3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8213	0.193	37	119.7897	0.533	484	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CC3){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.6912	0.115	10	119.7897	0.533	484	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Pd<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CC3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8546	0.273	9	119.7897	0.533	484	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CC3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.5325	0.492	75	119.7897	0.533	484	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CC3){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.7160	0.000	1	119.7897	0.533	484	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Pt<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CC3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0329	0.287	10	119.7897	0.533	484	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Pt<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CC3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7082	0.387	52	119.7897	0.533	484	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Re<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CC3){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.5465	0.643	6	119.7897	0.533	484	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CC3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8774	0.289	15	119.7897	0.533	484	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Rh<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CC3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7345	0.330	17	119.7897	0.533	484	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CC3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7039	0.322	26	119.7897	0.533	484	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Si<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CC3){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.8238	0.184	4	119.7897	0.533	484	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CC3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9230	0.092	2	119.7897	0.533	484	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CC3){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.7173	0.096	3	119.7897	0.533	484	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Zn<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CC3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7532	0.367	10	119.7897	0.533	484	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CCCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CCCH){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.8910	0.065	2	119.8910	0.004	2	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ag<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CCHH){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.8785	0.043	2	119.8563	0.733	307	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<2>,2|H<1>}	C[6](C[6]C[6]H)2(CCHH){1|H<1>,1|N<3>}	H(C[6]C[6]2)	112.9380	0.000	1	119.8563	0.733	307	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(CCHH){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.5914	0.232	25	119.8563	0.733	307	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(CCHH){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.3300	0.197	18	119.8563	0.733	307	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(CCHH){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.0975	0.074	4	119.8563	0.733	307	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(CCHH){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.9312	0.815	178	119.8563	0.733	307	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Co<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CCHH){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.3565	0.011	2	119.8563	0.733	307	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CCHH){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.9237	0.216	16	119.8563	0.733	307	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CCHH){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.8890	0.089	2	119.8563	0.733	307	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CCHH){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.6240	0.000	1	119.8563	0.733	307	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CCHH){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.7652	0.253	14	119.8563	0.733	307	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Mo<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CCHH){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.3487	1.084	6	119.8563	0.733	307	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Os<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CCHH){1|N<3>,2|H<1>}	H(C[6]C[6]2)	121.0798	2.175	6	119.8563	0.733	307	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CCHH){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.8490	0.502	10	119.8563	0.733	307	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CCHH){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.6637	0.461	4	119.8563	0.733	307	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Pt<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CCHH){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.9302	0.336	6	119.8563	0.733	307	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CCHH){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.9617	0.224	6	119.8563	0.733	307	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Zn<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CCHH){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.1092	0.094	6	119.8563	0.733	307	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CCHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(CCHN){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.1893	0.145	4	120.1893	0.021	4	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CCHO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(CCHO){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.9465	0.387	4	119.9465	0.150	4	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CC[5]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(CC[5]HH){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.8445	0.057	2	119.7853	0.012	3	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CC[5]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CC[5]HH){1|H<1>,1|N<3>,1|P<4>}	H(C[6]C[6]2)	119.6670	0.000	1	119.7853	0.012	3	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CC[6a]2C)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CC[6a]2C){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.6105	0.120	2	119.6105	0.014	2	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CC[6a]2H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(CC[6a]2H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.9580	0.036	4	119.9580	0.001	4	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CC[6a]2O)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ag<2>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CC[6a]2O){1|N<3>,2|H<1>}	H(C[6]C[6]2)	121.6065	0.838	2	120.0085	0.356	40	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CC[6a]2O)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CC[6a]2O){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.1192	0.547	14	120.0085	0.356	40	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CC[6a]2O)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CC[6a]2O){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.8108	0.365	24	120.0085	0.356	40	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CC[6a]CO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(CC[6a]CO){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.8072	0.197	4	119.8072	0.039	4	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CC[6a]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(CC[6a]HH){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.5650	1.298	10	119.8031	0.627	28	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CC[6a]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(CC[6a]HH){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.8673	0.073	9	119.8031	0.627	28	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CC[6a]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CC[6a]HH){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.0036	0.306	9	119.8031	0.627	28	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CClHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(CClHH){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.2760	0.014	2	120.2125	0.017	4	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CClHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CClHH){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1490	0.182	2	120.2125	0.017	4	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CCo2C)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CCo2C){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.8780	0.733	4	119.7043	0.316	8	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CCo2C)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CCo2C){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.5305	0.346	4	119.7043	0.316	8	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CF3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(CF3){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.7135	1.722	2	120.9445	0.702	21	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CF3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cr<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CF3){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.7910	0.140	2	120.9445	0.702	21	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CF3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CF3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8939	0.267	12	120.9445	0.702	21	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CF3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CF3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5457	0.455	4	120.9445	0.702	21	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CF3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ru<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CF3){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	123.9160	0.000	1	120.9445	0.702	21	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CGeHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(CGeHH){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.8600	0.000	1	119.8600	0.000	1	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ag<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1568	0.613	4	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Al<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.8200	0.079	2	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|B<3>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.7270	0.308	2	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.7801	0.269	35	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Bi<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.6885	1.083	2	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9066	0.180	10	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.0725	1.150	2	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.0760	0.000	1	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.4772	0.937	77	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|D<1>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.9370	0.054	2	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|I<1>}	C[6](C[6]C[6]H)2(CH3){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.7900	0.156	2	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)2(CH3){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.4345	0.095	2	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(CH3){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.5970	0.157	2	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.0730	0.000	1	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(CH3){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.5585	0.970	28	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(CH3){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.4955	0.137	8	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|O<3>}	C[6](C[6]C[6]H)2(CH3){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.3870	0.228	2	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|S<4>}	C[6](C[6]C[6]H)2(CH3){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.6450	0.000	1	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|W<6>}	C[6](C[6]C[6]H)2(CH3){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.9140	0.781	4	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(CH3){1|Br<1>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1013	1.572	3	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2112	0.148	6	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(CH3){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.2829	1.511	15	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(CH3){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.4567	2.591	3	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(CH3){1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.6517	1.197	3	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(CH3){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.2605	0.905	46	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(CH3){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.9956	1.023	82	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cd<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8300	0.134	2	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cd<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.5690	0.057	4	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cd<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2570	0.078	2	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Co<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.3992	0.398	6	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Co<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9555	0.035	2	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Co<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.9323	0.136	3	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1110	0.066	2	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.9553	1.954	6	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Co<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7235	0.624	2	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cr<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0190	0.000	1	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cr<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.9650	0.170	4	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cu<2>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.9130	0.000	1	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cu<3>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2985	0.351	2	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cu<3>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1705	0.101	2	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cu<3>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.5100	0.027	2	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8626	0.301	8	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	117.9500	0.000	1	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	121.0480	0.000	1	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|H<1>,1|N<3>,1|P<4>}	H(C[6]C[6]2)	120.0660	0.173	2	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.5150	0.153	2	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.9228	0.256	22	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1246	0.190	10	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.1820	0.348	2	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.2020	0.031	2	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.6140	0.187	4	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.7001	0.383	9	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Fe<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.1705	0.408	2	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0298	0.158	12	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0800	0.000	1	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.9202	0.207	4	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ga<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.8023	0.669	6	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Hg<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2080	0.337	2	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ir<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.0648	0.093	4	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9652	0.511	50	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.1135	0.009	2	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	119.8546	0.102	5	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.2140	0.294	5	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ir<7>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|Ir<7>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.3545	0.049	2	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1075	0.353	2	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Li<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.9683	0.416	15	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Mg<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.9310	0.274	2	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Mn<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.2150	1.823	2	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4542	1.070	21	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.2185	0.162	2	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Mn<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.8935	0.082	4	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Mo<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7020	0.322	6	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Mo<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.9124	0.233	16	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Mo<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7992	0.350	5	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ni<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0181	0.417	8	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ni<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3748	0.342	5	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ni<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.8107	0.222	4	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ni<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.0603	0.256	3	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9734	0.471	17	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.7048	0.535	16	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Os<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8008	0.519	4	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0851	0.659	16	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2820	0.000	1	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	119.6835	0.262	2	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|H<1>,2|N<3>}	H(C[6]C[6]2)	119.9880	0.000	1	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.8403	0.431	23	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Pt<3>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.8720	0.120	2	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9211	0.477	21	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.5900	0.000	1	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.7258	0.716	27	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Pt<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.1190	0.143	2	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Pt<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0528	0.311	5	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Pt<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.8907	0.088	6	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Re<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0210	0.168	2	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8555	0.481	27	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.8282	0.196	9	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Rh<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.6915	0.223	2	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Rh<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.9343	0.190	4	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Rh<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0815	0.250	2	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ru<10>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|Ru<10>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.4280	0.368	2	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ru<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.2240	0.059	2	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7730	1.475	27	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.0765	0.056	2	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|H<1>,1|N<3>,1|N<4>}	H(C[6]C[6]2)	119.8020	0.000	1	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|H<1>,2|N<3>}	H(C[6]C[6]2)	119.7810	0.000	1	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.7938	0.186	18	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ru<7>,1|Ru<9>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|Ru<9>,1|C<4>,1|H<1>,1|N<4>}	H(C[6]C[6]2)	119.1355	0.015	2	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ru<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7460	0.061	2	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ru<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.5220	0.000	1	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ru<8>,1|Ru<9>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|Rh<8>,1|Ru<9>,1|H<1>,1|N<4>}	H(C[6]C[6]2)	119.5890	0.000	1	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ru<9>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.6645	0.210	2	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ru<9>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.2740	0.000	2	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ru<9>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.8360	0.386	2	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Si<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.5245	0.245	2	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Si<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.1808	0.170	4	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Si<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.8940	0.148	8	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Sm<11>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.1142	0.113	4	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Sn<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.0505	0.114	2	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Sn<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0735	0.161	2	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Tc<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.8868	0.109	4	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ti<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.7745	0.139	2	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Y<15>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|Y<15>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.3820	0.000	1	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1830	0.253	2	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.7387	0.317	4	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Zn<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9165	0.190	2	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Zn<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9455	0.272	2	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Zr<12>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|Zr<12>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.5400	0.171	8	119.9480	0.594	941	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CHHN){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.6785	0.491	2	120.0717	0.864	85	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(CHHN){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.9940	0.159	4	120.0717	0.864	85	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(CHHN){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.3270	0.000	1	120.0717	0.864	85	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(CHHN){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.9745	1.101	44	120.0717	0.864	85	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cd<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CHHN){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.0610	0.014	2	120.0717	0.864	85	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CHHN){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.5003	1.065	14	120.0717	0.864	85	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CHHN){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2195	0.182	2	120.0717	0.864	85	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CHHN){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5245	0.438	2	120.0717	0.864	85	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CHHN){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.8167	0.275	4	120.0717	0.864	85	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CHHN){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.3390	0.153	2	120.0717	0.864	85	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ru<9>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CHHN){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.0750	0.137	2	120.0717	0.864	85	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CHHN){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.9752	0.148	6	120.0717	0.864	85	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(CHHO){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	122.0940	0.000	1	120.4861	0.962	49	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(CHHO){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.7790	0.744	18	120.4861	0.962	49	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CHHO){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.4505	0.292	2	120.4861	0.962	49	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ir<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CHHO){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.9610	0.150	2	120.4861	0.962	49	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CHHO){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2540	0.190	2	120.4861	0.962	49	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CHHO){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3575	0.112	2	120.4861	0.962	49	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CHHO){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2027	0.266	6	120.4861	0.962	49	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CHHO){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.7127	3.105	4	120.4861	0.962	49	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CHHO){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1155	0.059	2	120.4861	0.962	49	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CHHO){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3360	0.000	1	120.4861	0.962	49	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CHHO){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.2310	0.000	1	120.4861	0.962	49	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Rh<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CHHO){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.9920	0.064	2	120.4861	0.962	49	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Rh<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CHHO){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.9615	0.323	2	120.4861	0.962	49	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CHHO){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.1350	0.030	2	120.4861	0.962	49	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Zn<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CHHO){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3085	0.138	2	120.4861	0.962	49	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(CHHP){1|N<3>,2|H<1>}	H(C[6]C[6]2)	121.1030	1.809	2	120.3754	0.691	8	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(CHHP){1|H<1>,1|N<3>,1|P<4>}	H(C[6]C[6]2)	120.2745	0.183	2	120.3754	0.691	8	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CHHP){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9600	0.086	2	120.3754	0.691	8	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CHHP){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1640	0.109	2	120.3754	0.691	8	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CHHS)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Rh<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CHHS){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.9560	0.944	6	119.9560	0.891	6	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CHOO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(CHOO){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.1920	0.020	2	120.1863	0.000	3	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CHOO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CHOO){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1750	0.000	1	120.1863	0.000	3	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CHOP)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(CHOP){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.0370	0.078	2	120.0370	0.006	2	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CNOV)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(CNOV){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.5680	0.034	2	120.5680	0.001	2	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CN[5]2H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CN[5]2H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.1505	0.124	2	120.1505	0.015	2	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CN[5]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(CN[5]HH){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.2429	0.339	8	120.2005	0.111	12	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CN[5]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ir<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CN[5]HH){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.9625	0.508	2	120.2005	0.111	12	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CN[5]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CN[5]HH){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.2690	0.141	2	120.2005	0.111	12	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CN[5a]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(CN[5a]HH){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.2993	0.240	4	120.3190	0.045	5	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CN[5a]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CN[5a]HH){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3980	0.000	1	120.3190	0.045	5	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CN[6]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(CN[6]HH){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.0993	0.160	4	120.4695	1.013	60	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CN[6]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(CN[6]HH){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.8706	1.191	33	120.4695	1.013	60	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CN[6]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Cd<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CN[6]HH){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.0530	0.245	9	120.4695	1.013	60	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CN[6]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CN[6]HH){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.8443	0.376	12	120.4695	1.013	60	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CN[6]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Zn<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CN[6]HH){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.2170	0.212	2	120.4695	1.013	60	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CSeHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(CSeHH){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.7310	0.228	4	119.7035	0.038	6	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CSeHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(CSeHH){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.6485	0.158	2	119.7035	0.038	6	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CSi2H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(CSi2H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.5745	0.039	2	119.5745	0.002	2	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(CSiHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(CSiHH){1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.5965	0.092	4	119.5965	0.009	4	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]N)(H){1|Os<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CC3){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	118.6160	0.233	2	118.6160	0.054	2	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]N)(H){1|Co<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CCHH){1|H<1>,2|N<3>}	H(C[6]C[6]2)	119.7740	0.222	2	119.7740	0.049	2	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]N)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|H<1>,2|N<3>}	H(C[6]C[6]2)	119.4150	0.000	1	119.8398	0.903	88	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]N)(H){1|C<3>,1|H<1>,1|S<4>}	C[6](C[6]C[6]H)2(CH3){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.5560	0.000	1	119.8398	0.903	88	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(CH3){1|C<4>,2|N<3>}	H(C[6]C[6]2)	119.5090	0.308	2	119.8398	0.903	88	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(CH3){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.5287	2.019	3	119.8398	0.903	88	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(CH3){1|H<1>,2|N<3>}	H(C[6]C[6]2)	119.9981	1.144	46	119.8398	0.903	88	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]N)(H){1|Cd<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	119.1575	0.105	4	119.8398	0.903	88	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]N)(H){1|Co<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.0208	0.364	6	119.8398	0.903	88	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]N)(H){1|Cu<3>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|H<1>,2|N<3>}	H(C[6]C[6]2)	119.8610	0.190	2	119.8398	0.903	88	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]N)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	119.5970	0.000	1	119.8398	0.903	88	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]N)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|H<1>,2|N<3>}	H(C[6]C[6]2)	119.4300	0.154	2	119.8398	0.903	88	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]N)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	119.1775	0.019	2	119.8398	0.903	88	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]N)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|H<1>,2|N<3>}	H(C[6]C[6]2)	119.9945	0.100	4	119.8398	0.903	88	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]N)(H){1|Fe<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	119.2635	0.057	2	119.8398	0.903	88	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]N)(H){1|Ir<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	119.8475	0.129	2	119.8398	0.903	88	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]N)(H){1|Ir<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|H<1>,2|N<3>}	H(C[6]C[6]2)	119.7535	0.043	2	119.8398	0.903	88	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]N)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	119.2630	0.000	1	119.8398	0.903	88	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]N)(H){1|Ru<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|H<1>,2|N<3>}	H(C[6]C[6]2)	119.5580	0.191	2	119.8398	0.903	88	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]N)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	118.8455	0.071	2	119.8398	0.903	88	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]N)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|H<1>,1|N<3>,1|N<4>}	H(C[6]C[6]2)	119.5760	0.000	1	119.8398	0.903	88	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]N)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]N)(H){1|Ru<9>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	119.3850	0.000	2	119.8398	0.903	88	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]O)(H)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]O)(H){1|C<4>,1|H<1>,1|O<1>}	C[6](C[6]C[6,6]O)(C[6]C[6]H)(CH3){1|O<1>,3|N<3>}	H(C[6]C[6]2)	118.1780	0.000	1	118.1780	0.000	1	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]O)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]O)(H){1|C<2>,1|C<3>,1|H<1>}	C[6](C[6]C[6]C)(C[6]C[6]H)(CH3){1|N<3>,2|O<1>}	H(C[6]C[6]2)	119.2600	0.000	1	119.2600	0.000	1	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(CC[6a]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]O)(H){1|C<4>,1|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]C)(CC[6a]HH){1|N<2>,1|O<1>}	H(C[6]C[6]2)	118.6590	0.000	1	118.6590	0.000	1	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]O)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(CH3){1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	119.7623	1.144	3	119.8549	0.277	19	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]O)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.3640	0.089	2	119.8549	0.277	19	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]O)(H){1|Ir<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	119.8915	0.133	4	119.8549	0.277	19	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]O)(H){1|Ir<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	119.5994	0.313	5	119.8549	0.277	19	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]O)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.1210	0.775	2	119.8549	0.277	19	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]O)(H){1|Rh<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|C<4>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	119.8077	0.388	3	119.8549	0.277	19	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]P)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]P)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CC3){1|H<1>,1|N<3>,1|P<4>}	H(C[6]C[6]2)	119.4630	0.068	2	119.4630	0.005	2	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]P)(H)	C[6](C[6]C[6]H)2(CC[5]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]P)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CC[5]HH){1|H<1>,1|N<3>,1|P<4>}	H(C[6]C[6]2)	119.5910	0.000	1	119.5910	0.000	1	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]P)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]P)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|H<1>,1|N<3>,1|P<4>}	H(C[6]C[6]2)	119.4935	0.271	2	119.4935	0.073	2	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]P)(H)	C[6](C[6]C[6]H)2(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]P)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(CHHP){1|H<1>,1|N<3>,1|P<4>}	H(C[6]C[6]2)	119.7790	0.051	2	119.7790	0.003	2	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]B[6]H)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|B<4>,2|H<1>}	C[6](C[6]B[6]H)(C[6]C[6]H)(CH3){1|Mg<6>,1|C<3>,1|C<4>,1|N<4>}	H(C[6]C[6]2)	118.8847	3.229	4	118.8847	10.427	4	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<4>,1|H<1>,1|O<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(CC3){1|C<3>,1|C<4>,1|O<2>,1|S<2>}	H(C[6]C[6]2)	117.0755	0.301	2	117.0755	0.090	2	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[5,6]O)(C[6]C[6]H)(CC[6a]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<4>,1|H<1>,1|O<1>}	C[6](C[6]C[5,6]O)(C[6]C[6]H)(CC[6a]HH){1|C<3>,1|C<4>,1|O<2>,1|S<2>}	H(C[6]C[6]2)	117.4165	0.155	2	117.4165	0.024	2	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|O<2>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(CC3){1|C<3>,1|C<4>,1|O<1>}	H(C[6]C[6]2)	117.5585	0.052	4	117.4710	0.040	5	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Zr<16>,1|C<3>,1|C<4>,1|O<2>}	C[6](C[6]C[6]C)(C[6]C[6]H)(CC3){1|Zr<16>,1|O<2>,2|C<4>}	H(C[6]C[6]2)	117.1210	0.000	1	117.4710	0.040	5	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(CF3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|C<4>,1|O<2>,1|W<8>}	C[6](C[6]C[6]C)(C[6]C[6]H)(CF3){1|C<3>,2|C<4>}	H(C[6]C[6]2)	119.0965	0.624	2	119.0965	0.390	2	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]C[6]H)(CH3){1|C<4>,2|C<3>}	H(C[6]C[6]2)	114.5030	0.000	1	114.5030	0.000	1	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(CCCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|N<2>}	C[6](C[6]C[6]H)(C[6]C[6]N)(CCCH){1|C<2>,2|C<4>}	H(C[6]C[6]2)	111.8580	0.000	1	111.8580	0.000	1	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]C[6]N)(CH3){1|C<4>,2|C<3>}	H(C[6]C[6]2)	116.9760	1.324	2	117.0574	2.148	5	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(CH3){1|C<4>,2|C<3>}	H(C[6]C[6]2)	116.1710	1.229	2	117.0574	2.148	5	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(CH3){1|Ir<7>,1|C<3>,2|C<4>}	H(C[6]C[6]2)	118.9930	0.000	1	117.0574	2.148	5	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CC3){1|C<3>,1|C<4>,1|N<2>}	H(C[6]C[6]2)	118.8633	1.051	3	118.2189	0.954	61	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CC3){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	117.6647	0.265	3	118.2189	0.954	61	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CC3){1|C<3>,1|C<4>,1|O<1>}	H(C[6]C[6]2)	117.3277	0.684	3	118.2189	0.954	61	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CC3){1|C<3>,2|C<4>}	H(C[6]C[6]2)	118.6852	0.728	25	118.2189	0.954	61	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CC3){1|C<4>,2|C<3>}	H(C[6]C[6]2)	117.8178	1.109	21	118.2189	0.954	61	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CC3){1|C<4>,2|C<3>}	H(C[6]C[6]2)	119.0940	0.313	2	118.2189	0.954	61	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|O<2>,2|C<3>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CC3){1|C<3>,1|C<4>,1|O<1>}	H(C[6]C[6]2)	117.5742	0.031	4	118.2189	0.954	61	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CCCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CCCH){1|C<4>,2|C<3>}	H(C[6]C[6]2)	118.3835	0.282	2	118.3835	0.080	2	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CC[6]CH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|O<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CC[6]CH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	118.3715	0.081	2	117.6707	1.324	12	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CC[6]CH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|O<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CC[6]CH){1|C<4>,2|C<3>}	H(C[6]C[6]2)	117.4749	0.174	8	117.6707	1.324	12	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CC[6]CH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,2|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CC[6]CH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	117.7535	3.611	2	117.6707	1.324	12	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CC[6]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<2>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CC[6]HH){2|C<3>}	H(C[6]C[6]2)	122.6340	0.371	2	119.5961	2.315	12	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CC[6]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CC[6]HH){1|C<3>,2|C<4>}	H(C[6]C[6]2)	118.7426	0.317	8	119.5961	2.315	12	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CC[6]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CC[6]HH){3|C<3>}	H(C[6]C[6]2)	119.8080	0.000	1	119.5961	2.315	12	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CC[6]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CC[6]HH){1|C<4>,2|C<3>}	H(C[6]C[6]2)	120.1360	0.000	1	119.5961	2.315	12	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CC[6a]CH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|O<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CC[6a]CH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	118.2092	0.748	10	118.5098	1.370	17	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CC[6a]CH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|O<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CC[6a]CH){1|C<3>,2|C<4>}	H(C[6]C[6]2)	118.2948	0.212	4	118.5098	1.370	17	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CC[6a]CH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|O<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CC[6a]CH){1|H<1>,2|C<3>}	H(C[6]C[6]2)	122.4670	0.000	1	118.5098	1.370	17	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CC[6a]CH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,2|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CC[6a]CH){1|C<3>,1|C<4>,1|O<1>}	H(C[6]C[6]2)	118.4640	0.037	2	118.5098	1.370	17	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CC[6a]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CC[6a]HH){1|C<3>,2|C<4>}	H(C[6]C[6]2)	118.8644	0.567	5	118.8644	0.321	5	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CH3){1|C<4>,2|C<3>}	H(C[6]C[6]2)	118.4367	0.149	20	118.4367	0.022	20	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CHHN){1|C<4>,2|C<3>}	H(C[6]C[6]2)	118.4885	0.081	2	118.4885	0.007	2	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CHHO){1|C<3>,2|C<4>}	H(C[6]C[6]2)	118.1570	0.000	1	118.1570	0.000	1	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(C[6]C[6]P)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|P<4>}	C[6](C[6]C[6]H)(C[6]C[6]P)(CH3){1|C<2>,2|C<4>}	H(C[6]C[6]2)	117.9260	0.000	1	117.9260	0.000	1	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(CCHH){1|Co<5>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	118.0482	0.432	4	118.1942	0.145	16	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(CCHH){1|Cr<6>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	118.3220	0.055	4	118.1942	0.145	16	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|N<3>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(CCHH){1|Fe<5>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	118.2032	0.456	8	118.1942	0.145	16	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CCHH){1|Pt<4>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	119.3530	0.133	2	119.3530	0.018	2	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CC[6a]HN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CC[6a]HN){1|C<3>,1|C<4>,1|O<1>}	H(C[6]C[6]2)	120.0830	0.430	2	120.0830	0.185	2	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|C<3>,2|C<4>}	H(C[6]C[6]2)	118.5390	0.020	2	119.3552	0.330	187	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<4>,1|N<4>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){4|C<4>}	H(C[6]C[6]2)	120.0730	0.000	1	119.3552	0.330	187	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|B<3>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	119.5630	0.021	2	119.3552	0.330	187	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.0966	0.650	49	119.3552	0.330	187	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|C<3>,1|C<4>,1|O<1>}	H(C[6]C[6]2)	120.1065	0.347	2	119.3552	0.330	187	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|C<3>,2|C<4>}	H(C[6]C[6]2)	118.9734	0.250	7	119.3552	0.330	187	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|C<4>,2|C<3>}	H(C[6]C[6]2)	119.2198	0.057	5	119.3552	0.330	187	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Co<4>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	119.5417	0.104	3	119.3552	0.330	187	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Co<6>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	119.6190	0.042	2	119.3552	0.330	187	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Cu<5>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	119.4920	0.122	2	119.3552	0.330	187	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Cu<6>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	119.8430	0.000	1	119.3552	0.330	187	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Ga<4>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	119.3444	0.569	38	119.3552	0.330	187	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.1700	0.000	1	119.3552	0.330	187	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Hg<4>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	118.8446	0.647	5	119.3552	0.330	187	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Li<4>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	119.5613	0.035	3	119.3552	0.330	187	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Mg<4>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	119.7130	0.257	4	119.3552	0.330	187	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Mg<6>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	119.1280	2.807	2	119.3552	0.330	187	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Mn<6>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	119.3895	0.022	2	119.3552	0.330	187	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Mo<6>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	119.7704	0.087	8	119.3552	0.330	187	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Ni<6>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	119.5679	0.124	8	119.3552	0.330	187	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Pd<4>,1|C<2>,1|C<3>}	H(C[6]C[6]2)	120.0040	0.000	1	119.3552	0.330	187	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Pd<4>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	119.3580	0.207	7	119.3552	0.330	187	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Pt<4>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	119.5671	0.472	8	119.3552	0.330	187	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Re<6>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	119.8360	0.321	6	119.3552	0.330	187	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Si<6>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	119.4002	0.233	4	119.3552	0.330	187	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Ti<12>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	120.0512	0.064	4	119.3552	0.330	187	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Zn<4>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	119.4783	0.104	8	119.3552	0.330	187	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Zn<5>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	119.5675	0.050	2	119.3552	0.330	187	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|N<3>,2|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]N)(CCHH){1|Ni<4>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	117.3530	0.093	2	117.3530	0.009	2	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(C[6]P[6]P)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|P<2>,2|P<3>}	C[6](C[6]C[6]H)(C[6]P[6]P)(CH3){1|C<3>,1|C<4>}	H(C[6]C[6]2)	116.9290	0.025	2	116.9290	0.001	2	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|H<1>,1|N<3>,1|V<5>}	C[6](C[6]C[6]H)2(CC3){3|C<4>}	H(C[6]C[6]2)	118.9437	0.138	4	118.3441	1.104	154	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(CC3){1|Br<1>,2|C<3>}	H(C[6]C[6]2)	118.8765	0.218	2	118.3441	1.104	154	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(CC3){1|C<3>,1|C<4>,1|N<2>}	H(C[6]C[6]2)	115.4550	1.052	3	118.3441	1.104	154	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(CC3){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	117.6910	0.250	3	118.3441	1.104	154	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(CC3){1|C<3>,1|C<4>,1|O<1>}	H(C[6]C[6]2)	117.5027	0.618	3	118.3441	1.104	154	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(CC3){1|C<3>,2|C<4>}	H(C[6]C[6]2)	118.0050	0.740	3	118.3441	1.104	154	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(CC3){1|C<4>,2|C<3>}	H(C[6]C[6]2)	118.5664	2.249	13	118.3441	1.104	154	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(CC3){3|C<3>}	H(C[6]C[6]2)	121.5710	3.305	2	118.3441	1.104	154	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|H<1>,1|O<2>,1|U<8>}	C[6](C[6]C[6]H)2(CC3){3|C<4>}	H(C[6]C[6]2)	118.4355	0.732	2	118.3441	1.104	154	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|H<1>,1|O<2>,1|V<5>}	C[6](C[6]C[6]H)2(CC3){3|C<4>}	H(C[6]C[6]2)	118.7165	0.118	2	118.3441	1.104	154	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|H<1>,1|O<2>,1|V<6>}	C[6](C[6]C[6]H)2(CC3){3|C<4>}	H(C[6]C[6]2)	118.4745	0.241	2	118.3441	1.104	154	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|H<1>,1|O<2>,1|V<7>}	C[6](C[6]C[6]H)2(CC3){1|C<3>,2|C<4>}	H(C[6]C[6]2)	117.7430	0.021	2	118.3441	1.104	154	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|H<1>,1|O<2>,1|V<7>}	C[6](C[6]C[6]H)2(CC3){3|C<4>}	H(C[6]C[6]2)	118.4898	0.561	4	118.3441	1.104	154	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|H<1>,1|O<2>,1|V<8>}	C[6](C[6]C[6]H)2(CC3){1|C<3>,2|C<4>}	H(C[6]C[6]2)	117.8680	0.099	2	118.3441	1.104	154	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(CC3){1|C<4>,2|C<3>}	H(C[6]C[6]2)	119.6095	0.856	2	118.3441	1.104	154	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|P<4>,2|H<1>}	C[6](C[6]C[6]H)2(CC3){3|C<4>}	H(C[6]C[6]2)	118.4285	0.316	2	118.3441	1.104	154	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<4>,1|H<1>,1|O<2>,1|U<9>}	C[6](C[6]C[6]H)2(CC3){1|N<3>,1|U<9>,2|C<4>}	H(C[6]C[6]2)	117.5080	0.000	1	118.3441	1.104	154	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(CC3){1|U<12>,1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	118.7050	0.008	2	118.3441	1.104	154	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Ce<14>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(CC3){3|C<4>}	H(C[6]C[6]2)	118.3045	0.960	4	118.3441	1.104	154	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Ce<16>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(CC3){1|C<5>,2|C<4>}	H(C[6]C[6]2)	118.5370	0.653	15	118.3441	1.104	154	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Ho<14>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(CC3){1|Ho<14>,1|C<5>,2|C<4>}	H(C[6]C[6]2)	118.0040	0.000	1	118.3441	1.104	154	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Ho<15>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(CC3){1|Ho<15>,1|C<5>,2|C<4>}	H(C[6]C[6]2)	117.8490	0.000	1	118.3441	1.104	154	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Lu<14>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(CC3){1|Lu<14>,1|C<5>,2|C<4>}	H(C[6]C[6]2)	117.9050	0.000	1	118.3441	1.104	154	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Ni<5>,1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(CC3){1|Ni<5>,1|C<3>,2|C<4>}	H(C[6]C[6]2)	118.9420	0.000	1	118.3441	1.104	154	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Ru<10>,1|C<4>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(CC3){1|Ru<10>,1|O<2>,2|C<4>}	H(C[6]C[6]2)	117.4600	0.406	2	118.3441	1.104	154	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Ta<13>,1|C<4>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(CC3){1|Ta<13>,1|N<3>,2|C<4>}	H(C[6]C[6]2)	118.1810	0.000	1	118.3441	1.104	154	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Ta<8>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(CC3){1|C<3>,2|C<4>}	H(C[6]C[6]2)	118.0055	0.324	6	118.3441	1.104	154	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Ti<10>,1|C<4>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(CC3){1|Ti<10>,1|N<3>,2|C<4>}	H(C[6]C[6]2)	118.7150	0.167	2	118.3441	1.104	154	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Ti<11>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(CC3){3|C<4>}	H(C[6]C[6]2)	117.7625	0.013	4	118.3441	1.104	154	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Ti<13>,1|C<4>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(CC3){1|Ti<13>,1|O<3>,2|C<4>}	H(C[6]C[6]2)	118.0238	0.172	4	118.3441	1.104	154	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Ti<7>,1|C<3>,1|H<1>,1|O<3>}	C[6](C[6]C[6]H)2(CC3){3|C<4>}	H(C[6]C[6]2)	118.6105	0.216	2	118.3441	1.104	154	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Ti<8>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(CC3){3|C<4>}	H(C[6]C[6]2)	118.5665	0.436	2	118.3441	1.104	154	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Ti<9>,1|C<4>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(CC3){1|Ti<9>,1|O<3>,2|C<4>}	H(C[6]C[6]2)	118.0540	0.000	1	118.3441	1.104	154	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|U<10>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(CC3){3|C<4>}	H(C[6]C[6]2)	118.5812	0.571	29	118.3441	1.104	154	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|U<16>,1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)2(CC3){3|C<4>}	H(C[6]C[6]2)	117.9220	0.164	2	118.3441	1.104	154	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|U<16>,1|C<4>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(CC3){1|U<16>,1|N<3>,2|C<4>}	H(C[6]C[6]2)	118.0880	0.000	1	118.3441	1.104	154	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|W<14>,1|C<4>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(CC3){1|W<14>,1|N<3>,2|C<4>}	H(C[6]C[6]2)	118.4740	0.089	4	118.3441	1.104	154	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Y<14>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(CC3){1|Y<14>,1|C<5>,2|C<4>}	H(C[6]C[6]2)	117.9760	0.000	1	118.3441	1.104	154	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Yb<14>,1|C<4>,1|H<1>,1|O<3>}	C[6](C[6]C[6]H)2(CC3){1|Yb<14>,1|N<3>,2|C<4>}	H(C[6]C[6]2)	118.1405	0.054	2	118.3441	1.104	154	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Zr<12>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(CC3){1|C<5>,2|C<4>}	H(C[6]C[6]2)	118.3990	0.215	2	118.3441	1.104	154	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Zr<13>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(CC3){3|C<4>}	H(C[6]C[6]2)	117.4670	0.000	2	118.3441	1.104	154	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Zr<7>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(CC3){1|C<3>,2|C<4>}	H(C[6]C[6]2)	117.9505	1.457	2	118.3441	1.104	154	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Zr<8>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(CC3){1|C<3>,2|C<4>}	H(C[6]C[6]2)	117.7620	0.064	2	118.3441	1.104	154	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){2|Dy<15>,1|C<3>,1|H<1>,1|O<3>}	C[6](C[6]C[6]H)2(CC3){1|C<5>,2|C<3>}	H(C[6]C[6]2)	118.4125	0.057	2	118.3441	1.104	154	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){2|Ho<15>,1|C<3>,1|H<1>,1|O<3>}	C[6](C[6]C[6]H)2(CC3){1|C<5>,2|C<3>}	H(C[6]C[6]2)	118.8025	0.152	2	118.3441	1.104	154	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){2|Tb<15>,1|C<3>,1|H<1>,1|O<3>}	C[6](C[6]C[6]H)2(CC3){1|C<5>,2|C<3>}	H(C[6]C[6]2)	118.4740	0.058	2	118.3441	1.104	154	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CCCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Cr<4>,1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(CCCH){3|C<4>}	H(C[6]C[6]2)	118.9555	0.210	2	118.8360	0.016	24	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CCCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Pd<4>,1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(CCCH){3|C<4>}	H(C[6]C[6]2)	118.8200	0.116	21	118.8360	0.016	24	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CCCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Pd<5>,1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(CCCH){1|Pd<5>,3|C<4>}	H(C[6]C[6]2)	118.9330	0.000	1	118.8360	0.016	24	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(CCHH){1|O<2>,2|C<3>}	H(C[6]C[6]2)	123.5070	0.000	1	123.5070	0.000	1	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CC[6]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(CC[6]HH){1|C<3>,2|C<4>}	H(C[6]C[6]2)	118.0449	0.583	15	118.0449	0.339	15	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CC[6a]3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(CC[6a]3){1|C<3>,2|C<4>}	H(C[6]C[6]2)	118.6120	0.105	4	118.6120	0.011	4	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CC[6a]CC)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(CC[6a]CC){1|C<3>,2|C<4>}	H(C[6]C[6]2)	118.3786	0.226	10	118.3786	0.051	10	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CF3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CF3){1|B<4>,1|C<2>,1|C<4>}	H(C[6]C[6]2)	120.7320	0.000	1	120.6616	0.007	5	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CF3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){2|Li<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CF3){3|C<4>}	H(C[6]C[6]2)	120.6440	0.085	4	120.6616	0.007	5	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|C<4>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(CH3){1|O<1>,2|C<4>}	H(C[6]C[6]2)	118.5405	0.122	2	118.9333	0.933	196	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|C<4>,2|C<3>}	H(C[6]C[6]2)	118.4245	5.242	2	118.9333	0.933	196	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,3|C<4>}	H(C[6]C[6]2)	118.6010	0.000	1	118.9333	0.933	196	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|H<1>,1|N<3>,1|V<7>}	C[6](C[6]C[6]H)2(CH3){3|C<4>}	H(C[6]C[6]2)	118.8850	0.150	2	118.9333	0.933	196	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,2|C<4>}	H(C[6]C[6]2)	118.1033	0.788	6	118.9333	0.933	196	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(CH3){1|C<4>,2|C<3>}	H(C[6]C[6]2)	118.6528	0.409	6	118.9333	0.933	196	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(CH3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	118.8777	0.236	6	118.9333	0.933	196	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(CH3){3|C<3>}	H(C[6]C[6]2)	118.4820	0.185	3	118.9333	0.933	196	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|H<1>,1|O<2>,1|U<8>}	C[6](C[6]C[6]H)2(CH3){3|C<4>}	H(C[6]C[6]2)	118.9565	0.200	2	118.9333	0.933	196	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|H<1>,1|O<2>,1|U<9>}	C[6](C[6]C[6]H)2(CH3){3|C<4>}	H(C[6]C[6]2)	118.5243	0.534	7	118.9333	0.933	196	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|H<1>,1|O<2>,1|V<8>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	118.6850	0.000	1	118.9333	0.933	196	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(CH3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	118.3200	0.000	1	118.9333	0.933	196	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|P<4>,2|H<1>}	C[6](C[6]C[6]H)2(CH3){3|C<4>}	H(C[6]C[6]2)	118.1395	0.037	2	118.9333	0.933	196	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(CH3){1|C<4>,2|C<3>}	H(C[6]C[6]2)	119.3270	0.968	8	118.9333	0.933	196	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(CH3){1|Ir<7>,1|C<3>,2|C<4>}	H(C[6]C[6]2)	119.3590	0.000	1	118.9333	0.933	196	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(CH3){1|Ru<6>,1|C<3>,2|C<4>}	H(C[6]C[6]2)	119.0160	0.182	2	118.9333	0.933	196	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|C<4>,1|N<3>,1|V<7>}	H(C[6]C[6]2)	119.1845	0.314	8	118.9333	0.933	196	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|C<4>,1|N<3>,1|W<7>}	H(C[6]C[6]2)	119.1385	0.035	2	118.9333	0.933	196	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(CH3){1|Mo<9>,1|C<3>,2|C<4>}	H(C[6]C[6]2)	119.1170	0.000	1	118.9333	0.933	196	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(CH3){1|Ta<11>,1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	118.9880	0.153	6	118.9333	0.933	196	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(CH3){1|Ta<12>,1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	118.8768	0.214	4	118.9333	0.933	196	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(CH3){1|U<17>,1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	119.1331	0.288	7	118.9333	0.933	196	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(CH3){1|Zr<13>,1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	119.3655	0.062	2	118.9333	0.933	196	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Ce<11>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(CH3){1|P<4>,2|C<4>}	H(C[6]C[6]2)	117.7463	0.232	3	118.9333	0.933	196	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Cu<6>,1|B<4>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|Cu<6>,3|C<4>}	H(C[6]C[6]2)	118.7520	0.000	1	118.9333	0.933	196	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Dy<12>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(CH3){3|C<4>}	H(C[6]C[6]2)	119.0153	0.026	3	118.9333	0.933	196	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Dy<15>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(CH3){1|O<2>,2|C<4>}	H(C[6]C[6]2)	119.2830	0.000	1	118.9333	0.933	196	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Dy<15>,1|C<4>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(CH3){1|Dy<15>,1|O<3>,2|C<4>}	H(C[6]C[6]2)	119.1260	0.000	1	118.9333	0.933	196	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Er<12>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(CH3){3|C<4>}	H(C[6]C[6]2)	119.0260	0.193	3	118.9333	0.933	196	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Eu<15>,1|C<3>,1|H<1>,1|O<3>}	C[6](C[6]C[6]H)2(CH3){1|O<3>,2|C<4>}	H(C[6]C[6]2)	118.8175	0.228	2	118.9333	0.933	196	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Fe<10>,1|Si<5>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|Fe<10>,3|C<4>}	H(C[6]C[6]2)	118.6190	0.000	1	118.9333	0.933	196	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Gd<12>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(CH3){3|C<4>}	H(C[6]C[6]2)	119.1107	0.070	3	118.9333	0.933	196	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Gd<17>,1|C<4>,1|H<1>,1|O<3>}	C[6](C[6]C[6]H)2(CH3){1|Gd<17>,1|O<3>,2|C<4>}	H(C[6]C[6]2)	118.8865	0.182	2	118.9333	0.933	196	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|La<22>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(CH3){1|La<22>,1|C<5>,2|C<4>}	H(C[6]C[6]2)	118.7260	0.000	1	118.9333	0.933	196	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Li<3>,1|Li<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){3|C<4>}	H(C[6]C[6]2)	119.4375	0.222	4	118.9333	0.933	196	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Lu<12>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(CH3){3|C<4>}	H(C[6]C[6]2)	118.6975	0.220	2	118.9333	0.933	196	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Mo<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){3|C<3>}	H(C[6]C[6]2)	120.8345	8.394	2	118.9333	0.933	196	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Ni<4>,1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|Ni<4>,3|C<4>}	H(C[6]C[6]2)	119.1290	0.000	1	118.9333	0.933	196	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Ni<5>,1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){3|C<4>}	H(C[6]C[6]2)	118.8560	0.130	2	118.9333	0.933	196	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Ni<5>,1|B<4>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|Ni<5>,3|C<4>}	H(C[6]C[6]2)	119.0760	0.000	1	118.9333	0.933	196	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Pd<5>,1|B<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|Pd<5>,3|C<4>}	H(C[6]C[6]2)	118.5820	0.000	1	118.9333	0.933	196	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Pd<5>,1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(CH3){1|Pd<5>,3|C<4>}	H(C[6]C[6]2)	118.8960	0.000	1	118.9333	0.933	196	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Pd<6>,1|B<4>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|Pd<6>,3|C<4>}	H(C[6]C[6]2)	118.1265	0.011	2	118.9333	0.933	196	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Pd<6>,1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(CH3){1|Pd<6>,3|C<4>}	H(C[6]C[6]2)	119.2040	0.000	1	118.9333	0.933	196	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Ru<6>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(CH3){1|Ru<6>,3|C<4>}	H(C[6]C[6]2)	119.4400	0.000	1	118.9333	0.933	196	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Sm<6>,1|C<3>,1|H<1>,1|O<3>}	C[6](C[6]C[6]H)2(CH3){3|C<4>}	H(C[6]C[6]2)	119.1130	0.946	2	118.9333	0.933	196	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Ta<7>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(CH3){3|C<4>}	H(C[6]C[6]2)	118.9865	0.271	2	118.9333	0.933	196	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Th<15>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(CH3){1|C<5>,2|C<4>}	H(C[6]C[6]2)	118.6495	0.063	2	118.9333	0.933	196	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Th<15>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(CH3){3|C<4>}	H(C[6]C[6]2)	118.7383	0.351	6	118.9333	0.933	196	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Ti<12>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,2|C<4>}	H(C[6]C[6]2)	119.7950	1.037	2	118.9333	0.933	196	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Ti<8>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,2|C<4>}	H(C[6]C[6]2)	118.1605	0.830	4	118.9333	0.933	196	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|U<10>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(CH3){3|C<4>}	H(C[6]C[6]2)	118.8136	0.410	7	118.9333	0.933	196	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|U<12>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(CH3){1|P<4>,2|C<4>}	H(C[6]C[6]2)	117.4660	0.000	1	118.9333	0.933	196	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|U<13>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(CH3){3|C<4>}	H(C[6]C[6]2)	119.4100	0.742	2	118.9333	0.933	196	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|U<15>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(CH3){3|C<4>}	H(C[6]C[6]2)	119.0242	0.582	4	118.9333	0.933	196	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|U<17>,1|C<4>,1|H<1>,1|H<2>}	C[6](C[6]C[6]H)2(CH3){1|U<17>,1|N<3>,2|C<4>}	H(C[6]C[6]2)	119.2040	0.000	1	118.9333	0.933	196	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|U<17>,1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(CH3){1|U<17>,1|N<3>,2|C<4>}	H(C[6]C[6]2)	119.4820	0.000	1	118.9333	0.933	196	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Y<12>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(CH3){3|C<4>}	H(C[6]C[6]2)	118.1615	0.224	2	118.9333	0.933	196	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Y<15>,1|C<3>,1|H<1>,1|O<3>}	C[6](C[6]C[6]H)2(CH3){1|O<3>,2|C<4>}	H(C[6]C[6]2)	118.8000	0.000	1	118.9333	0.933	196	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Y<15>,1|C<4>,1|H<1>,1|O<3>}	C[6](C[6]C[6]H)2(CH3){1|Y<15>,1|O<3>,2|C<4>}	H(C[6]C[6]2)	118.8560	0.000	1	118.9333	0.933	196	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Yb<10>,1|C<3>,1|H<1>,1|O<3>}	C[6](C[6]C[6]H)2(CH3){3|C<4>}	H(C[6]C[6]2)	118.5890	0.057	2	118.9333	0.933	196	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Zr<10>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,2|C<4>}	H(C[6]C[6]2)	117.9150	0.000	1	118.9333	0.933	196	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Zr<10>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(CH3){1|Zr<10>,1|C<5>,2|C<4>}	H(C[6]C[6]2)	118.8990	0.000	1	118.9333	0.933	196	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Zr<12>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(CH3){1|S<3>,2|C<4>}	H(C[6]C[6]2)	117.9310	0.198	2	118.9333	0.933	196	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Zr<14>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,2|C<4>}	H(C[6]C[6]2)	118.3840	0.410	2	118.9333	0.933	196	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Zr<14>,1|C<4>,1|H<1>,1|H<2>}	C[6](C[6]C[6]H)2(CH3){1|Zr<14>,1|N<3>,2|C<4>}	H(C[6]C[6]2)	119.3030	0.000	1	118.9333	0.933	196	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Zr<7>,1|C<3>,1|H<1>,1|O<3>}	C[6](C[6]C[6]H)2(CH3){3|C<4>}	H(C[6]C[6]2)	120.4680	0.000	1	118.9333	0.933	196	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){2|Cr<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){3|C<4>}	H(C[6]C[6]2)	119.1050	0.117	4	118.9333	0.933	196	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){2|Cu<2>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){3|C<4>}	H(C[6]C[6]2)	119.3726	0.581	14	118.9333	0.933	196	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){2|Fe<3>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){3|C<4>}	H(C[6]C[6]2)	119.3620	0.076	3	118.9333	0.933	196	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){2|Mn<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){3|C<4>}	H(C[6]C[6]2)	120.4998	0.777	4	118.9333	0.933	196	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){2|Tb<14>,1|C<3>,1|H<1>,1|O<3>}	C[6](C[6]C[6]H)2(CH3){1|C<5>,2|C<3>}	H(C[6]C[6]2)	118.4020	0.064	2	118.9333	0.933	196	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)2(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CHHN){1|C<2>,2|C<4>}	H(C[6]C[6]2)	120.4990	0.844	2	120.4990	0.713	2	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]N[5])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[5])(C[6]C[6]H)(CH3){1|Ru<6>,2|C<3>,3|C<4>}	H(C[6]C[6]2)	118.8740	0.000	1	118.9915	0.028	2	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]N[5])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[5])(C[6]C[6]H)(CH3){1|Ru<6>,2|C<4>,3|C<3>}	H(C[6]C[6]2)	119.1090	0.000	1	118.9915	0.028	2	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(CCCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Fe<9>,1|C<4>,2|C<3>}	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(CCCH){1|Fe<9>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	118.6740	0.000	1	118.6665	0.000	2	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(CCCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Pd<4>,3|C<3>}	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(CCCH){2|C<3>,3|C<4>}	H(C[6]C[6]2)	118.6590	0.000	1	118.6665	0.000	2	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CHHN){2|Cl<1>,1|C<3>}	H(C[6]C[6]2)	119.8530	0.000	1	119.8530	0.000	1	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[5])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]C[6]C)(H){1|H<1>,1|N<2>,1|O<1>,2|C<3>}	C[6](C[6]C[6]H)2(CC3){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.2240	0.000	1	119.9220	0.182	2	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[5])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]C[6]C)(H){1|H<1>,1|O<1>,3|C<3>}	C[6](C[6]C[6]H)2(CC3){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	119.6200	0.000	1	119.9220	0.182	2	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[5])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]C[6]C)(H){1|Er<10>,1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6]H)2(CH3){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	118.5330	0.428	4	118.9008	0.271	14	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[5])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]C[6]C)(H){1|H<1>,1|O<1>,3|C<3>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.6490	0.000	1	118.9008	0.271	14	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[5])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]C[6]C)(H){1|Ta<7>,1|C<3>,1|H<1>,1|N<2>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)2(CH3){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9780	0.000	1	118.9008	0.271	14	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[5])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]C[6]C)(H){1|Yb<10>,1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6]H)2(CH3){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	118.8565	0.315	8	118.9008	0.271	14	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Cu<4>,1|C<4>,1|N<3>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	119.5765	0.179	2	119.5765	0.032	2	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Ag<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CC3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.5842	0.095	4	119.6024	0.308	453	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Co<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CC3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.6450	0.088	3	119.6024	0.308	453	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Cr<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CC3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.3402	0.390	4	119.6024	0.308	453	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Cr<9>,1|Ir<8>,1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(CC3){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.2260	0.000	1	119.6024	0.308	453	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Cu<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CC3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.6456	0.248	16	119.6024	0.308	453	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Cu<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CC3){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.1520	0.110	16	119.6024	0.308	453	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|H<1>,1|N<3>,1|W<6>,2|C<3>}	C[6](C[6]C[6]H)2(CC3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.4970	0.073	4	119.6024	0.308	453	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Ir<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CC3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.0620	0.228	2	119.6024	0.308	453	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Ir<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CC3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.4170	0.402	53	119.6024	0.308	453	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Ir<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CC3){1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.7970	0.784	3	119.6024	0.308	453	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Ir<7>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CC3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.5535	0.689	2	119.6024	0.308	453	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Ir<7>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CC3){1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.6250	0.212	2	119.6024	0.308	453	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Mn<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CC3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.4983	0.295	13	119.6024	0.308	453	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Mo<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CC3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.4682	0.182	6	119.6024	0.308	453	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Mo<8>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CC3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6125	0.957	2	119.6024	0.308	453	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(CC3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.4500	0.000	1	119.6024	0.308	453	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Ni<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CC3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1117	0.710	18	119.6024	0.308	453	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Ni<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CC3){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.1955	0.179	2	119.6024	0.308	453	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Ni<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CC3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0090	0.165	2	119.6024	0.308	453	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Ni<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CC3){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.0470	0.115	2	119.6024	0.308	453	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Ni<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CC3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7930	0.000	1	119.6024	0.308	453	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Os<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CC3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.6303	0.402	6	119.6024	0.308	453	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Pd<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CC3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.5847	0.178	38	119.6024	0.308	453	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Pd<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CC3){1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.9670	0.000	1	119.6024	0.308	453	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Pd<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CC3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.5443	0.380	8	119.6024	0.308	453	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Pt<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CC3){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	119.7428	0.308	6	119.6024	0.308	453	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Pt<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CC3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.5046	0.858	75	119.6024	0.308	453	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Pt<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CC3){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.1109	0.593	27	119.6024	0.308	453	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Pt<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CC3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.3649	0.371	9	119.6024	0.308	453	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Pt<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CC3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.4060	0.509	53	119.6024	0.308	453	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Pt<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CC3){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.5435	0.170	2	119.6024	0.308	453	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Re<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CC3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.4584	0.216	15	119.6024	0.308	453	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Rh<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CC3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.6039	0.226	17	119.6024	0.308	453	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Ru<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CC3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.4269	0.322	24	119.6024	0.308	453	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Ru<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CC3){1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.6810	0.052	2	119.6024	0.308	453	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Zn<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CC3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7150	0.086	2	119.6024	0.308	453	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Zn<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CC3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.6704	0.343	11	119.6024	0.308	453	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Ir<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CCHH){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6420	0.000	1	120.1496	0.103	5	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Pt<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CCHH){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0265	0.190	4	120.1496	0.103	5	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CClHH)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Ir<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CClHH){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2905	0.315	2	120.2905	0.099	2	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CF3)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|H<1>,1|N<3>,1|O<1>,2|C<3>}	C[6](C[6]C[6]H)2(CF3){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.4800	0.000	1	120.4661	0.271	9	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CF3)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Ir<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CF3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3805	0.433	2	120.4661	0.271	9	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CF3)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Ir<8>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CF3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7228	0.279	4	120.4661	0.271	9	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CF3)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Ni<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CF3){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.7700	0.000	1	120.4661	0.271	9	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CF3)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Ru<8>,1|Ru<9>,1|C<3>,1|C<4>,1|H<1>,1|N<4>}	C[6](C[6]C[6]H)2(CF3){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.2930	0.000	1	120.4661	0.271	9	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Ag<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.2680	0.199	4	119.6844	0.216	239	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.5470	0.238	5	119.6844	0.216	239	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Cd<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.3705	0.165	2	119.6844	0.216	239	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Cd<7>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.4710	0.076	2	119.6844	0.216	239	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Co<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8430	0.062	2	119.6844	0.216	239	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Co<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8255	0.439	2	119.6844	0.216	239	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Co<7>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.5260	0.197	2	119.6844	0.216	239	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Cr<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.3790	0.000	1	119.6844	0.216	239	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Cu<3>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9240	0.047	2	119.6844	0.216	239	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Cu<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8881	0.203	7	119.6844	0.216	239	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Cu<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8491	0.200	11	119.6844	0.216	239	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8821	0.208	10	119.6844	0.216	239	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|H<1>,1|N<3>,1|O<1>,2|C<3>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5630	0.000	1	119.6844	0.216	239	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Hg<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8170	0.133	2	119.6844	0.216	239	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Ir<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8131	0.496	19	119.6844	0.216	239	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Ir<6>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3550	0.000	1	119.6844	0.216	239	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Ir<8>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0000	0.396	2	119.6844	0.216	239	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Mn<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9460	0.117	2	119.6844	0.216	239	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Mn<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.4641	0.386	20	119.6844	0.216	239	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Mo<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.1440	0.133	6	119.6844	0.216	239	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Mo<7>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.3690	0.252	5	119.6844	0.216	239	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.1270	0.000	1	119.6844	0.216	239	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Ni<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7280	0.392	7	119.6844	0.216	239	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Ni<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8756	0.448	15	119.6844	0.216	239	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Os<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.6492	0.111	4	119.6844	0.216	239	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Pd<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.5329	0.503	15	119.6844	0.216	239	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Pt<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7629	0.384	15	119.6844	0.216	239	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Pt<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8798	0.218	5	119.6844	0.216	239	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Re<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7820	0.051	2	119.6844	0.216	239	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Re<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.6563	0.376	27	119.6844	0.216	239	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Rh<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.6970	0.083	2	119.6844	0.216	239	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Rh<8>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7230	0.000	1	119.6844	0.216	239	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Ru<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.5948	0.821	26	119.6844	0.216	239	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Ru<8>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8100	0.187	2	119.6844	0.216	239	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Ru<8>,1|Ru<9>,1|H<1>,1|N<4>,2|C<3>}	C[6](C[6]C[6]H)2(CH3){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.1810	0.000	1	119.6844	0.216	239	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Ru<9>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.5280	0.161	2	119.6844	0.216	239	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Sn<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.6900	0.165	2	119.6844	0.216	239	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Zn<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0480	0.000	1	119.6844	0.216	239	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Zn<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7900	0.000	1	119.6844	0.216	239	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Zn<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7340	0.024	2	119.6844	0.216	239	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Mn<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CHHN){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1405	0.078	2	120.2412	0.066	4	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Re<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CHHN){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3420	0.389	2	120.2412	0.066	4	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Ir<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CHHO){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9915	0.009	2	120.0265	0.057	15	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Ir<8>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CHHO){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0745	0.265	2	120.0265	0.057	15	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Pd<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CHHO){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9272	0.203	6	120.0265	0.057	15	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Pt<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CHHO){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3545	0.029	2	120.0265	0.057	15	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Re<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CHHO){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.6030	0.000	1	120.0265	0.057	15	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Zn<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CHHO){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1955	0.028	2	120.0265	0.057	15	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Mn<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CHHP){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0475	0.037	2	120.0125	0.002	4	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Re<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CHHP){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9775	0.021	2	120.0125	0.002	4	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CHOO)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Ru<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CHOO){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9760	0.000	1	119.9760	0.000	1	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CN[5]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Zn<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CN[5]HH){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.5466	1.201	7	120.5466	1.443	7	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CN[5a]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Re<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CN[5a]HH){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3450	0.000	1	120.3450	0.000	1	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]P[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]P[6])(C[6]C[6]C)(H){1|C<4>,1|P<2>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(CH3){1|C<3>,1|H<1>,1|P<2>}	H(C[6]C[6]2)	115.8755	0.098	2	116.5972	0.309	13	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]P[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]P[6])(C[6]C[6]C)(H){1|C<4>,1|P<3>,1|W<6>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(CH3){1|C<3>,1|H<1>,1|P<3>}	H(C[6]C[6]2)	116.9150	0.081	3	116.5972	0.309	13	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]P[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]P[6])(C[6]C[6]C)(H){1|Mn<5>,1|C<4>,1|P<3>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(CH3){1|C<3>,1|H<1>,1|P<3>}	H(C[6]C[6]2)	117.1875	0.087	2	116.5972	0.309	13	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]P[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]P[6])(C[6]C[6]C)(H){1|Sm<12>,1|C<4>,1|P<3>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(CH3){1|C<3>,1|H<1>,1|P<3>}	H(C[6]C[6]2)	115.7880	0.000	1	116.5972	0.309	13	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]P[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]P[6])(C[6]C[6]C)(H){1|Sm<12>,1|P<3>,3|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(CH3){1|C<3>,1|H<1>,1|P<3>}	H(C[6]C[6]2)	116.0050	0.000	1	116.5972	0.309	13	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]P[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]P[6])(C[6]C[6]C)(H){1|Tm<12>,1|C<4>,1|P<3>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(CH3){1|C<3>,1|H<1>,1|P<3>}	H(C[6]C[6]2)	116.5520	0.233	2	116.5972	0.309	13	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]P[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]P[6])(C[6]C[6]C)(H){1|Yb<12>,1|C<4>,1|P<3>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(CH3){1|C<3>,1|H<1>,1|P<3>}	H(C[6]C[6]2)	116.9980	0.496	2	116.5972	0.309	13	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]Sn)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]Sn)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CC3){1|Sn<4>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	119.3140	0.127	4	119.0434	0.064	15	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]Sn)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]Sn)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CC3){1|Sn<5>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	118.9450	0.212	11	119.0434	0.064	15	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]C)(H){1|H<1>,1|O<1>,3|C<3>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CC3){1|C<4>,2|C<3>}	H(C[6]C[6]2)	118.7015	0.050	2	118.7015	0.003	2	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]C)(H){1|Co<5>,1|C<4>,1|H<1>,1|O<2>,2|C<3>}	C[6](C[6]C[6]H)2(CC3){1|Co<5>,1|C<4>,2|C<3>}	H(C[6]C[6]2)	118.9790	0.000	1	118.7362	0.041	5	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]C)(H){1|Ir<5>,1|H<1>,1|O<2>,3|C<3>}	C[6](C[6]C[6]H)2(CC3){1|C<4>,2|C<3>}	H(C[6]C[6]2)	118.7005	0.187	2	118.7362	0.041	5	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]C)(H){1|Pt<5>,1|H<1>,1|O<2>,3|C<3>}	C[6](C[6]C[6]H)2(CC3){1|C<4>,2|C<3>}	H(C[6]C[6]2)	118.6505	0.228	2	118.7362	0.041	5	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CF3)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]C)(H){1|H<1>,1|O<1>,3|C<3>}	C[6](C[6]C[6]H)2(CF3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	118.7280	0.000	1	118.7280	0.000	1	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H){1|C<4>,1|H<1>,1|N<2>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8750	0.000	1	119.8750	0.000	1	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H){1|Au<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(CC3){1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.0230	0.399	2	119.7027	0.753	44	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H){1|Ir<6>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(CC3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.2952	0.284	4	119.7027	0.753	44	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H){1|Ir<6>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(CC3){1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.7226	0.913	13	119.7027	0.753	44	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H){1|Ir<7>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(CC3){1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.1105	0.039	2	119.7027	0.753	44	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H){1|Ir<8>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(CC3){1|N<3>,2|C<3>}	H(C[6]C[6]2)	121.2632	1.564	4	119.7027	0.753	44	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H){1|N<2>,2|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(CC3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.1280	0.255	6	119.7027	0.753	44	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H){1|Pd<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(CC3){1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.7580	0.280	2	119.7027	0.753	44	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H){1|Pd<6>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(CC3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.1920	0.000	1	119.7027	0.753	44	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H){1|Pt<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(CC3){1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.7253	0.249	8	119.7027	0.753	44	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H){1|Ru<6>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(CC3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.3725	0.110	2	119.7027	0.753	44	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CF3)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H){1|H<1>,4|C<3>}	C[6](C[6]C[6]H)2(CF3){1|Ir<6>,1|C<3>,1|N<3>}	H(C[6]C[6]2)	120.1040	0.000	1	120.1417	0.109	11	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CF3)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H){1|Ir<6>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(CF3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1455	0.348	10	120.1417	0.109	11	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H){1|C<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.1128	0.264	5	119.3593	0.274	54	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H){1|Ir<6>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.3491	0.409	31	119.3593	0.274	54	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H){1|N<2>,2|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	119.3695	0.530	2	119.3593	0.274	54	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H){1|N<2>,2|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7076	0.227	5	119.3593	0.274	54	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H){1|Pd<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	118.6870	0.379	2	119.3593	0.274	54	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H){1|Pt<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.0158	0.546	5	119.3593	0.274	54	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H){1|Pt<6>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.1590	0.000	1	119.3593	0.274	54	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H){1|Ru<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.4810	0.000	1	119.3593	0.274	54	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H){1|Ru<6>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8220	0.161	2	119.3593	0.274	54	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H){1|N<2>,2|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(CHHN){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3420	0.000	1	120.3420	0.000	1	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H){1|Ir<6>,4|C<3>}	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(CH3){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	120.0000	0.000	1	120.0000	0.000	1	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6a]O[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(CF3)	H(C[6]C[6]2)	C[6](C[6]C[6a]O[6])(C[6]C[6]C)(H){1|C<4>,3|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(CF3){1|C<3>,1|C<4>,2|O<2>}	H(C[6]C[6]2)	133.1980	0.000	1	133.1980	0.000	1	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6x3]C[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CC[6a]HH)	H(C[6]C[6]2)	C[6](C[6]C[6x3]C[6])(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|O<1>,2|C<7>,4|C<6>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CC[6a]HH){1|C<3>,1|C<4>,1|C<7>}	H(C[6]C[6]2)	118.8215	0.036	2	118.8215	0.001	2	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]C)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]C)(H){1|Ga<5>,1|C<3>,1|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(CC3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9010	0.105	2	119.7943	0.073	6	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]C)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]C)(H){1|In<6>,1|C<3>,1|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(CC3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7410	0.326	4	119.7943	0.073	6	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]C)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|S<2>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(CH3){1|H<1>,2|N<3>}	H(C[6]C[6]2)	119.4040	0.000	1	119.9810	0.148	4	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]C)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]C)(H){1|In<6>,1|C<3>,1|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1733	0.022	3	119.9810	0.148	4	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]C)(H){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CH3){3|N<3>}	H(C[6]C[6]2)	121.1287	0.070	6	120.8234	0.127	11	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]C)(H){1|Ir<6>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(CH3){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.4353	0.072	3	120.8234	0.127	11	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]C)(H){1|Pd<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(CH3){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.4550	0.000	1	120.8234	0.127	11	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]C)(H){1|Ru<6>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(CH3){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.5240	0.000	1	120.8234	0.127	11	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CHHO)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]C)(H){1|Fe<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(CHHO){3|N<3>}	H(C[6]C[6]2)	121.4290	0.301	11	121.4290	0.090	11	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[5a,6]C)(C[6]C[6]C)(H)	C[6](C[6]C[5a,6]C)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[5a,6]C)(C[6]C[6]C)(H){1|C<2>,2|C<3>}	C[6](C[6]C[5a,6]C)(C[6]C[6]H)(CH3){1|C<4>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	118.5090	0.000	1	118.5090	0.000	1	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[5a,6]H)(C[6]C[6]C)(H)	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[5a,6]H)(C[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.1065	0.151	2	119.1065	0.023	2	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[5a,6]S)(C[6]C[6]C)(H)	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]N[5a,6]S)(C[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(CC3){1|C<3>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	118.1320	0.314	2	118.5613	0.602	3	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[5a,6]S)(C[6]C[6]C)(H)	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]N[5a,6]S)(C[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[5a,6]H)(C[6]C[6]H)(CC3){1|C<3>,1|N<3>,1|S<3>}	H(C[6]C[6]2)	119.4200	0.000	1	118.5613	0.602	3	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]C[6]C)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1740	0.000	1	120.1021	0.063	9	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]C[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1343	0.260	7	120.1021	0.063	9	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|S<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(CH3){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	119.8050	0.000	1	120.1021	0.063	9	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6,6a]H)(C[6]C[6]C)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6,6a]H)(C[6]C[6]C)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4135	0.009	2	120.4135	0.000	2	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]Br)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]Br)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(CH3){1|Br<1>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4690	0.677	3	120.4690	0.458	3	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]Ir)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CF3)	H(C[6]C[6]2)	C[6](C[6]N[6]Ir)(C[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(CF3){1|Ir<6>,1|C<3>,1|N<3>}	H(C[6]C[6]2)	118.9480	0.000	1	118.9480	0.000	1	119.5664	1.190	5448	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(NH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(NH3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	116.9870	0.000	1	116.9870	0.000	1	120.1026	2.437	14	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]C[6]S)(NH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|S<4>,2|C<3>}	C[6](C[6]C[6]H)(C[6]C[6]S)(NH3){1|C<3>,2|H<1>}	H(C[6]C[6]2)	122.4100	0.000	1	122.4100	0.000	1	120.1026	2.437	14	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NH3){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8685	1.538	4	119.8685	2.364	4	120.1026	2.437	14	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(NH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(NH3){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7722	0.654	4	119.7722	0.428	4	120.1026	2.437	14	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(NH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NH3){1|C<2>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	121.4630	0.000	1	120.3467	0.997	3	120.1026	2.437	14	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(NH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(NH3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.0380	0.000	1	120.3467	0.997	3	120.1026	2.437	14	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(NH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(NH3){1|C<3>,3|H<1>}	H(C[6]C[6]2)	119.5390	0.000	1	120.3467	0.997	3	120.1026	2.437	14	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:N-4:	C[6]-3:	C[6](C[6]C[6]N)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(NH3)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]C[6]O)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NH3){1|C<2>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	122.4370	0.000	1	122.4370	0.000	1	120.1026	2.437	14	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:P-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]P)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(PTiCC)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]P)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(PTiCC){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.6540	0.000	1	119.6540	0.000	1	119.6371	2.596	54	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:P-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]P)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(PC[6a]3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]P)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(PC[6a]3){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.5570	0.000	1	119.5570	0.000	1	119.6371	2.596	54	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:P-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]P)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(PO3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]P)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(PO3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.6330	0.000	1	119.6330	0.000	1	119.6371	2.596	54	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:P-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(PC3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(PC3){1|C<3>,2|H<1>}	H(C[6]C[6]2)	115.5110	0.000	1	115.5110	0.000	1	119.6371	2.596	54	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:P-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](C[6]C[6]H)(C[6]C[6]S)(PC[6a]3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<3>,1|H<1>,1|S<4>}	C[6](C[6]C[6]H)(C[6]C[6]S)(PC[6a]3){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	119.6860	0.000	1	119.6860	0.000	1	119.6371	2.596	54	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:P-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(PO3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(PO3){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.4850	0.000	1	119.4850	0.000	1	119.6371	2.596	54	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:P-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(PO3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(PO3){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.5680	0.000	1	119.8470	0.156	2	119.6371	2.596	54	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:P-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(PO3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(PO3){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1260	0.000	1	119.8470	0.156	2	119.6371	2.596	54	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:P-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](C[6]C[6]H)2(PC[6]2Mo)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|Cl<1>,1|C<2>,1|H<1>}	C[6](C[6]C[6]H)2(PC[6]2Mo){1|C<3>,1|H<1>}	H(C[6]C[6]2)	115.8820	0.000	1	115.8820	0.000	1	119.6371	2.596	54	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:P-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](C[6]C[6]H)2(PC[6]FeC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<2>,2|H<1>}	C[6](C[6]C[6]H)2(PC[6]FeC){1|C<3>,1|H<1>}	H(C[6]C[6]2)	118.8385	2.279	2	118.8385	5.194	2	119.6371	2.596	54	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:P-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](C[6]C[6]H)2(PC[6]MoC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<2>,2|H<1>}	C[6](C[6]C[6]H)2(PC[6]MoC){1|C<3>,1|H<1>}	H(C[6]C[6]2)	118.1910	3.937	2	118.1910	15.501	2	119.6371	2.596	54	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:P-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](C[6]C[6]H)2(PC[6]PdO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<2>,2|H<1>}	C[6](C[6]C[6]H)2(PC[6]PdO){1|C<3>,1|H<1>}	H(C[6]C[6]2)	118.3170	0.000	1	118.3170	0.000	1	119.6371	2.596	54	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:P-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](C[6]C[6]H)2(PC[6]ReO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<2>,2|H<1>}	C[6](C[6]C[6]H)2(PC[6]ReO){1|C<3>,1|H<1>}	H(C[6]C[6]2)	124.1210	0.000	1	124.1210	0.000	1	119.6371	2.596	54	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:P-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](C[6]C[6]H)2(PC[6a]2N)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<2>,2|H<1>}	C[6](C[6]C[6]H)2(PC[6a]2N){1|C<3>,1|H<1>}	H(C[6]C[6]2)	118.4080	0.000	2	118.4080	0.000	2	119.6371	2.596	54	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:P-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](C[6]C[6]H)2(PC[6a]3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<2>,2|H<1>}	C[6](C[6]C[6]H)2(PC[6a]3){1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0860	0.000	1	120.0860	0.000	1	119.6371	2.596	54	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:P-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](C[6]C[6]H)2(PC[6a]CO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<2>,2|H<1>}	C[6](C[6]C[6]H)2(PC[6a]CO){1|C<3>,1|H<1>}	H(C[6]C[6]2)	117.7920	0.000	1	117.7920	0.000	1	119.6371	2.596	54	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:P-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](C[6]C[6]H)2(PC[6a]NN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<2>,2|H<1>}	C[6](C[6]C[6]H)2(PC[6a]NN){1|C<3>,1|H<1>}	H(C[6]C[6]2)	118.1660	0.000	1	118.1660	0.000	1	119.6371	2.596	54	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:P-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](C[6]C[6]H)2(PC[6a]NO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(PC[6a]NO){1|C<2>,2|H<1>}	H(C[6]C[6]2)	120.8280	3.109	4	120.8280	9.667	4	119.6371	2.596	54	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:P-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](C[6]C[6]H)2(PFeCC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<2>,2|H<1>}	C[6](C[6]C[6]H)2(PFeCC){1|C<3>,1|H<1>}	H(C[6]C[6]2)	118.6650	0.000	1	118.6650	0.000	1	119.6371	2.596	54	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:P-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](C[6]C[6]H)2(PMo2H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<2>,2|H<1>}	C[6](C[6]C[6]H)2(PMo2H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	118.2990	0.000	1	118.2990	0.000	1	119.6371	2.596	54	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:P-4:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]P)(H)	C[6](C[6]C[6]H)2(PO3)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]P)(H){1|Pt<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(PO3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2020	0.044	5	120.2444	0.075	9	119.6371	2.596	54	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:P-4:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]P)(H)	C[6](C[6]C[6]H)2(PO3)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]P)(H){1|Ru<6>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(PO3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2975	0.438	4	120.2444	0.075	9	119.6371	2.596	54	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:P-4:	C[6]-3:	C[6](C[6]C[6]P)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(PC[6a]3)	H(C[6]C[6]2)	C[6](C[6]C[6]P)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(PC[6a]3){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.5610	0.109	2	120.5610	0.012	2	119.6371	2.596	54	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:P-4:	C[6]-3:	C[6](C[6]C[6]P)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(PO3)	H(C[6]C[6]2)	C[6](C[6]C[6]P)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(PO3){1|H<1>,1|N<3>,1|P<4>}	H(C[6]C[6]2)	120.2760	0.000	1	120.1732	0.074	12	119.6371	2.596	54	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:P-4:	C[6]-3:	C[6](C[6]C[6]P)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(PO3)	H(C[6]C[6]2)	C[6](C[6]C[6]P)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(PO3){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.1535	0.108	2	120.1732	0.074	12	119.6371	2.596	54	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:P-4:	C[6]-3:	C[6](C[6]C[6]P)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(PO3)	H(C[6]C[6]2)	C[6](C[6]C[6]P)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(PO3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0820	0.306	5	120.1732	0.074	12	119.6371	2.596	54	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:P-4:	C[6]-3:	C[6](C[6]C[6]P)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(PO3)	H(C[6]C[6]2)	C[6](C[6]C[6]P)(C[6]N[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(PO3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2715	0.333	4	120.1732	0.074	12	119.6371	2.596	54	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:P-4:	C[6]-3:	C[6](C[6]C[6]P)(C[6]N[6]P)(H)	C[6](C[6]C[6]H)2(PO3)	H(C[6]C[6]2)	C[6](C[6]C[6]P)(C[6]N[6]P)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(PO3){1|H<1>,1|N<3>,1|P<4>}	H(C[6]C[6]2)	119.8800	0.000	1	119.8800	0.000	1	119.6371	2.596	54	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:P-4:	C[6]-3:	C[6](C[6]C[6]P)2(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(PO3)	H(C[6]C[6]2)	C[6](C[6]C[6]P)2(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(PO3){1|C<3>,1|H<1>,1|P<4>}	H(C[6]C[6]2)	119.5675	0.016	2	119.5675	0.000	2	119.6371	2.596	54	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:P-4:	C[6]-3:	C[6](C[6]C[6]P)2(H)	C[6](C[6]C[6]H)(C[6]O[6]O)(PC[6a]3)	H(C[6]C[6]2)	C[6](C[6]C[6]P)2(H){1|O<2>,2|O<1>}	C[6](C[6]C[6]H)(C[6]O[6]O)(PC[6a]3){1|C<3>,1|P<4>}	H(C[6]C[6]2)	118.6275	0.018	2	118.6275	0.000	2	119.6371	2.596	54	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-4:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]S)(H)	C[6](C[6]C[6]H)2(SC[6]OO)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]S)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(SC[6]OO){2|Br<1>,1|C<3>}	H(C[6]C[6]2)	120.4370	0.415	8	120.4370	0.172	8	120.2204	4.390	74	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]S)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(SO3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]S)(H){1|C<3>,1|H<1>,1|N<4>}	C[6](C[6]C[6]H)(C[6]C[6]N)(SO3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	117.4060	0.000	1	117.4060	0.000	1	120.2204	4.390	74	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]S)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(SC[6a]OO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]S)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(SC[6a]OO){1|C<3>,1|C<4>,1|S<4>}	H(C[6]C[6]2)	118.8530	0.051	2	118.8530	0.003	2	120.2204	4.390	74	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]S)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(SNOO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]S)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(SNOO){1|C<3>,1|C<4>,1|S<4>}	H(C[6]C[6]2)	118.7600	0.191	2	118.7600	0.036	2	120.2204	4.390	74	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-4:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]S)(H)	C[6](C[6]C[6]H)2(SC[6]OO)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]S)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(SC[6]OO){2|Cl<1>,1|C<3>}	H(C[6]C[6]2)	120.4945	0.348	8	120.4945	0.121	8	120.2204	4.390	74	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]S)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(SO3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]S)(H){1|H<1>,1|N<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(SO3){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1400	0.000	2	120.5603	1.082	10	120.2204	4.390	74	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]S)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(SO3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]S)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(SO3){1|C<3>,2|H<1>}	H(C[6]C[6]2)	121.4240	0.000	1	120.5603	1.082	10	120.2204	4.390	74	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]S)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(SO3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]S)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(SO3){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9847	1.737	3	120.5603	1.082	10	120.2204	4.390	74	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]S)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(SO3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]S)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(SO3){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.9862	0.543	4	120.5603	1.082	10	120.2204	4.390	74	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]S)(H)	C[6](C[6]C[6]H)2(SCOO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]S)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(SCOO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	118.4280	4.360	2	118.4280	19.010	2	120.2204	4.390	74	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]S)(H)	C[6](C[6]C[6]H)2(SC[5]OO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]S)(H){1|C<2>,2|H<1>}	C[6](C[6]C[6]H)2(SC[5]OO){1|C<3>,1|H<1>}	H(C[6]C[6]2)	118.6690	0.000	1	119.8533	1.053	3	120.2204	4.390	74	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]S)(H)	C[6](C[6]C[6]H)2(SC[5]OO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]S)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(SC[5]OO){1|C<2>,2|H<1>}	H(C[6]C[6]2)	120.4455	0.040	2	119.8533	1.053	3	120.2204	4.390	74	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]S)(H)	C[6](C[6]C[6]H)2(SC[6a]OO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]S)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(SC[6a]OO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9564	0.176	20	120.5925	4.451	22	120.2204	4.390	74	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]S)(H)	C[6](C[6]C[6]H)2(SC[6a]OO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]S)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(SC[6a]OO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	126.9530	1.971	2	120.5925	4.451	22	120.2204	4.390	74	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]S)(H)	C[6](C[6]C[6]H)2(SMn3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]S)(H){1|C<2>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(SMn3){1|C<3>,1|H<1>}	H(C[6]C[6]2)	118.2910	0.000	1	118.2910	0.000	1	120.2204	4.390	74	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]S)(H)	C[6](C[6]C[6]H)2(SNOO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]S)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(SNOO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	118.7703	4.745	4	118.7703	22.518	4	120.2204	4.390	74	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]S)(H)	C[6](C[6]C[6]H)2(SN[5]OO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]S)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(SN[5]OO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	121.0138	5.259	4	121.0138	27.654	4	120.2204	4.390	74	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]S)(H)	C[6](C[6]C[6]H)2(SN[6]OO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]S)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(SN[6]OO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5610	0.092	2	120.5610	0.008	2	120.2204	4.390	74	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]S)(H)	C[6](C[6]C[6]H)2(SO3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]S)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(SO3){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.7505	0.108	2	120.7505	0.012	2	120.2204	4.390	74	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-4:	C[6]-3:	C[6](C[6]C[6]N)(C[6]C[6]S)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(SO3)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]C[6]S)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(SO3){1|C<3>,2|N<3>}	H(C[6]C[6]2)	120.3850	0.000	1	120.3850	0.000	1	120.2204	4.390	74	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-4:	C[6]-3:	C[6](C[6]C[6]S)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(SO3)	H(C[6]C[6]2)	C[6](C[6]C[6]S)(C[6]N[6]H)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(SO3){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.3665	0.213	2	120.3665	0.045	2	120.2204	4.390	74	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Si-4:	C[6]-3:	C[6](C[6]C[6]Si)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(SiC3)	H(C[6]C[6]2)	C[6](C[6]C[6]Si)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(SiC3){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.3220	0.000	1	119.4960	0.023	3	119.4211	0.670	22	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Si-4:	C[6]-3:	C[6](C[6]C[6]Si)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(SiC3)	H(C[6]C[6]2)	C[6](C[6]C[6]Si)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(SiC3){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.5830	0.021	2	119.4960	0.023	3	119.4211	0.670	22	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Si-4:	C[6]-3:	C[6](C[6]C[6]Si)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(SiC[6]2C)	H(C[6]C[6]2)	C[6](C[6]C[6]Si)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(SiC[6]2C){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8694	0.172	8	119.8694	0.029	8	119.4211	0.670	22	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Si-4:	C[6]-3:	C[6](C[6]C[6]Si)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(SiSiCC)	H(C[6]C[6]2)	C[6](C[6]C[6]Si)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(SiSiCC){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.2800	0.000	1	119.2800	0.000	1	119.4211	0.670	22	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Si-4:	C[6]-3:	C[6](C[6]C[6]Si)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(SiC[6a]3)	H(C[6]C[6]2)	C[6](C[6]C[6]Si)(C[6]C[6]H)(H){1|C<2>,2|H<1>}	C[6](C[6]C[6]H)2(SiC[6a]3){1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7365	1.839	2	120.7365	3.383	2	119.4211	0.670	22	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:Si-4:	C[6]-3:	C[6](C[6]C[6]Si)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(SiC[6]CC)	H(C[6]C[6]2)	C[6](C[6]C[6]Si)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(SiC[6]CC){1|Si<4>,1|C<3>,1|O<1>}	H(C[6]C[6]2)	118.6335	0.227	8	118.6335	0.052	8	119.4211	0.670	22	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:B-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]B)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(BC[6a]3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]B)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(BC[6a]3){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.3468	0.102	5	119.3468	0.010	5	119.3468	0.010	5	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]B[5]C[6])(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]B[5]C[6])(C[6]N[6]C)(H){1|C<3>,2|H<1>,2|O<2>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3){1|B<3>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	119.6425	0.016	2	119.6425	0.000	2	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]N[6]C)(H){1|C<3>,1|C<4>,1|H<1>,2|N<3>}	C[6](C[6]C[6]H)(N[6]C[6]C)(CH3){1|C<4>,2|C<3>}	H(C[6]C[6]2)	118.3343	0.142	3	118.6981	0.104	9	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]N[6]C)(H){1|C<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)(N[6]C[6]C)(CH3){1|C<4>,2|C<3>}	H(C[6]C[6]2)	118.8800	0.199	6	118.6981	0.104	9	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]C)(H){1|C<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)(N[6]C[6]C)(CH3){1|C<4>,2|C<3>}	H(C[6]C[6]2)	118.1997	0.163	10	118.1997	0.026	10	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]B)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]B)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.0180	0.000	1	119.0180	0.000	1	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|C<2>,1|C<3>,1|C<4>}	C[6](C[6]C[6]H)(N[6]C[6]C)(CH3){1|N<3>,2|C<3>}	H(C[6]C[6]2)	118.5430	0.000	1	118.8725	0.048	25	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]C)(CH3){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	118.7440	0.082	2	118.8725	0.048	25	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]C)(CH3){1|C<3>,2|C<4>}	H(C[6]C[6]2)	118.9339	0.173	7	118.8725	0.048	25	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]C)(CH3){1|C<4>,2|C<3>}	H(C[6]C[6]2)	118.8859	0.247	14	118.8725	0.048	25	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]C)(CH3){3|C<3>}	H(C[6]C[6]2)	118.8410	0.000	1	118.8725	0.048	25	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CC3){1|C<3>,2|C<4>}	H(C[6]C[6]2)	119.1857	0.334	6	119.1644	0.081	8	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CC3){1|C<4>,2|C<3>}	H(C[6]C[6]2)	119.1005	0.016	2	119.1644	0.081	8	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CCCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CCCH){1|C<3>,2|C<4>}	H(C[6]C[6]2)	119.8475	0.047	2	119.8475	0.002	2	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.4261	0.766	15	119.4886	0.341	43	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	119.7805	0.186	2	119.4886	0.341	43	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3){1|C<3>,2|C<4>}	H(C[6]C[6]2)	119.4893	0.501	24	119.4886	0.341	43	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3){1|C<4>,2|C<3>}	H(C[6]C[6]2)	119.6570	0.085	2	119.4886	0.341	43	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CHHO){1|C<3>,2|C<4>}	H(C[6]C[6]2)	119.8152	0.388	4	119.8152	0.151	4	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]N)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(N[6]C[6]N)(CH3){1|C<3>,2|C<4>}	H(C[6]C[6]2)	119.1875	0.621	4	119.1875	0.385	4	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(N[6]C[6]O)(CH3){1|C<4>,2|C<3>}	H(C[6]C[6]2)	119.5140	0.000	1	119.5140	0.000	1	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(N[6]C[6]O)(CHHN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.4670	0.000	1	119.4670	0.000	1	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]S)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|S<4>,2|C<4>}	C[6](C[6]C[6]H)(N[6]C[6]S)(CH3){1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.0520	0.000	1	119.0520	0.000	1	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]Y)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|Y<16>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]Y)(CH3){1|C<3>,1|C<4>,1|C<5>}	H(C[6]C[6]2)	119.7870	0.092	2	119.7870	0.008	2	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]B)(CBHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]B)(CBHH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.1560	0.040	3	119.1560	0.002	3	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]B)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]B)(CCHH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.3340	0.000	1	119.3340	0.000	1	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]B)(CC[6]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]B)(CC[6]HH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.3365	0.192	2	119.3365	0.037	2	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]B)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|B<3>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]B)(CH3){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.9715	0.392	2	119.5890	0.068	11	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]B)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]B)(CH3){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.5205	0.154	6	119.5890	0.068	11	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]B)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|B<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]B)(CH3){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.4710	0.144	3	119.5890	0.068	11	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(CCCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]C)(CCCH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.2590	0.000	1	119.2590	0.000	1	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]C)(CCHH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.4232	0.160	4	119.4232	0.026	4	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(CGeHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]C)(CGeHH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.1780	0.000	1	119.1780	0.000	1	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]C)(CH3){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.6749	0.194	24	119.6529	0.160	44	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]C)(CH3){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7295	0.645	13	119.6529	0.160	44	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]C)(CH3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.7455	0.053	2	119.6529	0.160	44	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|C<4>}	C[6](C[6]C[6]H)(N[6]C[6]C)(CH3){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.3630	0.163	2	119.6529	0.160	44	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6]H)(N[6]C[6]C)(CH3){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.3520	0.000	1	119.6529	0.160	44	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(N[6]C[6]C)(CH3){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.2380	0.547	2	119.6529	0.160	44	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(CPtCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]C)(CPtCH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.0890	0.000	1	119.0890	0.000	1	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(CRuCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]C)(CRuCH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1130	0.000	1	120.1130	0.000	1	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(CSeHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]C)(CSeHH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.5870	0.096	2	119.5870	0.009	2	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(CSiHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]C)(CSiHH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.2320	0.000	1	119.2320	0.000	1	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]D)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|D<1>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]D)(CH3){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0210	0.000	1	120.0210	0.000	1	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CBHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CBHH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.8200	0.000	1	119.8200	0.000	1	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CBrCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CBrCH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1110	0.000	1	120.1110	0.000	1	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CBrHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CBrHH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.3050	0.008	2	120.3050	0.000	2	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CC3){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.2580	0.154	2	120.0573	0.133	3	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CC3){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.6560	0.000	1	120.0573	0.133	3	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CCHH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.0927	0.145	4	119.9724	0.312	21	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CCHH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8569	0.605	15	119.9724	0.312	21	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CCHH){1|Os<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6040	0.000	1	119.9724	0.312	21	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CCHH){1|Os<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5930	0.000	1	119.9724	0.312	21	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CCOO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CCOO){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.1265	0.223	2	120.1265	0.050	2	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CC[6]OO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CC[6]OO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1190	0.000	1	120.1190	0.000	1	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CC[6a]CO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CC[6a]CO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1340	0.365	2	120.1340	0.133	2	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CC[6a]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CC[6a]HH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.1355	0.098	4	120.0938	0.012	6	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CC[6a]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CC[6a]HH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0105	0.094	2	120.0938	0.012	6	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CC[6a]HO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CC[6a]HO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6240	0.000	1	120.6240	0.000	1	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CClHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CClHH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.3090	0.078	2	120.3033	0.003	3	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CClHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CClHH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2920	0.000	1	120.3033	0.003	3	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CCuCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CCuCH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9080	0.000	1	119.9080	0.000	1	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CF3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CF3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.0307	0.048	3	121.0307	0.002	3	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.1045	0.091	2	119.8480	1.790	172	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8531	2.015	7	119.8480	1.790	172	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	118.2596	2.826	9	119.8480	1.790	172	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.7075	1.170	57	119.8480	1.790	172	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.4310	0.343	3	119.8480	1.790	172	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3691	0.550	49	119.8480	1.790	172	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.3730	0.091	2	119.8480	1.790	172	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3){1|C<3>,1|H<1>,1|P<4>}	H(C[6]C[6]2)	119.9040	0.000	1	119.8480	1.790	172	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3){1|C<3>,1|H<1>,1|S<1>}	H(C[6]C[6]2)	120.3135	0.103	2	119.8480	1.790	172	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.3281	1.728	26	119.8480	1.790	172	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.1201	0.461	8	119.8480	1.790	172	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3){1|Ir<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7190	0.000	1	119.8480	1.790	172	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3){1|Os<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5800	0.000	1	119.8480	1.790	172	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3){1|Os<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.1900	0.000	1	119.8480	1.790	172	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<4>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3){1|Ce<12>,1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.1890	0.000	1	119.8480	1.790	172	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<4>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3){1|Ce<13>,1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.1900	0.000	1	119.8480	1.790	172	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0010	0.000	1	119.8480	1.790	172	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CHHN){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.1832	0.159	6	120.0817	0.113	84	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CHHN){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3250	0.000	1	120.0817	0.113	84	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CHHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0708	0.349	76	120.0817	0.113	84	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CHHN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.0530	0.000	1	120.0817	0.113	84	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CHHO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1985	0.071	2	120.1985	0.005	2	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CHHP){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2205	0.122	2	120.2205	0.015	2	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CHHS)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CHHS){1|C<3>,2|H<1>}	H(C[6]C[6]2)	118.5310	2.734	3	119.4815	2.764	8	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CHHS)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CHHS){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.9790	0.000	1	119.4815	2.764	8	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CHHS)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CHHS){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0700	0.139	4	119.4815	2.764	8	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CHOO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CHOO){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.5782	0.131	4	120.4676	0.074	5	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CHOO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CHOO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0250	0.000	1	120.4676	0.074	5	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CN[5]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CN[5]HH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8350	0.388	3	119.8350	0.150	3	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CN[5a]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CN[5a]HH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9550	0.000	1	119.9550	0.000	1	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CSeHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CSeHH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8750	0.041	2	119.8750	0.002	2	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]N)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(N[6]C[6]N)(CH3){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.5020	0.000	1	119.5020	0.000	1	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(CCCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(N[6]C[6]O)(CCCH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.3610	0.000	1	119.3610	0.000	1	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(N[6]C[6]O)(CCHH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	116.6445	1.399	2	116.7363	4.946	6	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(N[6]C[6]O)(CCHH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	116.7823	2.754	4	116.7363	4.946	6	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(CCHO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(N[6]C[6]O)(CCHO){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.0675	0.028	2	120.0675	0.001	2	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(CCHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(N[6]C[6]O)(CCHP){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.7075	0.052	2	119.7075	0.003	2	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(CC[6]3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(N[6]C[6]O)(CC[6]3){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.2270	0.000	1	119.2270	0.000	1	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(CC[6a]CC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(N[6]C[6]O)(CC[6a]CC){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.2740	0.000	1	119.2740	0.000	1	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(CC[6a]CN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(N[6]C[6]O)(CC[6a]CN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.6630	0.000	1	119.6630	0.000	1	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(CC[6a]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(N[6]C[6]O)(CC[6a]HH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	118.9260	0.000	1	118.9260	0.000	1	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Br<1>,1|C<3>,1|O<1>}	C[6](C[6]C[6]H)(N[6]C[6]O)(CH3){1|C<3>,2|H<1>}	H(C[6]C[6]2)	117.4680	0.000	1	118.8856	1.732	21	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(N[6]C[6]O)(CH3){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	118.5512	1.895	6	118.8856	1.732	21	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(N[6]C[6]O)(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	115.8250	0.000	1	118.8856	1.732	21	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(N[6]C[6]O)(CH3){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.3967	0.355	12	118.8856	1.732	21	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|O<3>}	C[6](C[6]C[6]H)(N[6]C[6]O)(CH3){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.2380	0.000	1	118.8856	1.732	21	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(N[6]C[6]O)(CHHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.5520	0.000	1	119.5520	0.000	1	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(N[6]C[6]O)(CHHO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.5702	0.493	9	119.5702	0.243	9	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(N[6]C[6]O)(CHHP){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.5230	0.201	2	119.4197	0.028	4	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(N[6]C[6]O)(CHHP){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.3165	0.018	2	119.4197	0.028	4	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(CHHS)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(N[6]C[6]O)(CHHS){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.5290	0.260	2	119.5290	0.068	2	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]U)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|U<11>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]U)(CH3){1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1110	0.000	1	120.1110	0.000	1	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]V)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|V<5>}	C[6](C[6]C[6]H)(N[6]C[6]V)(CCHH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.0890	0.140	2	120.0890	0.020	2	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]V)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|V<6>}	C[6](C[6]C[6]H)(N[6]C[6]V)(CH3){1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0210	0.000	1	120.0210	0.000	1	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]V)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|V<5>}	C[6](C[6]C[6]H)(N[6]C[6]V)(CHHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	118.7160	2.360	2	120.0999	1.360	22	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]V)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|V<6>}	C[6](C[6]C[6]H)(N[6]C[6]V)(CHHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0994	1.163	14	120.0999	1.360	22	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]V)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|V<7>}	C[6](C[6]C[6]H)(N[6]C[6]V)(CHHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5625	0.239	6	120.0999	1.360	22	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]V)(CHHS)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|V<6>}	C[6](C[6]C[6]H)(N[6]C[6]V)(CHHS){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.4285	0.117	2	120.4285	0.014	2	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]W)(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|W<6>}	C[6](C[6]C[6]H)(N[6]C[6]W)(CHHP){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.8940	0.310	2	119.9490	0.034	6	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]W)(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|W<9>}	C[6](C[6]C[6]H)(N[6]C[6]W)(CHHP){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.9765	0.145	4	119.9490	0.034	6	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]W)(CHHS)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|W<5>}	C[6](C[6]C[6]H)(N[6]C[6]W)(CHHS){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.8735	0.500	2	120.8735	0.250	2	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(N[6]C[6]O)(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3120	0.000	1	120.3120	0.000	1	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]C)(CH3){1|C<3>,1|C<4>,1|O<2>}	H(C[6]C[6]2)	119.3239	0.482	14	119.2408	0.233	19	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]C)(H){1|C<3>,1|C<4>,1|O<2>}	C[6](C[6]C[6]H)(N[6]C[6]C)(CH3){1|C<3>,1|C<4>,1|O<2>}	H(C[6]C[6]2)	119.1410	0.000	1	119.2408	0.233	19	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]C)(H){1|C<3>,1|C<4>,1|O<2>}	C[6](C[6]C[6]H)(N[6]C[6]C)(CH3){1|O<2>,2|C<3>}	H(C[6]C[6]2)	119.2277	0.079	3	119.2408	0.233	19	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]C)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6]H)(N[6]C[6]C)(CH3){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	118.2160	0.000	1	119.2408	0.233	19	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CC[6]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CC[6]HH){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.7120	0.000	1	119.7120	0.000	1	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(CCHO)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]C)(H){1|C<3>,1|O<1>,1|O<2>}	C[6](C[6]C[6]H)(N[6]C[6]O)(CCHO){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.1310	0.000	1	119.1310	0.000	1	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]C)(H){1|C<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)(N[6]C[6]C)(CH3){1|C<4>,2|C<3>}	H(C[6]C[6]2)	118.5300	0.111	6	118.5300	0.012	6	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]C)(H){2|H<1>,3|C<3>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.6780	0.000	1	119.6780	0.000	1	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]C)(H){1|H<1>,1|O<2>,3|C<3>}	C[6](C[6]C[6]H)(N[6]C[6]O)(CH3){1|C<4>,2|C<3>}	H(C[6]C[6]2)	119.1555	0.073	2	119.1555	0.005	2	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)(C[6]N[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3){1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	121.2197	0.617	3	121.1513	0.272	4	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3){1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.9460	0.000	1	121.1513	0.272	4	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CCCH)	H(C[6]C[6]2)	C[6](C[6]N[6]C)(C[6]N[6]O)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CCCH){1|Se<1>,1|N<3>,1|O<1>}	H(C[6]C[6]2)	119.6086	0.162	5	119.6086	0.026	5	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]N[6]C)(C[6]N[6]O)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CCHH){1|N<2>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.8020	0.055	2	119.7617	0.192	21	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]N[6]C)(C[6]N[6]O)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CCHH){1|N<3>,1|O<1>,1|S<1>}	H(C[6]C[6]2)	119.7393	0.146	11	119.7617	0.192	21	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]N[6]C)(C[6]N[6]O)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CCHH){1|N<3>,1|O<1>,1|S<2>}	H(C[6]C[6]2)	119.4292	0.278	4	119.7617	0.192	21	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]N[6]C)(C[6]N[6]O)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CCHH){1|Se<1>,1|N<3>,1|O<1>}	H(C[6]C[6]2)	119.6358	0.488	4	119.7617	0.192	21	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)(C[6]N[6]O)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3){1|N<2>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	121.2222	0.422	6	120.4905	0.894	22	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)(C[6]N[6]O)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3){1|N<2>,1|O<2>,1|S<2>}	H(C[6]C[6]2)	120.7930	0.000	1	120.4905	0.894	22	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)(C[6]N[6]O)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3){1|C<4>,1|N<3>,1|O<1>}	H(C[6]C[6]2)	119.6283	0.604	3	120.4905	0.894	22	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)(C[6]N[6]O)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3){1|N<3>,1|O<1>,1|S<1>}	H(C[6]C[6]2)	120.7287	1.168	6	120.4905	0.894	22	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)(C[6]N[6]O)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3){1|O<1>,2|N<3>}	H(C[6]C[6]2)	119.8920	0.772	5	120.4905	0.894	22	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)(C[6]N[6]O)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3){1|Se<1>,1|N<3>,1|O<1>}	H(C[6]C[6]2)	119.9480	0.000	1	120.4905	0.894	22	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)(C[6]N[6]O)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CHHO)	H(C[6]C[6]2)	C[6](C[6]N[6]C)(C[6]N[6]O)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CHHO){1|N<3>,1|O<1>,1|S<1>}	H(C[6]C[6]2)	120.0773	0.135	3	120.0773	0.018	3	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)(C[6]O[6]O)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]N[6]C)(C[6]O[6]O)(H){1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CCHH){1|O<1>,1|O<2>,2|C<3>}	H(C[6]C[6]2)	120.2090	0.000	1	120.2090	0.000	1	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](C[6]C[6]H)(N[6]B[6]C)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|B<4>,2|C<4>}	C[6](C[6]C[6]H)(N[6]B[6]C)(CH3){1|C<4>,1|N<3>,2|F<1>}	H(C[6]C[6]2)	118.9870	0.064	2	118.9870	0.004	2	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3){1|C<4>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.5952	0.377	33	120.6961	0.330	72	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3){1|C<4>,1|N<2>,1|S<1>}	H(C[6]C[6]2)	122.7020	0.000	1	120.6961	0.330	72	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3){1|C<4>,1|N<2>,1|S<2>}	H(C[6]C[6]2)	120.7096	0.402	5	120.6961	0.330	72	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3){1|C<4>,2|N<2>}	H(C[6]C[6]2)	120.6829	0.224	15	120.6961	0.330	72	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3){1|C<3>,1|N<3>,1|S<1>}	H(C[6]C[6]2)	122.8520	0.000	1	120.6961	0.330	72	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3){1|C<4>,1|N<3>,1|O<1>}	H(C[6]C[6]2)	120.5157	0.250	7	120.6961	0.330	72	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3){1|C<4>,1|N<3>,1|S<1>}	H(C[6]C[6]2)	120.4764	0.056	5	120.6961	0.330	72	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|C<4>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.1420	0.006	2	120.6961	0.330	72	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3){1|C<4>,1|N<3>,1|O<1>}	H(C[6]C[6]2)	120.9510	1.880	3	120.6961	0.330	72	119.7899	1.026	762	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:N-4:	C[6]-3:	C[6](C[6]N[6]N)2(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(NH3)	H(C[6]C[6]2)	C[6](C[6]N[6]N)2(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(NH3){1|N<3>,2|N<4>}	H(C[6]C[6]2)	119.1265	0.036	2	119.1265	0.001	2	119.1265	0.001	2	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:P-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]P)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(PO3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]P)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(PO3){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.7070	0.074	2	119.8497	0.064	3	119.9454	0.114	11	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:P-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]P)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(PO3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]P)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(PO3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.1350	0.000	1	119.8497	0.064	3	119.9454	0.114	11	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:P-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(PC[6a]2F)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]C)(PC[6a]2F){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0410	0.000	1	120.0410	0.000	1	119.9454	0.114	11	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:P-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(PO3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(PO3){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1235	0.474	4	120.0838	0.176	5	119.9454	0.114	11	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:P-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(PO3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(PO3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.9250	0.000	1	120.0838	0.176	5	119.9454	0.114	11	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:P-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(PO3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(N[6]C[6]O)(PO3){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.5380	0.000	1	119.5380	0.000	1	119.9454	0.114	11	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:P-4:	C[6]-3:	C[6](C[6]C[6]P)(C[6]N[6]P)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(PO3)	H(C[6]C[6]2)	C[6](C[6]C[6]P)(C[6]N[6]P)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(PO3){1|C<3>,1|H<1>,1|P<4>}	H(C[6]C[6]2)	119.8520	0.000	1	119.8520	0.000	1	119.9454	0.114	11	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:Si-4:	C[6]-3:	C[6](C[6]N[6]Si)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(SiCCO)	H(C[6]C[6]2)	C[6](C[6]N[6]Si)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(SiCCO){1|Si<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9885	0.384	2	119.9885	0.147	2	119.9885	0.147	2	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	Ga[6]-3:C[6]-3:Si-4:	C[6]-3:	C[6](C[6]Ga[6]Si)(C[6]C[6]H)(H)	C[6](Ga[6]C[6a]C[6])(C[6]C[6]H)(SiC3)	H(C[6]C[6]2)	C[6](C[6]Ga[6]Si)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](Ga[6]C[6a]C[6])(C[6]C[6]H)(SiC3){1|Si<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	115.6130	0.160	2	115.6130	0.026	2	115.6130	0.026	2	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	Ge[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]Ge[6]C)(C[6]C[6]H)(H)	C[6](Ge[6]C[6]Ru)(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]Ge[6]C)(C[6]C[6]H)(H){1|Ru<8>,1|C<3>,1|H<1>}	C[6](Ge[6]C[6]Ru)(C[6]C[6]H)(CC3){1|C<3>,2|H<1>}	H(C[6]C[6]2)	114.7320	0.000	1	114.7320	0.000	1	114.7320	0.000	1	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	In[6]-3:C[6]-3:Si-4:	C[6]-3:	C[6](C[6]In[6]Si)(C[6]C[6]H)(H)	C[6](In[6]C[6]C)(C[6]C[6]H)(SiC3)	H(C[6]C[6]2)	C[6](C[6]In[6]Si)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](In[6]C[6]C)(C[6]C[6]H)(SiC3){1|Si<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	114.5390	0.158	2	114.5390	0.025	2	114.5390	0.025	2	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[4,6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[4,6]C)(C[6]C[6]H)(H)	C[6](N[4,6]C[4,6]B[4])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[4,6]C)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](N[4,6]C[4,6]B[4])(C[6]C[6]H)(CH3){2|Br<1>,1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1160	0.000	1	119.8513	0.056	3	118.9920	2.468	9	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[4,6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[4,6]C)(C[6]C[6]H)(H)	C[6](N[4,6]C[4,6]B[4])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[4,6]C)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](N[4,6]C[4,6]B[4])(C[6]C[6]H)(CH3){2|Cl<1>,1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.7190	0.086	2	119.8513	0.056	3	118.9920	2.468	9	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[4,6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[4,6]C)(C[6]C[6]H)(H)	C[6](N[4,6]C[4,6]Ge[4])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[4,6]C)(C[6]C[6]H)(H){1|Ge<3>,1|C<3>,1|H<1>}	C[6](N[4,6]C[4,6]Ge[4])(C[6]C[6]H)(CH3){1|C<3>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.3750	0.000	1	120.3890	0.000	2	118.9920	2.468	9	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[4,6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[4,6]C)(C[6]C[6]H)(H)	C[6](N[4,6]C[4,6]Ge[4])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[4,6]C)(C[6]C[6]H)(H){1|Ge<3>,1|C<3>,1|H<1>}	C[6](N[4,6]C[4,6]Ge[4])(C[6]C[6]H)(CH3){1|Cl<1>,1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4030	0.000	1	120.3890	0.000	2	118.9920	2.468	9	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[4,6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[4,6]C)(C[6]C[6]H)(H)	C[6](N[4,6]C[4,6]Si[4])(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]N[4,6]C)(C[6]C[6]H)(H){1|Si<4>,1|C<3>,1|H<1>}	C[6](N[4,6]C[4,6]Si[4])(C[6]C[6]H)(CC3){1|C<3>,1|H<1>,3|C<4>}	H(C[6]C[6]2)	119.4220	0.000	1	119.4220	0.000	1	118.9920	2.468	9	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[4,6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[4,6]C)(C[6]C[6]N)(H)	C[6](N[4,6]C[4,6]B[4])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[4,6]C)(C[6]C[6]N)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](N[4,6]C[4,6]B[4])(C[6]C[6]H)(CH3){1|C<4>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	118.2420	0.000	1	118.2420	0.000	1	118.9920	2.468	9	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[4,6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[4,6]C)(C[6]N[6]C)(H)	C[6](N[4,6]Nb[4,6]C[4])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[4,6]C)(C[6]N[6]C)(H){1|Nb<5>,1|C<3>,1|C<4>}	C[6](N[4,6]Nb[4,6]C[4])(C[6]C[6]H)(CH3){1|N<2>,2|N<3>,4|C<4>}	H(C[6]C[6]2)	116.4200	0.000	1	116.4660	0.004	2	118.9920	2.468	9	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[4,6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[4,6]C)(C[6]N[6]C)(H)	C[6](N[4,6]Nb[4,6]C[4])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[4,6]C)(C[6]N[6]C)(H){1|Nb<5>,1|C<3>,1|C<4>}	C[6](N[4,6]Nb[4,6]C[4])(C[6]C[6]H)(CH3){1|N<3>,2|N<2>,4|C<4>}	H(C[6]C[6]2)	116.5120	0.000	1	116.4660	0.004	2	118.9920	2.468	9	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[5,6]C)(H)	C[6](N[5,6]C[5,6,6a]Ga[5,5])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]C)(H){1|Ga<5>,2|C<3>}	C[6](N[5,6]C[5,6,6a]Ga[5,5])(C[6]C[6]H)(CH3){1|Cl<1>,1|H<1>,1|N<3>,2|C<3>,2|O<2>}	H(C[6]C[6]2)	119.5360	0.000	1	119.4958	0.060	8	118.4187	3.845	60	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[5,6]C)(H)	C[6](N[5,6]C[5,6,6a]Ga[5,5])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]C)(H){1|Ga<5>,2|C<3>}	C[6](N[5,6]C[5,6,6a]Ga[5,5])(C[6]C[6]H)(CH3){1|H<1>,1|N<3>,2|C<3>,3|O<2>}	H(C[6]C[6]2)	119.5698	0.172	6	119.4958	0.060	8	118.4187	3.845	60	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[5,6]C)(H)	C[6](N[5,6]C[5,6,6a]Ga[5,5])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[5,6]C)(H){1|Ga<5>,2|C<3>}	C[6](N[5,6]C[5,6,6a]Ga[5,5])(C[6]C[6]H)(CH3){1|H<1>,2|C<3>,2|N<3>,2|O<2>}	H(C[6]C[6]2)	119.0110	0.000	1	119.4958	0.060	8	118.4187	3.845	60	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6a]O[6])(C[6]N[5,6]C)(H)	C[6](N[5,6]Ga[5,6,6]C[5])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6a]O[6])(C[6]N[5,6]C)(H){1|Ga<5>,1|C<4>,2|C<3>}	C[6](N[5,6]Ga[5,6,6]C[5])(C[6]C[6]H)(CH3){1|C<3>,1|N<3>,2|C<4>,2|H<1>,2|O<2>}	H(C[6]C[6]2)	117.4860	0.017	2	117.4860	0.000	2	118.4187	3.845	60	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[5,6]C)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]B[5])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[5,6]C)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](N[5,6]C[5,6]B[5])(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|N<3>,1|O<2>,2|H<1>}	H(C[6]C[6]2)	119.7260	0.000	1	119.7935	0.012	4	118.4187	3.845	60	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[5,6]C)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]B[5])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[5,6]C)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](N[5,6]C[5,6]B[5])(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|N<3>,3|H<1>}	H(C[6]C[6]2)	119.8080	0.000	1	119.7935	0.012	4	118.4187	3.845	60	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[5,6]C)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]B[5])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[5,6]C)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](N[5,6]C[5,6]B[5])(C[6]C[6]H)(CH3){1|Cl<1>,1|C<4>,1|H<1>,1|P<4>,2|C<3>}	H(C[6]C[6]2)	119.8200	0.173	2	119.7935	0.012	4	118.4187	3.845	60	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[5,6]C)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[5,6]C)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(CH3){1|C<4>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	119.4520	0.000	1	119.6408	0.066	5	118.4187	3.845	60	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[5,6]C)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[5,6]C)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(CH3){1|H<1>,5|C<3>}	H(C[6]C[6]2)	119.5045	0.252	2	119.6408	0.066	5	118.4187	3.845	60	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[5,6]C)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[5,6]C)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(CH3){1|Si<5>,1|C<3>,1|O<2>,3|H<1>}	H(C[6]C[6]2)	119.8715	0.139	2	119.6408	0.066	5	118.4187	3.845	60	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[5,6]C)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]Ga[5])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[5,6]C)(C[6]C[6]H)(H){1|Ga<4>,1|C<3>,1|H<1>}	C[6](N[5,6]C[5,6]Ga[5])(C[6]C[6]H)(CH3){2|Cl<1>,1|H<1>,1|P<4>,2|C<3>}	H(C[6]C[6]2)	120.4630	0.000	1	120.4630	0.000	1	118.4187	3.845	60	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[5,6]C)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]Ga[5])(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]N[5,6]C)(C[6]C[6]H)(H){1|Ga<4>,1|C<3>,1|H<1>}	C[6](N[5,6]C[5,6]Ga[5])(C[6]C[6]H)(CHHN){1|H<1>,2|C<3>,3|O<2>}	H(C[6]C[6]2)	120.7270	0.000	1	120.7270	0.000	1	118.4187	3.845	60	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[5,6]C)(C[6]C[6]H)(H)	C[6](N[5,6]C[5,6]S[5])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[5,6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<2>}	C[6](N[5,6]C[5,6]S[5])(C[6]C[6]H)(CH3){1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.5470	0.076	2	119.5470	0.006	2	118.4187	3.845	60	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[5,6]C)(C[6]N[6]C)(H)	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]N[5,6]C)(C[6]N[6]C)(H){1|C<3>,1|N<2>}	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(CCHH){1|C<3>,1|C<4>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	119.2170	0.190	3	119.2170	0.036	3	118.4187	3.845	60	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[5,6]C)(C[6]N[6]C)(H)	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[5,6]C)(C[6]N[6]C)(H){1|C<3>,1|N<2>}	C[6](N[5,6]C[5,6]N[5])(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	119.6125	0.473	14	119.6125	0.224	14	118.4187	3.845	60	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[5,6]C)(C[6]O[6]C)(H)	C[6](N[5,6]Ga[3x5,6,6]C[5])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[5,6]C)(C[6]O[6]C)(H){1|Ga<6>,1|C<4>}	C[6](N[5,6]Ga[3x5,6,6]C[5])(C[6]C[6]H)(CH3){1|N<3>,2|C<4>,2|H<1>,2|N<4>,2|O<2>}	H(C[6]C[6]2)	116.5070	0.000	1	116.5070	0.000	1	118.4187	3.845	60	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[5,6]C)(C[6]O[6]C)(H)	C[6](N[5,6]Ga[5,6,6]C[5])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[5,6]C)(C[6]O[6]C)(H){1|Ga<6>,1|Li<6>,1|C<4>}	C[6](N[5,6]Ga[5,6,6]C[5])(C[6]C[6]H)(CH3){1|Cl<1>,1|Li<6>,1|N<3>,2|C<4>,2|H<1>,2|O<3>}	H(C[6]C[6]2)	116.5970	0.042	2	116.5970	0.002	2	118.4187	3.845	60	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[5,6]C)(C[6]O[6]C)(H)	C[6](N[5,6]In[5,6,6]C[5])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[5,6]C)(C[6]O[6]C)(H){1|In<5>,1|C<4>}	C[6](N[5,6]In[5,6,6]C[5])(C[6]C[6]H)(CH3){1|Cl<1>,1|N<3>,2|C<4>,2|H<1>,2|O<2>}	H(C[6]C[6]2)	115.1690	0.143	2	115.2622	0.028	6	118.4187	3.845	60	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[5,6]C)(C[6]O[6]C)(H)	C[6](N[5,6]In[5,6,6]C[5])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[5,6]C)(C[6]O[6]C)(H){1|In<6>,1|C<4>}	C[6](N[5,6]In[5,6,6]C[5])(C[6]C[6]H)(CH3){1|Cl<1>,1|N<3>,1|O<3>,2|C<4>,2|H<1>,2|O<2>}	H(C[6]C[6]2)	115.2225	0.117	2	115.2622	0.028	6	118.4187	3.845	60	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[5,6]C)(C[6]O[6]C)(H)	C[6](N[5,6]In[5,6,6]C[5])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[5,6]C)(C[6]O[6]C)(H){1|In<6>,1|C<4>}	C[6](N[5,6]In[5,6,6]C[5])(C[6]C[6]H)(CH3){1|Cl<1>,1|N<3>,2|C<4>,2|H<1>,3|O<2>}	H(C[6]C[6]2)	115.3950	0.229	2	115.2622	0.028	6	118.4187	3.845	60	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[5,6]C)(C[6]O[6]C)(H)	C[6](N[5,6]Si[5,6,6]C[5,6a])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[5,6]C)(C[6]O[6]C)(H){1|Si<6>,1|C<3>}	C[6](N[5,6]Si[5,6,6]C[5,6a])(C[6]C[6]H)(CH3){1|C<4>,1|S<2>,3|C<3>,3|O<2>}	H(C[6]C[6]2)	117.9850	0.474	3	117.9850	0.224	3	118.4187	3.845	60	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[5,6]C)(C[6]O[6]C)(H)	C[6](N[5,6]Si[5,6,6]C[5])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[5,6]C)(C[6]O[6]C)(H){1|Si<6>,1|C<4>}	C[6](N[5,6]Si[5,6,6]C[5])(C[6]C[6]H)(CH3){1|N<3>,2|C<4>,2|H<1>,2|N<2>,2|O<2>}	H(C[6]C[6]2)	118.0810	0.000	1	118.0810	0.000	1	118.4187	3.845	60	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[5,6]C)(C[6]O[6]C)(H)	C[6](N[5,6]Si[5,6]C[5])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[5,6]C)(C[6]O[6]C)(H){1|Si<5>,1|C<4>}	C[6](N[5,6]Si[5,6]C[5])(C[6]C[6]H)(CH3){1|C<3>,1|H<1>,2|O<2>,4|C<4>}	H(C[6]C[6]2)	118.8057	0.027	3	118.8057	0.001	3	118.4187	3.845	60	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[5,6]C)2(H)	C[6](N[5,6]In[5,5,6,6]C[5,6a])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[5,6]C)2(H){1|In<5>,2|C<3>}	C[6](N[5,6]In[5,5,6,6]C[5,6a])(C[6]C[6]H)(CH3){1|Cl<1>,1|C<4>,2|C<3>,3|N<3>}	H(C[6]C[6]2)	113.6420	0.216	4	113.6420	0.047	4	118.4187	3.845	60	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:P-4:	C[6]-3:	C[6](C[6]N[5,6]P)(C[6]C[6]H)(H)	C[6](N[5,6]In[5,5]C[5,6])(C[6]C[6]H)(PIrCC)	H(C[6]C[6]2)	C[6](C[6]N[5,6]P)(C[6]C[6]H)(H){1|In<5>,1|C<3>,1|H<1>}	C[6](N[5,6]In[5,5]C[5,6])(C[6]C[6]H)(PIrCC){1|Cl<1>,1|H<1>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	120.7258	0.190	4	120.7258	0.036	4	120.7258	0.036	4	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[5a,6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[5a,6]C)(H)	C[6](N[5a,6]C[5a,6,6a]B[5a])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[5a,6]C)(H){1|B<4>,2|C<3>}	C[6](N[5a,6]C[5a,6,6a]B[5a])(C[6]C[6]H)(CH3){1|H<1>,1|O<2>,4|C<3>}	H(C[6]C[6]2)	119.0830	0.000	1	119.0830	0.000	1	119.0257	0.814	7	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[5a,6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[5a,6]C)(C[6]C[6]C)(H)	C[6](N[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[5a,6]C)(C[6]C[6]C)(H){1|C<2>,2|C<3>}	C[6](N[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(CH3){1|C<4>,1|H<1>,1|O<2>,2|C<3>}	H(C[6]C[6]2)	118.4410	0.000	1	118.4410	0.000	1	119.0257	0.814	7	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[5a,6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[5a,6]C)(C[6]N[6]C)(H)	C[6](N[5a,6]C[5a,6]2)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[5a,6]C)(C[6]N[6]C)(H){2|C<3>}	C[6](N[5a,6]C[5a,6]2)(C[6]C[6]H)(CH3){1|C<4>,1|N<3>,3|N<2>}	H(C[6]C[6]2)	119.8030	1.625	2	119.8030	2.640	2	119.0257	0.814	7	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[5a,6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[5a,6]C)(C[6]N[6]C)(H)	C[6](N[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[5a,6]C)(C[6]N[6]C)(H){2|C<3>}	C[6](N[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|H<1>,1|N<2>,1|O<2>}	H(C[6]C[6]2)	119.1430	0.000	1	119.1430	0.000	1	119.0257	0.814	7	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[5a,6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[5a,6]C)(C[6]N[6]C)(H)	C[6](N[5a,6]C[5a,6a]B[5a,6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[5a,6]C)(C[6]N[6]C)(H){1|B<4>,2|C<3>}	C[6](N[5a,6]C[5a,6a]B[5a,6])(C[6]C[6]H)(CH3){1|C<4>,1|F<1>,1|N<3>,1|O<2>,2|C<3>}	H(C[6]C[6]2)	118.5530	0.000	1	118.4535	0.020	2	119.0257	0.814	7	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[5a,6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[5a,6]C)(C[6]N[6]C)(H)	C[6](N[5a,6]C[5a,6a]B[5a,6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[5a,6]C)(C[6]N[6]C)(H){1|B<4>,2|C<3>}	C[6](N[5a,6]C[5a,6a]B[5a,6])(C[6]C[6]H)(CH3){1|C<4>,1|N<3>,2|C<3>,2|O<2>}	H(C[6]C[6]2)	118.3540	0.000	1	118.4535	0.020	2	119.0257	0.814	7	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6,6]C)(H)	C[6](N[6,6]C[6,6,6a]C[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6,6]C)(H){1|C<4>,2|C<3>}	C[6](N[6,6]C[6,6,6a]C[6])(C[6]C[6]H)(CH3){1|C<4>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	119.6040	0.000	1	119.6040	0.000	1	117.2433	3.871	10	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6,6]C)(C[6]C[6]H)(H)	C[6](N[6,6]C[6,6]B[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6,6]C)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](N[6,6]C[6,6]B[6])(C[6]C[6]H)(CH3){1|F<1>,1|H<1>,1|O<2>,3|C<3>}	H(C[6]C[6]2)	120.0550	0.000	1	119.9465	0.024	2	117.2433	3.871	10	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6,6]C)(C[6]C[6]H)(H)	C[6](N[6,6]C[6,6]B[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6,6]C)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](N[6,6]C[6,6]B[6])(C[6]C[6]H)(CH3){1|H<1>,1|N<3>,2|C<3>,2|F<1>}	H(C[6]C[6]2)	119.8380	0.000	1	119.9465	0.024	2	117.2433	3.871	10	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6,6]C)(C[6]N[6]C)(H)	C[6](N[6,6]C[6,6a]Nb[6,6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6,6]C)(C[6]N[6]C)(H){1|Nb<5>,2|C<3>}	C[6](N[6,6]C[6,6a]Nb[6,6])(C[6]C[6]H)(CH3){1|N<2>,1|N<3>,1|O<2>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	115.4775	0.845	2	115.4775	0.714	2	117.2433	3.871	10	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6,6]C)(C[6]O[6]C)(H)	C[6](N[6,6]Ga[3x6]C[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6,6]C)(C[6]O[6]C)(H){1|Ga<5>,1|C<4>}	C[6](N[6,6]Ga[3x6]C[6])(C[6]C[6]H)(CH3){1|Cl<1>,1|N<3>,2|C<4>,2|H<1>,2|O<2>}	H(C[6]C[6]2)	117.3685	0.610	2	117.3685	0.372	2	117.2433	3.871	10	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6,6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6,6]C)(C[6]O[6]C)(H)	C[6](N[6,6]In[3x6]C[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6,6]C)(C[6]O[6]C)(H){1|In<5>,1|C<4>}	C[6](N[6,6]In[3x6]C[6])(C[6]C[6]H)(CH3){1|Cl<1>,1|N<3>,2|C<4>,2|H<1>,2|O<2>}	H(C[6]C[6]2)	115.7480	0.534	3	115.7480	0.285	3	117.2433	3.871	10	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6,6a]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6,6a]C)(C[6]C[6]H)(H)	C[6](N[6,6a]C[6,6a]B[6a])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6,6a]C)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](N[6,6a]C[6,6a]B[6a])(C[6]C[6]H)(CH3){1|H<1>,2|C<4>,3|C<3>}	H(C[6]C[6]2)	119.6990	0.000	1	119.6990	0.000	1	119.6990	0.000	1	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:B-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]B)(H)	C[6](N[6]C[6]Li)(C[6]C[6]H)(BC[5a]OO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]B)(H){1|Li<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Li)(C[6]C[6]H)(BC[5a]OO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.3295	0.030	2	119.3295	0.001	2	119.1574	0.135	12	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:B-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]B)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(BC[6]CC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]B)(H){1|Ni<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(BC[6]CC){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.1647	0.155	4	119.1647	0.024	4	119.1574	0.135	12	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:B-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]B)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(BC[6]CC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]B)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(BC[6]CC){1|C<3>,2|H<1>}	H(C[6]C[6]2)	118.8650	0.269	2	118.8650	0.072	2	119.1574	0.135	12	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:B-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]B)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(BC[6]OO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]B)(H){1|Pt<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(BC[6]OO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7045	0.330	2	119.7045	0.109	2	119.1574	0.135	12	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:B-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]B)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(BC[6]CC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]B)(H){1|Ru<9>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(BC[6]CC){1|C<3>,2|H<1>}	H(C[6]C[6]2)	118.7160	0.123	2	118.7160	0.015	2	119.1574	0.135	12	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]B[5]C[6])(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CHHP)	H(C[6]C[6]2)	C[6](C[6]B[5]C[6])(C[6]N[6]C)(H){1|Co<4>,1|C<3>,1|H<1>,2|O<2>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CHHP){1|B<3>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	119.8398	0.525	4	119.7512	0.185	6	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]B[5]C[6])(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CHHP)	H(C[6]C[6]2)	C[6](C[6]B[5]C[6])(C[6]N[6]C)(H){1|Co<6>,1|C<3>,1|H<1>,2|O<2>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CHHP){1|B<3>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	119.5740	0.058	2	119.7512	0.185	6	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[3x6]H)(C[6]N[6]C)(H)	C[6](N[6]C[3x6]Mn)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[3x6]H)(C[6]N[6]C)(H){1|Mn<5>,1|C<3>,1|C<4>}	C[6](N[6]C[3x6]Mn)(C[6]C[6]H)(CHHN){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.4345	0.223	4	120.4345	0.050	4	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]N[6]C)(H)	C[6](N[6]C[6]Mo)(C[6]C[6]H)(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]N[6]C)(H){1|Fe<10>,1|Mo<6>,1|C<3>,1|H<1>,2|C<4>}	C[6](N[6]C[6]Mo)(C[6]C[6]H)(CHHP){1|C<3>,2|C<4>}	H(C[6]C[6]2)	119.4213	0.354	4	119.3109	0.150	8	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]N[6]C)(H)	C[6](N[6]C[6]Mo)(C[6]C[6]H)(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]N[6]C)(H){1|Ru<10>,1|Mo<6>,1|C<3>,1|H<1>,2|C<4>}	C[6](N[6]C[6]Mo)(C[6]C[6]H)(CHHP){1|C<3>,2|C<4>}	H(C[6]C[6]2)	119.2005	0.437	4	119.3109	0.150	8	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5a,6]C)(C[6]N[6]C)(H)	C[6](N[6]C[5a,6]O)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]C)(C[6]N[6]C)(H){1|C<3>,1|O<1>,1|O<2>}	C[6](N[6]C[5a,6]O)(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|N<2>}	H(C[6]C[6]2)	118.0380	0.000	1	118.0380	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5a,6]C)(C[6]N[6]C)(H)	C[6](N[6]N[5a,6]Ir)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]C)(C[6]N[6]C)(H){1|Ir<6>,1|C<3>,1|N<3>}	C[6](N[6]N[5a,6]Ir)(C[6]C[6]H)(CH3){1|C<4>,2|C<3>}	H(C[6]C[6]2)	117.7950	0.000	1	117.7950	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6]C)(C[6]N[6]C)(H)	C[6](N[6]C[6,6]Co)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6]C)(C[6]N[6]C)(H){1|Co<6>,2|C<3>}	C[6](N[6]C[6,6]Co)(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	119.2675	0.039	2	119.2675	0.002	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6]C)(C[6]N[6]C)(H)	C[6](N[6]C[6,6]Cu)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6]C)(C[6]N[6]C)(H){1|Cu<3>,2|C<3>}	C[6](N[6]C[6,6]Cu)(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.0650	0.000	1	120.0650	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6]Al)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|Al<4>,1|C<3>,1|C<4>}	C[6](N[6]C[6,6]Al)(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.9770	0.000	1	120.0733	0.007	3	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6]Al)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|Al<4>,1|C<3>,1|C<4>}	C[6](N[6]C[6,6]Al)(C[6]C[6]H)(CH3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.1440	0.000	1	120.0733	0.007	3	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6]Al)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|Al<5>,1|C<3>,1|C<4>}	C[6](N[6]C[6,6]Al)(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.0990	0.000	1	120.0733	0.007	3	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6]B)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|B<5>,2|C<3>}	C[6](N[6]C[6,6]B)(C[6]C[6]H)(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7230	0.000	1	119.7230	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6]C)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|C<3>,1|C<4>,1|O<2>}	C[6](N[6]C[6,6]C)(C[6]C[6]H)(CH3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.3000	0.518	4	119.3000	0.269	4	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6]Co)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|Co<6>,2|C<3>}	C[6](N[6]C[6,6]Co)(C[6]C[6]H)(CHHN){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0915	0.066	2	120.0915	0.004	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6]Cu)(C[6]C[6]H)(CC[6]2F)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|Cu<4>,2|C<3>}	C[6](N[6]C[6,6]Cu)(C[6]C[6]H)(CC[6]2F){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6095	0.279	2	120.6740	0.025	6	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6]Cu)(C[6]C[6]H)(CC[6]2F)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|Cu<5>,2|C<3>}	C[6](N[6]C[6,6]Cu)(C[6]C[6]H)(CC[6]2F){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7062	0.109	4	120.6740	0.025	6	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6]Cu)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|Cu<4>,1|C<3>,1|C<4>}	C[6](N[6]C[6,6]Cu)(C[6]C[6]H)(CH3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.2085	0.170	2	118.8787	2.453	4	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6]Cu)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|Cu<5>,1|C<2>,1|C<3>}	C[6](N[6]C[6,6]Cu)(C[6]C[6]H)(CH3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	117.9080	0.000	1	118.8787	2.453	4	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6]Cu)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|Cu<5>,2|C<3>}	C[6](N[6]C[6,6]Cu)(C[6]C[6]H)(CH3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	117.1900	0.000	1	118.8787	2.453	4	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6]Cu)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|Cu<3>,2|C<3>}	C[6](N[6]C[6,6]Cu)(C[6]C[6]H)(CHHN){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2327	0.083	3	120.3180	0.034	4	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6]Cu)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|Cu<5>,2|C<3>}	C[6](N[6]C[6,6]Cu)(C[6]C[6]H)(CHHN){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5740	0.000	1	120.3180	0.034	4	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6]Dy)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|Dy<13>,1|C<3>,1|C<4>}	C[6](N[6]C[6,6]Dy)(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.4513	0.424	3	119.4513	0.180	3	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6]Fe)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|Fe<5>,2|C<3>}	C[6](N[6]C[6,6]Fe)(C[6]C[6]H)(CHHN){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5205	0.091	2	120.4170	0.036	3	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6]Fe)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|Fe<6>,2|C<3>}	C[6](N[6]C[6,6]Fe)(C[6]C[6]H)(CHHN){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2100	0.000	1	120.4170	0.036	3	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6]H)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|H<1>,2|C<3>}	C[6](N[6]C[6,6]H)(C[6]C[6]H)(CH3){1|C<3>,1|C<5>,1|H<1>}	H(C[6]C[6]2)	119.4855	0.103	2	119.4855	0.011	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6]Ir)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|Ir<6>,1|C<3>,1|C<4>}	C[6](N[6]C[6,6]Ir)(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.0550	0.000	1	120.0550	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6]Ni)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|Ni<5>,1|C<3>,1|C<4>}	C[6](N[6]C[6,6]Ni)(C[6]C[6]H)(CHHN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5290	0.180	2	120.5290	0.032	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6]Pt)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|Pt<4>,2|C<3>}	C[6](N[6]C[6,6]Pt)(C[6]C[6]H)(CH3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	112.5000	0.000	1	112.5000	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6]Rh)(C[6]C[6]H)(CSiHH)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|Rh<7>,2|C<3>}	C[6](N[6]C[6,6]Rh)(C[6]C[6]H)(CSiHH){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7220	0.000	1	119.7220	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6]Ru)(C[6]C[6]H)(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|Ru<6>,2|C<3>}	C[6](N[6]C[6,6]Ru)(C[6]C[6]H)(CHHP){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.1428	0.120	4	120.1428	0.014	4	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6]Ti)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]C)(H){1|Ti<9>,2|C<3>}	C[6](N[6]C[6,6]Ti)(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.5235	0.029	2	119.5235	0.001	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]H)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]N[6]C)(H){1|H<1>,2|C<3>}	C[6](N[6]C[6,6a]H)(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|N<2>}	H(C[6]C[6]2)	119.1525	0.076	2	119.2680	0.040	8	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]H)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]N[6]C)(H){1|H<1>,2|C<3>}	C[6](N[6]C[6,6a]H)(C[6]C[6]H)(CH3){1|C<4>,2|C<3>}	H(C[6]C[6]2)	119.3065	0.219	6	119.2680	0.040	8	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Pd)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]N[6]C)(H){1|Pd<4>,2|C<3>}	C[6](N[6]C[6,6a]Pd)(C[6]C[6]H)(CH3){1|C<4>,2|C<3>}	H(C[6]C[6]2)	119.4707	0.225	3	119.4707	0.051	3	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Rh)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]N[6]C)(H){1|Rh<6>,2|C<3>}	C[6](N[6]C[6,6a]Rh)(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|N<2>}	H(C[6]C[6]2)	119.0600	0.000	1	119.0600	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]C[6a])(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Ag)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C[6a])(C[6]N[6]C)(H){1|Ag<4>,4|C<3>}	C[6](N[6]C[6,6a]Ag)(C[6]C[6]H)(CH3){3|C<3>}	H(C[6]C[6]2)	119.3852	0.214	6	119.3852	0.046	6	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]C[6a])(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Co)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C[6a])(C[6]N[6]C)(H){1|Co<4>,4|C<3>}	C[6](N[6]C[6,6a]Co)(C[6]C[6]H)(CH3){3|C<3>}	H(C[6]C[6]2)	119.0440	0.169	6	119.0440	0.029	6	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]C[6a])(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C[6a])(C[6]N[6]C)(H){1|Cu<4>,4|C<3>}	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(CH3){3|C<3>}	H(C[6]C[6]2)	119.0789	0.636	10	119.0789	0.405	10	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]C[6a])(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Hg)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C[6a])(C[6]N[6]C)(H){1|Hg<4>,4|C<3>}	C[6](N[6]C[6,6a]Hg)(C[6]C[6]H)(CH3){3|C<3>}	H(C[6]C[6]2)	119.3097	0.152	4	119.3097	0.023	4	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]C[6a])(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Ni)(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C[6a])(C[6]N[6]C)(H){1|Ni<3>,4|C<3>}	C[6](N[6]C[6,6a]Ni)(C[6]C[6]H)(CCHH){3|C<3>}	H(C[6]C[6]2)	118.8210	0.055	2	118.8210	0.003	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]C[6a])(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]O)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C[6a])(C[6]N[6]C)(H){1|O<1>,4|C<3>}	C[6](N[6]C[6,6a]O)(C[6]C[6]H)(CH3){3|C<3>}	H(C[6]C[6]2)	118.1900	0.000	1	118.1900	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]C[6a])(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Pt)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C[6a])(C[6]N[6]C)(H){1|Pt<4>,4|C<3>}	C[6](N[6]C[6,6a]Pt)(C[6]C[6]H)(CH3){3|C<3>}	H(C[6]C[6]2)	118.2710	1.023	4	118.2710	1.046	4	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]C[6a])(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Re)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C[6a])(C[6]N[6]C)(H){1|Re<6>,4|C<3>}	C[6](N[6]C[6,6a]Re)(C[6]C[6]H)(CH3){3|C<3>}	H(C[6]C[6]2)	118.6797	0.184	4	118.6797	0.034	4	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]Cl)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Re)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]Cl)(C[6]N[6]C)(H){1|Re<6>,2|C<3>}	C[6](N[6]C[6,6a]Re)(C[6]C[6]H)(CH3){1|Cl<1>,2|C<3>}	H(C[6]C[6]2)	119.6510	0.421	4	119.6510	0.177	4	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Ag)(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Ag<4>,2|C<3>}	C[6](N[6]C[6,6a]Ag)(C[6]C[6]H)(CCHH){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.1005	0.139	4	120.1005	0.019	4	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Ag)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Ag<3>,2|C<3>}	C[6](N[6]C[6,6a]Ag)(C[6]C[6]H)(CH3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	116.2835	3.004	2	116.2835	9.027	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Al)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Al<4>,2|C<3>}	C[6](N[6]C[6,6a]Al)(C[6]C[6]H)(CH3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.7953	0.105	4	119.5458	0.071	24	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Al)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Al<5>,2|C<3>}	C[6](N[6]C[6,6a]Al)(C[6]C[6]H)(CH3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.4959	0.263	20	119.5458	0.071	24	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Ba)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Ba<11>,2|C<3>}	C[6](N[6]C[6,6a]Ba)(C[6]C[6]H)(CHHN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.8990	0.000	1	119.8990	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Bi)(C[6]C[6]H)(CHOO)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Bi<6>,2|C<3>}	C[6](N[6]C[6,6a]Bi)(C[6]C[6]H)(CHOO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5643	0.216	3	120.5643	0.047	3	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Ca)(C[6]C[6]H)(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Ca<8>,2|C<3>}	C[6](N[6]C[6,6a]Ca)(C[6]C[6]H)(CHHO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.4833	0.192	3	120.4833	0.037	3	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Cd)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Cd<4>,2|C<3>}	C[6](N[6]C[6,6a]Cd)(C[6]C[6]H)(CH3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.0127	0.101	3	120.0127	0.010	3	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Cd)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Cd<6>,2|C<3>}	C[6](N[6]C[6,6a]Cd)(C[6]C[6]H)(CHHN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.4619	1.911	15	119.4619	3.652	15	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Co)(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Co<4>,2|C<3>}	C[6](N[6]C[6,6a]Co)(C[6]C[6]H)(CCHH){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3565	0.162	2	120.3565	0.026	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Co)(C[6]C[6]H)(CC[6]CO)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Co<6>,2|C<3>}	C[6](N[6]C[6,6a]Co)(C[6]C[6]H)(CC[6]CO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.0835	0.220	2	120.0835	0.048	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Co)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Co<4>,2|C<3>}	C[6](N[6]C[6,6a]Co)(C[6]C[6]H)(CH3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.7677	0.345	8	119.7402	0.095	24	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Co)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Co<5>,2|C<3>}	C[6](N[6]C[6,6a]Co)(C[6]C[6]H)(CH3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.8160	0.383	7	119.7402	0.095	24	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Co)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Co<6>,2|C<3>}	C[6](N[6]C[6,6a]Co)(C[6]C[6]H)(CH3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.6387	0.233	7	119.7402	0.095	24	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Co)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Co<7>,2|C<3>}	C[6](N[6]C[6,6a]Co)(C[6]C[6]H)(CH3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.7200	0.161	2	119.7402	0.095	24	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Co)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Co<5>,2|C<3>}	C[6](N[6]C[6,6a]Co)(C[6]C[6]H)(CHHN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5205	0.006	2	120.4933	0.002	3	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Co)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Co<6>,2|C<3>}	C[6](N[6]C[6,6a]Co)(C[6]C[6]H)(CHHN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.4390	0.000	1	120.4933	0.002	3	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Co)(C[6]C[6]H)(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Co<4>,2|C<3>}	C[6](N[6]C[6,6a]Co)(C[6]C[6]H)(CHHP){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.5020	0.101	4	119.4308	0.039	6	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Co)(C[6]C[6]H)(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Co<5>,2|C<3>}	C[6](N[6]C[6,6a]Co)(C[6]C[6]H)(CHHP){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.2885	0.323	2	119.4308	0.039	6	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Cr)(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Cr<6>,2|C<3>}	C[6](N[6]C[6,6a]Cr)(C[6]C[6]H)(CCHH){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.5180	0.000	1	119.5180	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Cu<3>,2|C<3>}	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(CC3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.7073	0.223	15	119.6979	0.037	30	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Cu<4>,2|C<3>}	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(CC3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.6884	0.162	15	119.6979	0.037	30	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(CCCH)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Cu<4>,2|C<3>}	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(CCCH){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.2670	0.450	6	120.2670	0.202	6	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Cu<4>,2|C<3>}	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(CCHH){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.8942	0.186	14	119.8942	0.035	14	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(CC[6]CH)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Cu<5>,2|C<3>}	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(CC[6]CH){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.9340	0.058	2	119.9340	0.003	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(CF3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Cu<4>,2|C<3>}	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(CF3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.7974	0.149	16	120.7974	0.022	16	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Cu<3>,2|C<3>}	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(CH3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.1660	0.187	2	119.7085	0.337	165	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Cu<4>,2|C<3>}	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(CH3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.7047	0.600	149	119.7085	0.337	165	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Cu<5>,2|C<3>}	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(CH3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.7984	0.343	8	119.7085	0.337	165	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Cu<6>,2|C<3>}	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(CH3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.5325	0.257	6	119.7085	0.337	165	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Cu<4>,2|C<3>}	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(CHHN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.4770	0.228	2	119.8783	3.203	20	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Cu<5>,2|C<3>}	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(CHHN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.7296	1.984	16	119.8783	3.203	20	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Cu<6>,2|C<3>}	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(CHHN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.4690	0.006	2	119.8783	3.203	20	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Cu<4>,2|C<3>}	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(CHHO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.0267	0.287	4	119.9887	0.100	6	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Cu<5>,2|C<3>}	C[6](N[6]C[6,6a]Cu)(C[6]C[6]H)(CHHO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.9125	0.484	2	119.9887	0.100	6	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Fe)(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Fe<4>,2|C<3>}	C[6](N[6]C[6,6a]Fe)(C[6]C[6]H)(CCHH){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.2860	0.000	1	120.2860	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Fe)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Fe<4>,2|C<3>}	C[6](N[6]C[6,6a]Fe)(C[6]C[6]H)(CH3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.6285	0.542	4	119.3144	0.687	19	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Fe)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Fe<5>,2|C<3>}	C[6](N[6]C[6,6a]Fe)(C[6]C[6]H)(CH3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.4292	0.113	6	119.3144	0.687	19	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Fe)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Fe<6>,2|C<3>}	C[6](N[6]C[6,6a]Fe)(C[6]C[6]H)(CH3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.0982	1.147	9	119.3144	0.687	19	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Fe)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Fe<6>,2|C<3>}	C[6](N[6]C[6,6a]Fe)(C[6]C[6]H)(CHHN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.2924	0.186	19	120.2924	0.035	19	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Fe)(C[6]C[6]H)(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Fe<6>,2|C<3>}	C[6](N[6]C[6,6a]Fe)(C[6]C[6]H)(CHHO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	117.4420	0.000	1	117.4420	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Fe)(C[6]C[6]H)(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Fe<5>,2|C<3>}	C[6](N[6]C[6,6a]Fe)(C[6]C[6]H)(CHHP){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.5826	0.345	10	119.5688	0.105	16	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Fe)(C[6]C[6]H)(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Fe<6>,2|C<3>}	C[6](N[6]C[6,6a]Fe)(C[6]C[6]H)(CHHP){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.5458	0.316	6	119.5688	0.105	16	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Fe)(C[6]C[6]H)(CHHS)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Fe<6>,2|C<3>}	C[6](N[6]C[6,6a]Fe)(C[6]C[6]H)(CHHS){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.7195	0.139	2	119.7195	0.019	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]H)(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|H<1>,2|C<3>}	C[6](N[6]C[6,6a]H)(C[6]C[6]H)(CCHH){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.2870	0.000	1	119.2870	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]H)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|H<1>,2|C<3>}	C[6](N[6]C[6,6a]H)(C[6]C[6]H)(CH3){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	119.8090	0.000	1	119.3602	1.203	34	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]H)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|H<1>,2|C<3>}	C[6](N[6]C[6,6a]H)(C[6]C[6]H)(CH3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.3466	1.111	33	119.3602	1.203	34	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Hg)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Hg<4>,2|C<3>}	C[6](N[6]C[6,6a]Hg)(C[6]C[6]H)(CH3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.4357	0.393	4	120.4357	0.154	4	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Hg)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Hg<6>,2|C<3>}	C[6](N[6]C[6,6a]Hg)(C[6]C[6]H)(CHHN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.2990	0.000	1	120.2990	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Ir)(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Ir<6>,2|C<3>}	C[6](N[6]C[6,6a]Ir)(C[6]C[6]H)(CC3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	118.7270	0.000	1	118.7270	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Ir)(C[6]C[6]H)(CCCH)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Ir<6>,2|C<3>}	C[6](N[6]C[6,6a]Ir)(C[6]C[6]H)(CCCH){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.5060	0.000	1	119.5060	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Ir)(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Ir<8>,2|C<3>}	C[6](N[6]C[6,6a]Ir)(C[6]C[6]H)(CCHH){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.1590	0.000	1	119.1590	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Ir)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Ir<6>,2|C<3>}	C[6](N[6]C[6,6a]Ir)(C[6]C[6]H)(CH3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.4920	0.000	1	119.4920	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Li)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Li<4>,2|C<3>}	C[6](N[6]C[6,6a]Li)(C[6]C[6]H)(CH3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.3178	0.883	4	119.4738	0.706	5	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Li)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Li<5>,2|C<3>}	C[6](N[6]C[6,6a]Li)(C[6]C[6]H)(CH3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.0980	0.000	1	119.4738	0.706	5	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Mn)(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Mn<6>,2|C<3>}	C[6](N[6]C[6,6a]Mn)(C[6]C[6]H)(CCHH){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.0975	0.214	2	120.0975	0.046	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Mn)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Mn<5>,2|C<3>}	C[6](N[6]C[6,6a]Mn)(C[6]C[6]H)(CH3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.1825	0.234	2	119.8051	0.095	8	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Mn)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Mn<6>,2|C<3>}	C[6](N[6]C[6,6a]Mn)(C[6]C[6]H)(CH3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.7233	0.297	3	119.8051	0.095	8	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Mn)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Mn<7>,2|C<3>}	C[6](N[6]C[6,6a]Mn)(C[6]C[6]H)(CH3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.7710	0.000	1	119.8051	0.095	8	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Mn)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Mn<8>,2|C<3>}	C[6](N[6]C[6,6a]Mn)(C[6]C[6]H)(CH3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.5675	0.115	2	119.8051	0.095	8	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Mn)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Mn<5>,2|C<3>}	C[6](N[6]C[6,6a]Mn)(C[6]C[6]H)(CHHN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.9320	0.000	1	120.2604	0.103	16	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Mn)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Mn<6>,2|C<3>}	C[6](N[6]C[6,6a]Mn)(C[6]C[6]H)(CHHN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.2823	0.319	15	120.2604	0.103	16	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Mo)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Mo<6>,2|C<3>}	C[6](N[6]C[6,6a]Mo)(C[6]C[6]H)(CH3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	118.5670	1.739	2	119.5217	0.422	14	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Mo)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Mo<8>,2|C<3>}	C[6](N[6]C[6,6a]Mo)(C[6]C[6]H)(CH3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.6934	0.152	10	119.5217	0.422	14	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Mo)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Mo<9>,2|C<3>}	C[6](N[6]C[6,6a]Mo)(C[6]C[6]H)(CH3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.6180	0.342	2	119.5217	0.422	14	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Ni)(C[6]C[6]H)(CCCH)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Ni<3>,2|C<3>}	C[6](N[6]C[6,6a]Ni)(C[6]C[6]H)(CCCH){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.4670	0.448	2	119.4670	0.201	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Ni)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Ni<4>,2|C<3>}	C[6](N[6]C[6,6a]Ni)(C[6]C[6]H)(CH3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.3780	0.460	18	119.4868	0.170	28	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Ni)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Ni<5>,2|C<3>}	C[6](N[6]C[6,6a]Ni)(C[6]C[6]H)(CH3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.7236	0.244	5	119.4868	0.170	28	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Ni)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Ni<6>,2|C<3>}	C[6](N[6]C[6,6a]Ni)(C[6]C[6]H)(CH3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.5955	0.315	2	119.4868	0.170	28	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Ni)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Ni<7>,2|C<3>}	C[6](N[6]C[6,6a]Ni)(C[6]C[6]H)(CH3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.6727	0.135	3	119.4868	0.170	28	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Ni)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Ni<6>,2|C<3>}	C[6](N[6]C[6,6a]Ni)(C[6]C[6]H)(CHHN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.2950	0.117	2	120.2950	0.014	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Ni)(C[6]C[6]H)(CHHS)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Ni<6>,2|C<3>}	C[6](N[6]C[6,6a]Ni)(C[6]C[6]H)(CHHS){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.9534	0.211	8	119.9534	0.044	8	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Pb)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Pb<4>,2|C<3>}	C[6](N[6]C[6,6a]Pb)(C[6]C[6]H)(CH3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.1118	0.098	4	120.1118	0.010	4	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Pd)(C[6]C[6]H)(CC[5a]2H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Pd<4>,2|C<3>}	C[6](N[6]C[6,6a]Pd)(C[6]C[6]H)(CC[5a]2H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.4240	0.000	1	119.4240	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Pd)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Pd<4>,2|C<3>}	C[6](N[6]C[6,6a]Pd)(C[6]C[6]H)(CH3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.3976	0.263	10	119.4666	0.082	12	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Pd)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Pd<6>,2|C<3>}	C[6](N[6]C[6,6a]Pd)(C[6]C[6]H)(CH3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.8115	0.011	2	119.4666	0.082	12	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Pd)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Pd<4>,2|C<3>}	C[6](N[6]C[6,6a]Pd)(C[6]C[6]H)(CHHN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.8690	0.075	2	119.8690	0.006	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Pd)(C[6]C[6]H)(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Pd<4>,2|C<3>}	C[6](N[6]C[6,6a]Pd)(C[6]C[6]H)(CHHP){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.1241	0.582	7	120.1241	0.339	7	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Pt)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Pt<4>,2|C<3>}	C[6](N[6]C[6,6a]Pt)(C[6]C[6]H)(CH3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.2574	0.418	16	119.3648	0.218	23	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Pt)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Pt<5>,2|C<3>}	C[6](N[6]C[6,6a]Pt)(C[6]C[6]H)(CH3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5490	0.000	1	119.3648	0.218	23	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Pt)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Pt<6>,2|C<3>}	C[6](N[6]C[6,6a]Pt)(C[6]C[6]H)(CH3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.4538	0.331	6	119.3648	0.218	23	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Pt)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Pt<6>,2|C<3>}	C[6](N[6]C[6,6a]Pt)(C[6]C[6]H)(CHHN){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.6250	0.000	1	120.6250	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Re)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Re<6>,2|C<3>}	C[6](N[6]C[6,6a]Re)(C[6]C[6]H)(CH3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.6024	0.439	8	119.6024	0.193	8	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Re)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Re<6>,2|C<3>}	C[6](N[6]C[6,6a]Re)(C[6]C[6]H)(CHHN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5433	0.325	9	120.5433	0.106	9	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Re)(C[6]C[6]H)(CHHS)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Re<6>,2|C<3>}	C[6](N[6]C[6,6a]Re)(C[6]C[6]H)(CHHS){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.6193	0.173	6	119.6193	0.030	6	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Rh)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Rh<5>,2|C<3>}	C[6](N[6]C[6,6a]Rh)(C[6]C[6]H)(CH3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	118.2670	0.000	1	119.2182	0.344	5	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Rh)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Rh<8>,2|C<3>}	C[6](N[6]C[6,6a]Rh)(C[6]C[6]H)(CH3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.4560	0.285	4	119.2182	0.344	5	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Rh)(C[6]C[6]H)(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Rh<4>,2|C<3>}	C[6](N[6]C[6,6a]Rh)(C[6]C[6]H)(CHHP){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.0067	0.043	3	119.9493	0.014	4	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Rh)(C[6]C[6]H)(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Rh<6>,2|C<3>}	C[6](N[6]C[6,6a]Rh)(C[6]C[6]H)(CHHP){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.7770	0.000	1	119.9493	0.014	4	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Ru)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Ru<6>,2|C<3>}	C[6](N[6]C[6,6a]Ru)(C[6]C[6]H)(CH3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.2185	0.558	24	119.2171	0.287	26	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Ru)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Ru<9>,2|C<3>}	C[6](N[6]C[6,6a]Ru)(C[6]C[6]H)(CH3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.1995	0.008	2	119.2171	0.287	26	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Ru)(C[6]C[6]H)(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Ru<5>,2|C<3>}	C[6](N[6]C[6,6a]Ru)(C[6]C[6]H)(CHHP){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.1760	0.000	1	119.0898	1.750	6	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Ru)(C[6]C[6]H)(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Ru<6>,2|C<3>}	C[6](N[6]C[6,6a]Ru)(C[6]C[6]H)(CHHP){1|H<1>,2|C<3>}	H(C[6]C[6]2)	118.1337	1.241	3	119.0898	1.750	6	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Ru)(C[6]C[6]H)(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Ru<8>,2|C<3>}	C[6](N[6]C[6,6a]Ru)(C[6]C[6]H)(CHHP){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.7020	0.000	1	119.0898	1.750	6	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Ru)(C[6]C[6]H)(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Ru<9>,2|C<3>}	C[6](N[6]C[6,6a]Ru)(C[6]C[6]H)(CHHP){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.2600	0.000	1	119.0898	1.750	6	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Ru)(C[6]C[6]H)(CN[5]HH)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Ru<6>,2|C<3>}	C[6](N[6]C[6,6a]Ru)(C[6]C[6]H)(CN[5]HH){1|H<1>,2|C<3>}	H(C[6]C[6]2)	118.2570	0.000	1	118.2570	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Sn)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Sn<4>,2|C<3>}	C[6](N[6]C[6,6a]Sn)(C[6]C[6]H)(CH3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.7235	0.141	2	119.7360	0.074	11	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Sn)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Sn<5>,2|C<3>}	C[6](N[6]C[6,6a]Sn)(C[6]C[6]H)(CH3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.7138	0.255	4	119.7360	0.074	11	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Sn)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Sn<6>,2|C<3>}	C[6](N[6]C[6,6a]Sn)(C[6]C[6]H)(CH3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.7588	0.360	5	119.7360	0.074	11	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Zn)(C[6]C[6]H)(CC[6]CC)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Zn<5>,2|C<3>}	C[6](N[6]C[6,6a]Zn)(C[6]C[6]H)(CC[6]CC){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.1700	0.099	2	120.1700	0.010	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Zn)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Zn<4>,2|C<3>}	C[6](N[6]C[6,6a]Zn)(C[6]C[6]H)(CH3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.9272	0.221	18	119.9501	0.042	25	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Zn)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Zn<5>,2|C<3>}	C[6](N[6]C[6,6a]Zn)(C[6]C[6]H)(CH3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.0073	0.132	3	119.9501	0.042	25	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Zn)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Zn<6>,2|C<3>}	C[6](N[6]C[6,6a]Zn)(C[6]C[6]H)(CH3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.0105	0.186	4	119.9501	0.042	25	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Zn)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Zn<5>,2|C<3>}	C[6](N[6]C[6,6a]Zn)(C[6]C[6]H)(CHHN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5032	1.851	8	120.3970	1.547	17	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Zn)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Zn<6>,2|C<3>}	C[6](N[6]C[6,6a]Zn)(C[6]C[6]H)(CHHN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3026	0.274	9	120.3970	1.547	17	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]Zn)(C[6]C[6]H)(CN[5]HH)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]C)(H){1|Zn<5>,2|C<3>}	C[6](N[6]C[6,6a]Zn)(C[6]C[6]H)(CN[5]HH){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.0730	0.180	2	120.0730	0.032	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]N)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]H)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]N)(C[6]N[6]C)(H){1|H<1>,2|C<3>}	C[6](N[6]C[6,6a]H)(C[6]C[6]H)(CH3){1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.5357	0.045	3	119.5357	0.002	3	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]N[6]C)(H)	C[6](N[6]C[6,6a]H)(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]N[6]C)(H){1|H<1>,2|C<3>}	C[6](N[6]C[6,6a]H)(C[6]C[6]H)(CCHH){1|O<2>,2|C<3>}	H(C[6]C[6]2)	119.6730	0.000	1	119.6730	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]C)(H){1|Pd<4>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CH3){1|C<4>,2|C<3>}	H(C[6]C[6]2)	119.5175	0.009	2	119.5175	0.000	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CHHN){1|C<2>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.9280	0.000	1	120.7160	0.090	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CHHN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5040	0.000	1	120.7160	0.090	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CHHO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.1870	0.000	1	120.1870	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|Cu<3>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.2850	0.000	1	119.7115	0.223	13	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|Cu<3>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CH3){1|C<3>,2|C<4>}	H(C[6]C[6]2)	119.5285	0.058	4	119.7115	0.223	13	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CH3){1|C<3>,2|C<4>}	H(C[6]C[6]2)	119.8607	0.627	4	119.7115	0.223	13	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CH3){3|C<3>}	H(C[6]C[6]2)	119.8520	0.577	4	119.7115	0.223	13	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|Cu<3>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CHHN){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.1800	0.000	1	120.5090	0.216	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CHHN){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.8380	0.000	1	120.5090	0.216	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CHHO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.4400	0.266	2	120.4400	0.071	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CN[6]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CN[6]HH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.7887	0.304	3	119.7887	0.092	3	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CC[6]2C)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CC[6]2C){1|C<3>,2|C<4>}	H(C[6]C[6]2)	120.1685	0.395	6	120.1685	0.156	6	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CH3){1|C<3>,2|C<4>}	H(C[6]C[6]2)	119.4820	0.000	1	119.4820	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHHN){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.1930	0.000	1	120.3225	0.277	4	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHHN){1|C<3>,2|C<4>}	H(C[6]C[6]2)	120.5235	0.812	2	120.3225	0.277	4	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHHN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.0500	0.000	1	120.3225	0.277	4	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ga)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|Ga<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ga)(C[6]C[6]H)(CH3){1|C<2>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	119.7105	0.022	2	119.7105	0.000	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](N[6]C[6]Li)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|Li<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Li)(C[6]C[6]H)(CH3){1|C<3>,2|C<4>}	H(C[6]C[6]2)	119.6575	0.231	2	119.6575	0.053	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mo)(C[6]C[6]H)(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|Mo<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mo)(C[6]C[6]H)(CHHP){1|C<3>,2|C<4>}	H(C[6]C[6]2)	119.2362	0.548	4	119.2362	0.300	4	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|Ni<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.3094	0.493	5	119.5212	0.463	6	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CH3){1|C<4>,2|C<3>}	H(C[6]C[6]2)	120.5800	0.000	1	119.5212	0.463	6	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHHO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.1980	0.000	1	120.1980	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CC3){1|C<3>,2|C<4>}	H(C[6]C[6]2)	119.3940	0.000	1	119.3940	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.1760	0.000	1	119.5800	0.136	3	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CH3){1|C<3>,2|C<4>}	H(C[6]C[6]2)	119.7820	0.167	2	119.5800	0.136	3	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CHHP){1|C<3>,2|C<4>}	H(C[6]C[6]2)	119.4230	0.000	1	119.4230	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CCHH){1|C<4>,2|C<3>}	H(C[6]C[6]2)	119.1150	0.000	1	119.1150	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|Pt<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CH3){1|C<3>,2|C<4>}	H(C[6]C[6]2)	119.3358	0.643	20	119.3358	0.414	20	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CHHO){1|C<4>,2|C<3>}	H(C[6]C[6]2)	119.6005	0.467	4	119.6005	0.218	4	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|Rh<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(CCHH){1|C<3>,1|C<4>,1|O<2>}	H(C[6]C[6]2)	119.6807	0.203	3	119.6807	0.041	3	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CH3){1|C<3>,2|C<4>}	H(C[6]C[6]2)	119.5532	0.308	6	119.5532	0.095	6	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|Zn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CHHO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.1260	0.000	1	120.1260	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](N[6]C[6a]S[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|S<4>}	C[6](N[6]C[6a]S[6])(C[6]C[6]H)(CH3){1|C<4>,2|O<1>,3|C<3>}	H(C[6]C[6]2)	118.3030	0.000	1	118.3030	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]N[6]C)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CHHN){1|Cl<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.0940	0.000	1	121.0940	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]N[6]C)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CCHH){1|Cl<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5790	0.000	1	120.5790	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]N[6]C)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CHHN){1|Cl<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.8250	0.000	1	120.8250	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHHN){1|Cl<1>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	121.2570	0.000	1	121.0525	0.084	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHHN){1|Cl<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.8480	0.000	1	121.0525	0.084	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHHS)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHHS){1|Cl<1>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	120.9585	0.114	2	120.9585	0.013	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHHO){1|Cl<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1790	0.000	1	120.1790	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHHS)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]N[6]C)(H){1|Ni<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHHS){1|Cl<1>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	121.0170	0.264	2	121.0170	0.070	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CHNP)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]N[6]C)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CHNP){1|Cl<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7573	0.151	3	120.7573	0.023	3	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]B[3,3,5,3x6]C[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|B<5>,1|C<3>,1|H<1>}	C[6](N[6]B[3,3,5,3x6]C[6])(C[6]C[6]H)(CH3){1|B<5>,1|C<3>,2|B<6>,3|H<1>}	H(C[6]C[6]2)	106.6270	0.000	1	106.6270	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]B[3,3,5,4x6]C[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|B<5>,1|C<3>,1|H<1>}	C[6](N[6]B[3,3,5,4x6]C[6])(C[6]C[6]H)(CH3){1|Rh<8>,1|C<3>,2|H<1>,3|B<6>}	H(C[6]C[6]2)	118.9990	0.000	1	118.9990	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]B[5]C[6])(C[6]C[6]H)(CB[5]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](N[6]B[5]C[6])(C[6]C[6]H)(CB[5]HH){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.1480	0.000	1	119.1480	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]B[6]C[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|B<3>,1|C<3>,1|H<1>}	C[6](N[6]B[6]C[6])(C[6]C[6]H)(CH3){1|C<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.0580	0.000	1	120.0580	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]B[6a]C[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|B<3>,1|C<3>,1|H<1>}	C[6](N[6]B[6a]C[6])(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|H<1>,2|O<2>}	H(C[6]C[6]2)	120.0037	0.210	4	120.0037	0.044	4	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ag)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ag<3>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ag)(C[6]C[6]H)(CH3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3825	0.006	2	120.3405	0.008	4	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ag)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ag<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ag)(C[6]C[6]H)(CH3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.2985	0.129	2	120.3405	0.008	4	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ag)(C[6]C[6]H)(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ag<3>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ag)(C[6]C[6]H)(CHHP){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.8630	0.113	2	120.8630	0.013	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ag)(C[6]C[6]H)(CHHS)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ag<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ag)(C[6]C[6]H)(CHHS){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.5355	0.029	2	120.5355	0.001	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Al)(C[6]C[6]H)(CAsSi2)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Al<3>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Al)(C[6]C[6]H)(CAsSi2){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.4770	0.000	1	119.4770	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Al)(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Al<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Al)(C[6]C[6]H)(CC3){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0737	0.136	3	120.0737	0.018	3	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Al)(C[6]C[6]H)(CCCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Al<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Al)(C[6]C[6]H)(CCCN){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.5340	0.000	1	120.4393	0.007	3	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Al)(C[6]C[6]H)(CCCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Al<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Al)(C[6]C[6]H)(CCCN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3920	0.024	2	120.4393	0.007	3	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Al)(C[6]C[6]H)(CCHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Al<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Al)(C[6]C[6]H)(CCHN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5885	0.214	4	120.5885	0.046	4	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Al)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Al<3>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Al)(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.5800	0.000	1	120.0097	0.107	8	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Al)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Al<3>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Al)(C[6]C[6]H)(CH3){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.5160	0.000	1	120.0097	0.107	8	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Al)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Al<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Al)(C[6]C[6]H)(CH3){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.2350	0.000	1	120.0097	0.107	8	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Al)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Al<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Al)(C[6]C[6]H)(CH3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.9967	0.218	3	120.0097	0.107	8	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Al)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Al<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Al)(C[6]C[6]H)(CH3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.8785	0.012	2	120.0097	0.107	8	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Al)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Al<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Al)(C[6]C[6]H)(CHHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5190	0.000	1	120.6570	0.014	3	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Al)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Al<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Al)(C[6]C[6]H)(CHHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.7260	0.000	2	120.6570	0.014	3	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Au)(C[6]C[6]H)(CC[6a]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Au<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Au)(C[6]C[6]H)(CC[6a]HH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.6890	0.000	1	119.6890	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ca)(C[6]C[6]H)(CCCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ca<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ca)(C[6]C[6]H)(CCCH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9710	0.186	4	119.9710	0.035	4	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ca)(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ca<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ca)(C[6]C[6]H)(CCHH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0290	0.146	2	120.0290	0.021	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ca)(C[6]C[6]H)(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ca<10>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ca)(C[6]C[6]H)(CHHO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2620	0.000	1	120.2620	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cd)(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cd<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cd)(C[6]C[6]H)(CCHH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0065	0.735	2	120.0065	0.540	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cd)(C[6]C[6]H)(CC[5]CH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cd<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cd)(C[6]C[6]H)(CC[5]CH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.5783	0.125	3	119.5783	0.016	3	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cd)(C[6]C[6]H)(CC[5]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cd)(C[6]C[6]H)(CC[5]HH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3090	0.000	1	120.1500	0.051	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cd)(C[6]C[6]H)(CC[5]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cd<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cd)(C[6]C[6]H)(CC[5]HH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9910	0.000	1	120.1500	0.051	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cd)(C[6]C[6]H)(CC[6]2O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cd<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cd)(C[6]C[6]H)(CC[6]2O){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.6723	0.340	6	120.6723	0.115	6	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cd)(C[6]C[6]H)(CC[6]OO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cd<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cd)(C[6]C[6]H)(CC[6]OO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3123	0.168	4	120.3123	0.028	4	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cd)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cd)(C[6]C[6]H)(CH3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.2040	0.090	3	120.1258	0.022	5	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cd)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cd<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cd)(C[6]C[6]H)(CH3){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0085	0.166	2	120.1258	0.022	5	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cd)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cd<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cd)(C[6]C[6]H)(CHHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2818	0.330	5	120.2086	0.586	22	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cd)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cd<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cd)(C[6]C[6]H)(CHHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3856	0.155	10	120.2086	0.586	22	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cd)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cd<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cd)(C[6]C[6]H)(CHHN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5397	0.115	4	120.2086	0.586	22	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cd)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cd<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cd)(C[6]C[6]H)(CHHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.0550	1.851	3	120.2086	0.586	22	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cd)(C[6]C[6]H)(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cd<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cd)(C[6]C[6]H)(CHHO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5495	0.292	2	120.5495	0.085	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cd)(C[6]C[6]H)(CHHS)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cd<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cd)(C[6]C[6]H)(CHHS){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3720	0.156	8	120.3720	0.024	8	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cd)(C[6]C[6]H)(CN[5]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cd<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cd)(C[6]C[6]H)(CN[5]HH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.6450	0.000	1	119.6450	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cd)(C[6]C[6]H)(CN[5]HS)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cd<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cd)(C[6]C[6]H)(CN[5]HS){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4830	0.000	1	120.4830	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cd)(C[6]C[6]H)(CSeHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cd<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cd)(C[6]C[6]H)(CSeHH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3493	0.138	3	120.3493	0.019	3	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CCCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CCCN){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.5153	0.141	6	120.5153	0.020	6	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CCCO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CCCO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4547	0.441	4	120.5895	0.202	6	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CCCO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CCCO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.8590	0.454	2	120.5895	0.202	6	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CCHH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7668	0.223	5	119.8471	0.622	34	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CCHH){1|H<1>,2|C<3>}	H(C[6]C[6]2)	117.9275	2.375	2	119.8471	0.622	34	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CCHH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1282	0.113	4	119.8471	0.622	34	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CCHH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0281	0.585	19	119.8471	0.622	34	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CCHH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7668	0.192	4	119.8471	0.622	34	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CCHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CCHN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	121.0660	0.000	1	121.0660	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CCHO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CCHO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6280	0.475	6	120.6280	0.226	6	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CC[5]CH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CC[5]CH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0810	0.000	1	120.0810	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CC[6]2C)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CC[6]2C){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.3449	0.122	9	120.0801	0.044	31	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CC[6]2C)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CC[6]2C){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9717	0.120	22	120.0801	0.044	31	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CC[6]2O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CC[6]2O){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.4340	0.082	4	120.5212	0.075	15	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CC[6]2O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CC[6]2O){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5401	0.329	10	120.5212	0.075	15	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CC[6]2O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CC[6]2O){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.6810	0.000	1	120.5212	0.075	15	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CC[6]CC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CC[6]CC){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.0605	0.141	4	120.0605	0.020	4	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CC[6]CO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CC[6]CO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.8987	0.143	6	119.8987	0.020	6	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CC[6]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CC[6]HH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1620	0.000	1	120.1620	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CC[6]HN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CC[6]HN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.9895	0.351	2	120.9895	0.124	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CC[6]OO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CC[6]OO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4377	0.450	15	120.4377	0.203	15	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CC[6a]HN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CC[6a]HN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.4900	0.000	1	120.4900	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CC[6a]HS)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CC[6a]HS){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5850	0.000	1	120.5850	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CCoHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CCoHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2840	0.000	1	120.2840	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CH3){1|As<3>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.7850	0.216	2	119.9989	0.165	53	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.9520	0.000	1	119.9989	0.165	53	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1060	0.000	1	119.9989	0.165	53	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CH3){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9170	0.623	4	119.9989	0.165	53	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CH3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.0905	0.455	10	119.9989	0.165	53	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CH3){1|Si<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.7820	0.192	2	119.9989	0.165	53	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CH3){1|As<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.6415	0.521	2	119.9989	0.165	53	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.8744	0.301	5	119.9989	0.165	53	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.0793	0.362	20	119.9989	0.165	53	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CH3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.0764	0.578	5	119.9989	0.165	53	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.5550	0.000	1	119.9989	0.165	53	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CHHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1130	0.197	4	120.3326	0.646	317	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CHHN){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.4801	0.288	7	120.3326	0.646	317	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CHHN){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	118.5790	0.000	1	120.3326	0.646	317	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CHHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3775	0.258	42	120.3326	0.646	317	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CHHN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	118.9857	1.946	3	120.3326	0.646	317	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CHHN){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.2923	1.231	66	120.3326	0.646	317	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CHHN){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1927	1.101	9	120.3326	0.646	317	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CHHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3483	0.652	174	120.3326	0.646	317	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CHHN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.7890	0.073	3	120.3326	0.646	317	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CHHN){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.9540	0.000	1	120.3326	0.646	317	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CHHN){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6305	0.009	2	120.3326	0.646	317	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CHHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.8044	0.084	5	120.3326	0.646	317	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CHHO){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.8015	0.177	13	120.6370	0.057	30	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CHHO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5128	0.210	16	120.6370	0.057	30	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CHHO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.4850	0.000	1	120.6370	0.057	30	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CHHP){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.0679	0.358	11	120.1478	0.086	31	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CHHP){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.0010	0.203	4	120.1478	0.086	31	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CHHP){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.1872	0.170	10	120.1478	0.086	31	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CHHP){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.3265	0.328	6	120.1478	0.086	31	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CHHS)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CHHS){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.4817	0.537	6	120.4446	0.212	8	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CHHS)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CHHS){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.3335	0.069	2	120.4446	0.212	8	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CHNO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CHNO){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.5030	0.000	1	120.5030	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CHPP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CHPP){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.2890	0.000	1	120.2890	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CN[5]2H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CN[5]2H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.6500	0.083	2	120.5730	0.021	3	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CN[5]2H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CN[5]2H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4190	0.000	1	120.5730	0.021	3	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CN[5]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CN[5]HH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.4480	0.000	1	120.4813	0.033	8	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CN[5]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CN[5]HH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3490	0.000	1	120.4813	0.033	8	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CN[5]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CN[5]HH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.5088	0.205	6	120.4813	0.033	8	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CN[5a]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CN[5a]HH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.0790	0.000	1	120.0790	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CN[6]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CN[6]HH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1335	0.136	2	120.3796	0.063	5	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CN[6]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CN[6]HH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.6110	0.058	2	120.3796	0.063	5	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CN[6]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CN[6]HH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4090	0.000	1	120.3796	0.063	5	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CN[6a]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CN[6a]HH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0565	0.016	2	120.0565	0.000	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cr)(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cr<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cr)(C[6]C[6]H)(CCHH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.4370	0.604	3	119.4431	1.686	8	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cr)(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cr<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cr)(C[6]C[6]H)(CCHH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	118.3943	1.545	3	119.4431	1.686	8	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cr)(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cr<9>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cr)(C[6]C[6]H)(CCHH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.5255	0.155	2	119.4431	1.686	8	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cr)(C[6]C[6]H)(CC[6]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cr<9>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cr)(C[6]C[6]H)(CC[6]HH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	117.8750	0.000	1	117.8750	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cr)(C[6]C[6]H)(CCrHO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cr<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cr)(C[6]C[6]H)(CCrHO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5170	0.000	1	120.5170	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cr)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cr<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cr)(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.1980	0.106	2	120.2055	0.139	6	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cr)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cr<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cr)(C[6]C[6]H)(CH3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5460	0.000	1	120.2055	0.139	6	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cr)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cr<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cr)(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.0970	0.515	3	120.2055	0.139	6	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cr)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cr<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cr)(C[6]C[6]H)(CHHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7550	0.000	1	120.4224	0.075	19	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cr)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cr<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cr)(C[6]C[6]H)(CHHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4391	0.218	17	120.4224	0.075	19	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cr)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cr<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cr)(C[6]C[6]H)(CHHN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.8060	0.000	1	120.4224	0.075	19	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cr)(C[6]C[6]H)(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cr<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cr)(C[6]C[6]H)(CHHO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5755	0.592	6	120.5755	0.351	6	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cr)(C[6]C[6]H)(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cr<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cr)(C[6]C[6]H)(CHHP){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.8760	0.000	1	120.1650	0.214	17	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cr)(C[6]C[6]H)(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cr<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cr)(C[6]C[6]H)(CHHP){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.2943	0.561	3	120.1650	0.214	17	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cr)(C[6]C[6]H)(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cr<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cr)(C[6]C[6]H)(CHHP){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0805	0.422	13	120.1650	0.214	17	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cr)(C[6]C[6]H)(CHHS)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cr<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cr)(C[6]C[6]H)(CHHS){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.2382	0.362	6	120.2382	0.131	6	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CBrHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CBrHH){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.6913	0.038	3	120.6913	0.001	3	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CC3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.0220	0.000	1	120.3140	0.541	7	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CC3){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5002	0.646	4	120.3140	0.541	7	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CC3){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.5875	0.192	2	120.3140	0.541	7	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CCCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CCCH){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.0097	0.333	3	120.0097	0.111	3	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CCCO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CCCO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6165	0.105	2	120.6165	0.011	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<2>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CCHH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0505	0.037	2	119.7523	3.949	78	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<3>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CCHH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0127	0.385	11	119.7523	3.949	78	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CCHH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	114.0100	2.346	4	119.7523	3.949	78	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CCHH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9662	0.933	25	119.7523	3.949	78	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CCHH){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.7420	0.552	3	119.7523	3.949	78	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CCHH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.4040	0.228	2	119.7523	3.949	78	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CCHH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2325	2.026	31	119.7523	3.949	78	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CCHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CCHN){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.9520	0.824	4	120.9520	0.679	4	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CCHO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CCHO){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.6535	0.030	2	120.6535	0.001	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CCOO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CCOO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	121.0410	0.000	1	121.0410	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CC[5]2O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<3>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CC[5]2O){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1980	0.000	1	120.1980	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CC[6]2C)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CC[6]2C){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.2720	0.352	6	120.2714	0.183	26	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CC[6]2C)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CC[6]2C){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2383	0.314	11	120.2714	0.183	26	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CC[6]2C)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CC[6]2C){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.5208	0.519	5	120.2714	0.183	26	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CC[6]2C)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CC[6]2C){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0497	0.674	4	120.2714	0.183	26	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CC[6]2F)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CC[6]2F){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.8725	0.129	4	120.8320	0.054	11	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CC[6]2F)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CC[6]2F){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.8089	0.282	7	120.8320	0.054	11	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CC[6]2H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CC[6]2H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5369	0.123	8	120.5369	0.015	8	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CC[6]2O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CC[6]2O){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.4327	2.393	7	120.4756	4.922	8	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CC[6]2O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CC[6]2O){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.7760	0.000	1	120.4756	4.922	8	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CC[6]CH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CC[6]CH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0275	0.111	4	120.0275	0.012	4	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CC[6]CO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CC[6]CO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2567	0.057	4	120.0527	0.446	10	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CC[6]CO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CC[6]CO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.9167	0.863	6	120.0527	0.446	10	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CC[6]NO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CC[6]NO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	123.3475	0.223	2	123.3475	0.050	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CClHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CClHH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8300	0.000	1	119.8300	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CCuSi2)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CCuSi2){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	115.0880	0.000	1	115.0880	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CF3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CF3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.1940	0.208	4	120.3878	0.220	5	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CF3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CF3){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	121.1630	0.000	1	120.3878	0.220	5	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<2>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.1080	0.281	4	119.9422	1.204	128	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<3>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.1270	0.327	6	119.9422	1.204	128	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<3>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CH3){1|C<3>,1|H<1>,1|P<4>}	H(C[6]C[6]2)	120.0093	0.229	11	119.9422	1.204	128	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.2246	2.252	19	119.9422	1.204	128	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CH3){1|C<3>,1|H<1>,1|P<4>}	H(C[6]C[6]2)	119.8323	0.099	3	119.9422	1.204	128	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CH3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.0197	0.348	54	119.9422	1.204	128	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.2986	1.761	14	119.9422	1.204	128	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9367	0.183	3	119.9422	1.204	128	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CH3){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0080	0.000	1	119.9422	1.204	128	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CH3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.0895	0.227	8	119.9422	1.204	128	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CH3){1|Si<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8015	0.200	2	119.9422	1.204	128	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.3860	0.221	3	119.9422	1.204	128	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<3>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CHHN){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.4135	0.090	8	120.4211	0.556	481	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<3>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CHHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2012	0.330	5	120.4211	0.556	481	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<4>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CHHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5900	0.000	1	120.4211	0.556	481	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CHHN){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.3889	0.848	70	120.4211	0.556	481	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CHHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2681	0.504	68	120.4211	0.556	481	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<5>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CHHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3860	0.000	1	120.4211	0.556	481	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CHHN){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.2959	0.952	29	120.4211	0.556	481	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CHHN){1|C<3>,1|F<1>,1|H<1>}	H(C[6]C[6]2)	120.7170	0.000	1	120.4211	0.556	481	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CHHN){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	121.5916	2.101	5	120.4211	0.556	481	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CHHN){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4155	1.133	11	120.4211	0.556	481	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CHHN){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.6748	0.245	5	120.4211	0.556	481	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CHHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4933	0.597	245	120.4211	0.556	481	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CHHN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.6718	0.425	9	120.4211	0.556	481	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<5>,1|C<3>,1|O<2>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CHHN){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.2990	0.000	1	120.4211	0.556	481	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CHHN){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.1988	2.421	6	120.4211	0.556	481	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CHHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2461	0.655	10	120.4211	0.556	481	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CHHN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.2937	0.478	6	120.4211	0.556	481	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CHHO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4820	0.045	5	120.4681	0.029	23	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CHHO){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.4894	0.157	9	120.4681	0.029	23	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CHHO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3407	0.125	3	120.4681	0.029	23	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<5>,2|C<3>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CHHO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3800	0.049	2	120.4681	0.029	23	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CHHO){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.4100	0.230	3	120.4681	0.029	23	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<6>,2|C<3>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CHHO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.9390	0.000	1	120.4681	0.029	23	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<3>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CHHP){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.6530	0.256	2	120.4001	0.091	10	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CHHP){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.5650	0.100	4	120.4001	0.091	10	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CHHP){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1088	0.223	4	120.4001	0.091	10	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CHHS)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CHHS){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.5997	1.259	12	119.9691	0.761	33	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CHHS)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CHHS){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7869	0.568	7	119.9691	0.761	33	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CHHS)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CHHS){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.3445	0.276	8	119.9691	0.761	33	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CHHS)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CHHS){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5010	0.095	5	119.9691	0.761	33	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CHHS)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CHHS){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0150	0.000	1	119.9691	0.761	33	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CHNO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CHNO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.6215	0.262	2	120.5440	0.052	3	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CHNO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CHNO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3890	0.000	1	120.5440	0.052	3	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CN[5]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<2>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CN[5]HH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9140	0.000	1	120.6091	0.250	15	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CN[5]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<3>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CN[5]HH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.7580	0.004	2	120.6091	0.250	15	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CN[5]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CN[5]HH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.6232	0.930	4	120.6091	0.250	15	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CN[5]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CN[5]HH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.4590	0.040	2	120.6091	0.250	15	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CN[5]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CN[5]HH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5453	0.098	3	120.6091	0.250	15	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CN[5]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CN[5]HH){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.8863	0.191	3	120.6091	0.250	15	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CN[5a]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CN[5a]HH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3073	0.163	3	120.3637	0.030	4	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CN[5a]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CN[5a]HH){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5330	0.000	1	120.3637	0.030	4	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CN[6]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CN[6]HH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6730	0.322	4	120.5022	0.144	11	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CN[6]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CN[6]HH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1403	0.440	3	120.5022	0.144	11	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CN[6]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CN[6]HH){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.9010	0.000	1	120.5022	0.144	11	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CN[6]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CN[6]HH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5033	0.195	3	120.5022	0.144	11	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Eu)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Eu<9>,1|C<4>,1|H<1>}	C[6](N[6]C[6]Eu)(C[6]C[6]H)(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5190	0.000	1	120.5190	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Eu)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Eu<13>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Eu)(C[6]C[6]H)(CHHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.7360	0.423	2	120.3825	0.226	4	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Eu)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Eu<9>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Eu)(C[6]C[6]H)(CHHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0290	0.024	2	120.3825	0.226	4	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CC3){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.4870	0.000	1	120.0337	0.088	6	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CC3){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.2150	0.184	2	120.0337	0.088	6	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CC3){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0950	0.120	3	120.0337	0.088	6	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CCHH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1344	0.263	5	120.1078	0.391	39	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CCHH){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.4730	0.013	2	120.1078	0.391	39	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CCHH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.3740	0.245	10	120.1078	0.391	39	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CCHH){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.6143	0.264	6	120.1078	0.391	39	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CCHH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7747	0.792	15	120.1078	0.391	39	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CCHH){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5420	0.000	1	120.1078	0.391	39	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CCHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CCHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.6247	1.317	3	120.0930	0.970	6	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CCHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CCHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5040	0.000	1	120.0930	0.970	6	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CCHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CCHN){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.5900	0.238	2	120.0930	0.970	6	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CCHO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CCHO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.4600	0.000	1	120.4600	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CC[5]3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CC[5]3){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8330	0.000	1	119.8330	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CC[5]CH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CC[5]CH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8700	0.000	1	119.8700	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CC[5a]2C)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CC[5a]2C){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.4470	0.255	2	120.4470	0.065	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CC[6]2C)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CC[6]2C){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.2843	0.135	7	120.0419	0.057	42	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CC[6]2C)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CC[6]2C){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9934	0.227	35	120.0419	0.057	42	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CC[6]2H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CC[6]2H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4323	0.071	3	120.4323	0.005	3	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CC[6]2O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CC[6]2O){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.5501	0.149	9	120.3485	0.117	34	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CC[6]2O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CC[6]2O){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2498	0.379	22	120.3485	0.117	34	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CC[6]2O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CC[6]2O){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.4673	0.148	3	120.3485	0.117	34	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CC[6]CN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CC[6]CN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5895	0.213	2	120.5895	0.045	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CC[6]HN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CC[6]HN){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	121.0665	0.008	2	120.7407	0.099	29	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CC[6]HN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CC[6]HN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.7101	0.310	25	120.7407	0.099	29	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CC[6]HN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CC[6]HN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.7980	0.475	2	120.7407	0.099	29	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CC[6]OO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CC[6]OO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6173	0.230	9	120.5558	0.063	13	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CC[6]OO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CC[6]OO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.4175	0.268	4	120.5558	0.063	13	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CC[6a]HN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CC[6a]HN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2850	0.000	1	120.2850	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.1198	0.085	5	119.8349	0.107	141	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CH3){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.3890	0.089	2	119.8349	0.107	141	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CH3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.0086	0.154	12	119.8349	0.107	141	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CH3){1|Si<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9750	0.173	2	119.8349	0.107	141	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.9281	0.231	8	119.8349	0.107	141	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CH3){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.0350	0.506	4	119.8349	0.107	141	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CH3){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2260	0.000	1	119.8349	0.107	141	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CH3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.0495	0.212	4	119.8349	0.107	141	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.9248	0.263	47	119.8349	0.107	141	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CH3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.5535	0.233	50	119.8349	0.107	141	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<7>,1|C<4>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CH3){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.2387	0.087	3	119.8349	0.107	141	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<8>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CH3){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7560	0.000	1	119.8349	0.107	141	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.3470	0.407	2	119.8349	0.107	141	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Br<1>,1|Fe<6>,1|C<3>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9493	0.316	6	120.4155	0.302	904	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHHN){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.2850	0.361	2	120.4155	0.302	904	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5685	0.630	4	120.4155	0.302	904	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHHN){1|Br<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6340	0.000	1	120.4155	0.302	904	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHHN){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.7924	0.289	7	120.4155	0.302	904	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHHN){1|C<3>,1|F<1>,1|H<1>}	H(C[6]C[6]2)	120.5295	0.144	2	120.4155	0.302	904	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHHN){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.6580	0.000	1	120.4155	0.302	904	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHHN){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.9500	0.158	3	120.4155	0.302	904	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2756	0.872	22	120.4155	0.302	904	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHHN){1|Cl<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.7090	0.529	2	120.4155	0.302	904	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHHN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.1530	0.590	4	120.4155	0.302	904	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<2>,1|C<3>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2815	0.172	2	120.4155	0.302	904	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3101	0.240	13	120.4155	0.302	904	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHHN){1|Br<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.5270	0.000	1	120.4155	0.302	904	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHHN){1|C<2>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2370	0.286	2	120.4155	0.302	904	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHHN){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.5813	0.887	90	120.4155	0.302	904	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHHN){1|C<3>,1|F<1>,1|H<1>}	H(C[6]C[6]2)	120.4287	0.232	6	120.4155	0.302	904	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHHN){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6150	0.160	2	120.4155	0.302	904	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3960	0.496	695	120.4155	0.302	904	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHHN){1|Cl<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3967	0.248	4	120.4155	0.302	904	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHHN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.4760	0.219	13	120.4155	0.302	904	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,2|C<3>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3135	0.284	2	120.4155	0.302	904	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHHN){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.6583	0.335	7	120.4155	0.302	904	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3393	0.146	11	120.4155	0.302	904	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHHN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.7610	0.008	2	120.4155	0.302	904	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHHO){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.6352	0.315	8	120.3470	0.193	21	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHHO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3562	0.225	5	120.3470	0.193	21	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHHO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.0530	0.480	8	120.3470	0.193	21	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHHP){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.3956	1.105	5	119.4896	1.982	16	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHHP){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3365	0.175	4	119.4896	1.982	16	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHHP){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	118.2013	2.122	4	119.4896	1.982	16	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHHP){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.2350	0.107	3	119.4896	1.982	16	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHHS)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHHS){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0033	0.303	3	120.0741	0.209	13	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHHS)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHHS){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.7100	0.655	3	120.0741	0.209	13	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHHS)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHHS){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2604	0.367	7	120.0741	0.209	13	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHNN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHNN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4080	0.000	1	120.4080	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHNO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHNO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1380	0.000	1	120.1380	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHPP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHPP){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.3010	0.000	1	120.0325	0.144	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHPP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHPP){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7640	0.000	1	120.0325	0.144	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CN[5]2H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CN[5]2H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.8715	0.211	4	120.8715	0.044	4	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CN[5]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CN[5]HH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2813	0.056	3	120.4338	0.118	39	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CN[5]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CN[5]HH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.5396	0.316	5	120.4338	0.118	39	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CN[5]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CN[5]HH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3114	0.328	5	120.4338	0.118	39	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CN[5]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CN[5]HH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.4730	0.240	2	120.4338	0.118	39	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CN[5]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CN[5]HH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3726	0.400	9	120.4338	0.118	39	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CN[5]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CN[5]HH){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.6336	0.287	7	120.4338	0.118	39	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CN[5]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|Si<4>,1|C<3>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CN[5]HH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6030	0.000	1	120.4338	0.118	39	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CN[5]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CN[5]HH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.7015	0.156	4	120.4338	0.118	39	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CN[5]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CN[5]HH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8923	0.079	3	120.4338	0.118	39	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ga)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ga<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ga)(C[6]C[6]H)(CH3){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8760	0.000	1	119.8760	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Hf)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Hf<10>,1|C<4>,1|H<1>}	C[6](N[6]C[6]Hf)(C[6]C[6]H)(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1900	0.000	1	120.1900	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Hg)(C[6]C[6]H)(CC[5]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Hg<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Hg)(C[6]C[6]H)(CC[5]HH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7480	0.000	1	119.7480	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Hg)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Hg<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Hg)(C[6]C[6]H)(CH3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.4200	0.414	2	120.3385	0.260	4	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Hg)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Hg<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Hg)(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.2570	0.762	2	120.3385	0.260	4	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Hg)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Hg<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Hg)(C[6]C[6]H)(CHHN){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.5285	0.073	2	120.4573	0.018	3	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Hg)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Hg<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Hg)(C[6]C[6]H)(CHHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3150	0.000	1	120.4573	0.018	3	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Hg)(C[6]C[6]H)(CHHS)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Hg<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Hg)(C[6]C[6]H)(CHHS){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.5610	0.204	2	120.5610	0.041	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]In)(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|In<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]In)(C[6]C[6]H)(CCHH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0690	0.000	1	120.0690	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]In)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|In<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]In)(C[6]C[6]H)(CHHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6040	0.000	1	120.6040	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CCCO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CCCO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7590	0.151	2	120.0072	0.124	41	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CCCO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CCCO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9978	0.293	31	120.0072	0.124	41	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CCCO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CCCO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1280	0.000	1	120.0072	0.124	41	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CCCO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CCCO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1021	0.599	7	120.0072	0.124	41	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CCHH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9960	0.102	2	119.9960	0.010	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CCHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CCHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6247	0.807	6	120.6247	0.650	6	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CC[5]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CC[5]HH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8040	0.222	3	119.8040	0.049	3	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CC[6a]2H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CC[6a]2H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.6870	0.000	1	119.6870	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CC[6a]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CC[6a]HH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9193	0.121	3	119.9193	0.015	3	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.5360	0.000	1	119.6183	0.128	35	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CH3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.2320	0.000	1	119.6183	0.128	35	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.5651	0.249	7	119.6183	0.128	35	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.5484	0.411	19	119.6183	0.128	35	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.6250	0.096	2	119.6183	0.128	35	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CH3){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	119.8496	0.198	5	119.6183	0.128	35	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CHHN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	121.2985	0.016	2	120.5076	0.192	45	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CHHN){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.4617	0.299	9	120.5076	0.192	45	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CHHN){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.5862	0.467	20	120.5076	0.192	45	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CHHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3155	0.407	8	120.5076	0.192	45	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CHHN){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.5070	0.141	2	120.5076	0.192	45	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CHHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3880	0.000	1	120.5076	0.192	45	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CHHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1477	0.394	3	120.5076	0.192	45	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CHHO){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.8870	0.000	1	119.8870	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CHHP){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.0168	0.177	4	120.1236	0.162	46	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CHHP){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.2560	0.000	1	120.1236	0.162	46	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CHHP){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.0807	0.451	8	120.1236	0.162	46	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CHHP){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.6400	0.000	1	120.1236	0.162	46	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CHHP){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.2036	0.409	21	120.1236	0.162	46	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CHHP){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0700	0.693	2	120.1236	0.162	46	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CHHP){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0800	0.000	1	120.1236	0.162	46	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CHHP){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9476	0.418	8	120.1236	0.162	46	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CHHS)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CHHS){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.1825	0.267	2	119.7788	0.267	5	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CHHS)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CHHS){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.5097	0.476	3	119.7788	0.267	5	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CIrHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CIrHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4830	0.000	1	120.4830	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CN[5]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CN[5]HH){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.7150	0.000	1	120.2650	0.178	7	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CN[5]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CN[5]HH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.8640	0.014	2	120.2650	0.178	7	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CN[5]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CN[5]HH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3530	0.412	4	120.2650	0.178	7	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CP[5]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CP[5]HH){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.6950	0.201	3	119.6950	0.041	3	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CSeHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CSeHH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2380	0.000	1	120.2380	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CSiHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CSiHH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.8030	0.126	2	119.7340	0.022	3	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CSiHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CSiHH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.5960	0.000	1	119.7340	0.022	3	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Li)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Li<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Li)(C[6]C[6]H)(CH3){1|Al<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4002	0.124	13	120.4491	0.034	17	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Li)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Li<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Li)(C[6]C[6]H)(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.9640	0.000	1	120.4491	0.034	17	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Li)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Li<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Li)(C[6]C[6]H)(CH3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3965	0.112	2	120.4491	0.034	17	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Li)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Li<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Li)(C[6]C[6]H)(CH3){1|C<3>,1|H<1>,1|N<4>}	H(C[6]C[6]2)	120.6750	0.000	1	120.4491	0.034	17	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Li)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Li<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Li)(C[6]C[6]H)(CHHN){1|C<3>,1|H<1>,1|P<4>}	H(C[6]C[6]2)	120.2595	0.349	2	120.3312	0.050	10	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Li)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Li<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Li)(C[6]C[6]H)(CHHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1705	0.051	4	120.3312	0.050	10	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Li)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Li<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Li)(C[6]C[6]H)(CHHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5277	0.132	4	120.3312	0.050	10	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Li)(C[6]C[6]H)(CLiHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Li<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Li)(C[6]C[6]H)(CLiHP){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.2510	0.000	1	119.3520	0.020	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Li)(C[6]C[6]H)(CLiHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Li<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Li)(C[6]C[6]H)(CLiHP){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.4530	0.000	1	119.3520	0.020	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Li)(C[6]C[6]H)(CSiHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Li<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Li)(C[6]C[6]H)(CSiHH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2230	0.122	3	120.2230	0.015	3	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mg)(C[6]C[6]H)(CCCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mg<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mg)(C[6]C[6]H)(CCCN){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.8350	0.000	1	120.8350	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mg)(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mg<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mg)(C[6]C[6]H)(CCHH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.3270	0.000	1	119.9543	0.115	4	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mg)(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mg<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mg)(C[6]C[6]H)(CCHH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8300	0.283	3	119.9543	0.115	4	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mg)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mg<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mg)(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.4910	0.000	1	120.4910	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mg)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mg<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mg)(C[6]C[6]H)(CHHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4025	0.153	4	120.4025	0.023	4	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mg)(C[6]C[6]H)(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mg<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mg)(C[6]C[6]H)(CHHO){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.6960	0.400	4	120.6960	0.160	4	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mg)(C[6]C[6]H)(CMgHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mg<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mg)(C[6]C[6]H)(CMgHH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.1810	0.075	2	119.1810	0.006	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mg)(C[6]C[6]H)(CN[5]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mg<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mg)(C[6]C[6]H)(CN[5]HH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.7890	0.000	1	120.7890	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CCHH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1790	0.000	1	119.5218	1.520	5	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CCHH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.3575	1.359	4	119.5218	1.520	5	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CCHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CCHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2242	0.433	4	117.4068	22.090	6	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CCHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CCHN){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	111.7720	3.825	2	117.4068	22.090	6	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CCHO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CCHO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4255	0.177	4	120.4255	0.031	4	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CCHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CCHP){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.3555	0.220	2	120.3555	0.048	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CC[5]HO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CC[5]HO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1645	0.053	2	120.1645	0.003	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CC[5a]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CC[5a]HH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0570	0.000	1	120.0570	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CC[6]2C)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CC[6]2C){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.5020	0.404	2	120.0172	0.226	6	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CC[6]2C)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CC[6]2C){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7748	0.296	4	120.0172	0.226	6	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CC[6]2H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CC[6]2H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4340	0.349	3	120.4340	0.122	3	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CC[6]2O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CC[6]2O){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.4198	0.731	6	120.5554	0.330	20	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CC[6]2O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CC[6]2O){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5973	0.557	12	120.5554	0.330	20	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CC[6]2O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CC[6]2O){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.7100	0.098	2	120.5554	0.330	20	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CC[6]HN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CC[6]HN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.4127	2.256	3	119.4127	5.090	3	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CC[6]OO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CC[6]OO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4596	0.355	5	120.4596	0.126	5	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CC[6a]2O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CC[6a]2O){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3683	0.163	3	120.3683	0.027	3	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CC[6a]HN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CC[6a]HN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.7365	0.378	4	120.7365	0.143	4	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CH3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.2000	0.000	1	120.0203	1.029	17	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.0299	1.115	14	120.0203	1.029	17	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CH3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.8630	0.448	2	120.0203	1.029	17	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CHHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5156	0.208	12	120.3465	0.754	274	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CHHN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	121.1680	0.000	1	120.3465	0.754	274	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CHHN){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.4280	1.240	24	120.3465	0.754	274	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CHHN){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.1080	0.000	1	120.3465	0.754	274	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CHHN){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	115.7610	0.000	1	120.3465	0.754	274	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CHHN){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.9540	0.000	1	120.3465	0.754	274	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CHHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3276	0.834	176	120.3465	0.754	274	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CHHN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.1530	1.537	4	120.3465	0.754	274	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CHHN){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.6798	0.658	20	120.3465	0.754	274	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CHHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3712	0.266	34	120.3465	0.754	274	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CHHO){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	116.7707	4.442	4	119.4792	6.674	16	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CHHO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2873	0.367	10	119.4792	6.674	16	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CHHO){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.8555	0.155	2	119.4792	6.674	16	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CHHP){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.7080	0.120	2	120.5328	0.089	12	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CHHP){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.6520	0.000	1	120.5328	0.089	12	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CHHP){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.3643	0.265	7	120.5328	0.089	12	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CHHP){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.8880	0.116	2	120.5328	0.089	12	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CHHS)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CHHS){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.4467	0.098	10	120.4467	0.010	10	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CN[5]2H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CN[5]2H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.5425	0.110	2	120.5425	0.012	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CN[5]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CN[5]HH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5480	0.129	2	120.4360	0.109	4	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CN[5]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<6>,2|C<3>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CN[5]HH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3240	0.509	2	120.4360	0.109	4	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CN[6]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CN[6]HH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	121.0080	0.202	2	120.8720	0.076	3	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CN[6]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CN[6]HH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6000	0.000	1	120.8720	0.076	3	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CN[6a]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CN[6a]HH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2960	0.000	1	120.2960	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mo)(C[6]C[6]H)(CAsHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mo<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mo)(C[6]C[6]H)(CAsHH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.8220	0.436	8	119.8220	0.190	8	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mo)(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mo<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mo)(C[6]C[6]H)(CCHH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.7615	0.243	4	119.7615	0.059	4	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mo)(C[6]C[6]H)(CCHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mo<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mo)(C[6]C[6]H)(CCHN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.2550	0.000	1	120.3802	0.017	5	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mo)(C[6]C[6]H)(CCHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mo<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mo)(C[6]C[6]H)(CCHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4115	0.127	4	120.3802	0.017	5	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mo)(C[6]C[6]H)(CC[5]HN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mo<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mo)(C[6]C[6]H)(CC[5]HN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	117.2575	4.027	2	117.2575	16.217	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mo)(C[6]C[6]H)(CC[6]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mo<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mo)(C[6]C[6]H)(CC[6]HH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8350	0.048	2	119.8350	0.002	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mo)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mo<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mo)(C[6]C[6]H)(CH3){1|C<3>,1|H<1>,1|P<3>}	H(C[6]C[6]2)	119.5307	0.652	3	119.5190	0.128	9	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mo)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mo<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mo)(C[6]C[6]H)(CH3){1|C<3>,1|H<1>,1|P<4>}	H(C[6]C[6]2)	119.6910	0.000	1	119.5190	0.128	9	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mo)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mo<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mo)(C[6]C[6]H)(CH3){1|Si<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.6097	0.052	3	119.5190	0.128	9	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mo)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mo<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mo)(C[6]C[6]H)(CH3){1|C<3>,1|H<1>,1|P<4>}	H(C[6]C[6]2)	119.2795	0.057	2	119.5190	0.128	9	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mo)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mo<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mo)(C[6]C[6]H)(CHHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.8150	0.490	6	120.8150	0.240	6	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mo)(C[6]C[6]H)(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mo<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mo)(C[6]C[6]H)(CHHO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9375	1.322	2	119.9375	1.747	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mo)(C[6]C[6]H)(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mo<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mo)(C[6]C[6]H)(CHHP){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.9600	0.680	2	120.0682	0.106	34	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mo)(C[6]C[6]H)(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mo<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mo)(C[6]C[6]H)(CHHP){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.0783	0.343	26	120.0682	0.106	34	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mo)(C[6]C[6]H)(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mo<9>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mo)(C[6]C[6]H)(CHHP){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.0605	0.099	6	120.0682	0.106	34	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mo)(C[6]C[6]H)(CHNO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mo<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mo)(C[6]C[6]H)(CHNO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5380	0.000	1	120.5380	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mo)(C[6]C[6]H)(CMoHO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mo<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mo)(C[6]C[6]H)(CMoHO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5630	0.000	1	120.5630	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mo)(C[6]C[6]H)(CN[5]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mo<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mo)(C[6]C[6]H)(CN[5]HH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5053	0.208	4	120.5053	0.043	4	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Nd)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Nd<12>,1|C<4>,1|H<1>}	C[6](N[6]C[6]Nd)(C[6]C[6]H)(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8140	0.242	3	120.8140	0.059	3	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CC3){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.7545	0.080	2	119.7545	0.006	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CCCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CCCN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.0030	0.000	1	120.0030	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CCCO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CCCO){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.6360	0.000	1	120.1815	0.105	6	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CCCO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CCCO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3917	0.199	3	120.1815	0.105	6	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CCCO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CCCO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1390	0.119	2	120.1815	0.105	6	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CCHH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9140	0.209	7	119.6733	3.576	86	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CCHH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.5146	2.045	18	119.6733	3.576	86	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CCHH){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.7545	0.282	2	119.6733	3.576	86	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CCHH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.5940	2.281	45	119.6733	3.576	86	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CCHH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0007	0.256	14	119.6733	3.576	86	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CCHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CCHN){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.6520	0.055	2	120.5535	0.093	6	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CCHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CCHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2430	0.000	1	120.5535	0.093	6	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CCHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CCHN){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.8235	0.135	2	120.5535	0.093	6	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CCHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CCHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1270	0.000	1	120.5535	0.093	6	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CCHO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CCHO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7950	0.000	1	119.7950	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CC[6]2C)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CC[6]2C){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.3220	0.000	1	120.1376	0.016	5	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CC[6]2C)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CC[6]2C){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0915	0.087	4	120.1376	0.016	5	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CC[6]2O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CC[6]2O){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.7163	0.234	3	120.7856	0.157	9	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CC[6]2O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CC[6]2O){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.8202	0.474	6	120.7856	0.157	9	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CC[6]CF)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CC[6]CF){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1347	0.309	4	120.4302	0.088	11	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CC[6]CF)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CC[6]CF){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5990	0.087	7	120.4302	0.088	11	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CC[6]CO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CC[6]CO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.8175	0.378	2	120.2877	0.166	7	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CC[6]CO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CC[6]CO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4758	0.241	5	120.2877	0.166	7	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CC[6]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CC[6]HH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0030	0.000	1	120.0030	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CC[6]HN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CC[6]HN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.8120	0.000	1	120.8120	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CC[6]OO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CC[6]OO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6094	0.288	40	120.6094	0.083	40	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CC[6a]2N)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CC[6a]2N){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4070	0.264	2	120.4070	0.070	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CC[6a]HN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CC[6a]HN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2880	0.000	1	120.4142	0.011	5	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CC[6a]HN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CC[6a]HN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4458	0.091	4	120.4142	0.011	5	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CH3){1|As<3>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8410	0.380	2	119.5049	2.645	73	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.0788	0.214	5	119.5049	2.645	73	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CH3){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8210	0.000	1	119.5049	2.645	73	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CH3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.1230	0.000	1	119.5049	2.645	73	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<5>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CH3){1|C<3>,2|H<1>}	H(C[6]C[6]2)	109.4870	0.000	1	119.5049	2.645	73	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.8720	0.727	4	119.5049	2.645	73	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CH3){1|C<3>,2|H<1>}	H(C[6]C[6]2)	111.5790	0.000	1	119.5049	2.645	73	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CH3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.0362	0.264	5	119.5049	2.645	73	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.7921	0.523	32	119.5049	2.645	73	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CH3){1|C<3>,1|H<1>,1|S<2>}	H(C[6]C[6]2)	120.2730	0.315	3	119.5049	2.645	73	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CH3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.3295	0.705	15	119.5049	2.645	73	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,1|C<4>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CH3){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.2960	0.000	1	119.5049	2.645	73	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.8485	0.057	2	119.5049	2.645	73	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHHN){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.1433	0.340	21	120.3946	0.554	339	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4540	0.668	3	120.3946	0.554	339	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHHN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.7080	0.151	2	120.3946	0.554	339	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHHN){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.7335	0.163	4	120.3946	0.554	339	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHHN){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.3187	0.511	3	120.3946	0.554	339	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3519	0.306	14	120.3946	0.554	339	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHHN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.4826	0.827	8	120.3946	0.554	339	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHHN){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.5428	0.811	86	120.3946	0.554	339	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHHN){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.3260	0.000	1	120.3946	0.554	339	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHHN){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8807	0.111	13	120.3946	0.554	339	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3613	0.624	166	120.3946	0.554	339	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHHN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.5350	1.844	9	120.3946	0.554	339	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHHN){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.6368	0.149	6	120.3946	0.554	339	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	116.6430	0.000	1	120.3946	0.554	339	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHHN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.2930	1.171	2	120.3946	0.554	339	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Br<1>,1|Ni<6>,1|C<3>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHHO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9623	0.617	6	120.4620	0.233	43	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHHO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1820	0.000	1	120.4620	0.233	43	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHHO){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.6217	0.532	18	120.4620	0.233	43	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHHO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4817	0.283	12	120.4620	0.233	43	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,2|C<3>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHHO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4898	0.180	6	120.4620	0.233	43	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHHP){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.2055	0.114	11	120.3233	0.083	16	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHHP){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6750	0.000	1	120.3233	0.083	16	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHHP){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.8360	0.017	2	120.3233	0.083	16	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHHP){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6740	0.000	1	120.3233	0.083	16	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHHP){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8910	0.000	1	120.3233	0.083	16	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHHS)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHHS){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.6195	0.168	2	120.0125	1.910	25	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHHS)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHHS){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	117.5410	0.700	2	120.0125	1.910	25	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHHS)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHHS){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.1376	1.555	14	120.0125	1.910	25	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHHS)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHHS){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2951	0.157	7	120.0125	1.910	25	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHNN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHNN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4080	0.000	1	120.4080	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHNO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHNO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3085	0.025	2	118.1646	26.977	5	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHNO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHNO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.9090	0.000	1	118.1646	26.977	5	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHNO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHNO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	108.8840	0.000	1	118.1646	26.977	5	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHNO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHNO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4130	0.000	1	118.1646	26.977	5	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CN[5]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CN[5]HH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.2678	0.418	4	120.3754	0.072	21	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CN[5]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CN[5]HH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3077	0.076	7	120.3754	0.072	21	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CN[5]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CN[5]HH){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.2477	0.047	3	120.3754	0.072	21	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CN[5]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CN[5]HH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4660	0.000	1	120.3754	0.072	21	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CN[5]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CN[5]HH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.3840	0.096	4	120.3754	0.072	21	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CN[5]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CN[5]HH){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.9565	0.194	2	120.3754	0.072	21	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CN[6]CH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CN[6]CH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1010	0.000	1	120.1010	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CN[6]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CN[6]HH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.8040	0.000	1	120.8040	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CNiHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CNiHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3000	0.263	2	120.3000	0.069	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Os)(C[6]C[6]H)(CC[4]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Os<9>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Os)(C[6]C[6]H)(CC[4]HH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8360	0.000	1	119.8360	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Os)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Os<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Os)(C[6]C[6]H)(CH3){1|C<3>,1|H<1>,1|N<5>}	H(C[6]C[6]2)	118.3230	0.000	1	119.4567	1.013	3	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Os)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Os<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Os)(C[6]C[6]H)(CH3){1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2460	0.000	1	119.4567	1.013	3	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Os)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Os<7>,1|C<4>,1|H<1>}	C[6](N[6]C[6]Os)(C[6]C[6]H)(CH3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.8010	0.000	1	119.4567	1.013	3	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Os)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Os<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Os)(C[6]C[6]H)(CHHN){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.4666	0.571	16	120.4689	0.251	22	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Os)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Os<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Os)(C[6]C[6]H)(CHHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3936	0.207	5	120.4689	0.251	22	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Os)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Os<9>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Os)(C[6]C[6]H)(CHHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.8830	0.000	1	120.4689	0.251	22	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Os)(C[6]C[6]H)(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Os<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Os)(C[6]C[6]H)(CHHP){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.8820	0.175	2	119.8820	0.031	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Os)(C[6]C[6]H)(CN[5]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Os<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Os)(C[6]C[6]H)(CN[5]HH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0440	0.410	2	119.9273	0.125	3	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Os)(C[6]C[6]H)(CN[5]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Os<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Os)(C[6]C[6]H)(CN[5]HH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.6940	0.000	1	119.9273	0.125	3	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Os)(C[6]C[6]H)(COs2C)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Os<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Os)(C[6]C[6]H)(COs2C){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.1532	1.508	6	119.1532	2.273	6	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Os)(C[6]C[6]H)(COsCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Os<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Os)(C[6]C[6]H)(COsCH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.0600	0.000	1	119.5130	0.410	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Os)(C[6]C[6]H)(COsCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Os<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Os)(C[6]C[6]H)(COsCH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9660	0.000	1	119.5130	0.410	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CBHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CBHP){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.0630	0.000	1	120.0630	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CC3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.2485	0.165	2	120.2485	0.027	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CCCH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CCCH){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.8405	0.562	2	119.8405	0.316	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CCCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CCCN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.5660	0.000	1	120.1325	0.188	4	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CCCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CCCN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3213	0.260	3	120.1325	0.188	4	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CCCO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CCCO){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.1237	0.216	3	120.4986	0.287	5	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CCCO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CCCO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	121.0610	0.000	2	120.4986	0.287	5	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CCHH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.8773	0.163	4	119.9984	0.440	27	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CCHH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1155	0.562	22	119.9984	0.440	27	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CCHH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	117.9080	0.000	1	119.9984	0.440	27	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CCHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CCHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3526	0.278	8	120.3526	0.077	8	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CCHO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CCHO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.8340	0.000	1	119.8340	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CCHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CCHP){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9830	0.040	2	119.9830	0.002	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CCOO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CCOO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.4234	0.244	5	120.3143	0.119	6	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CCOO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CCOO){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.7690	0.000	1	120.3143	0.119	6	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CC[6]2H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CC[6]2H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2150	0.359	6	120.2150	0.129	6	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CC[6]CH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CC[6]CH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9640	0.000	1	119.9640	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CC[6]HN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CC[6]HN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4190	0.584	2	120.4190	0.341	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CC[6]HS)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CC[6]HS){1|C<3>,2|H<1>}	H(C[6]C[6]2)	117.8855	1.360	2	117.8855	1.849	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CC[6]OO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CC[6]OO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3878	0.166	10	120.3878	0.028	10	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CC[6a]2H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CC[6a]2H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.6590	0.000	1	119.6590	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CC[6a]HN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CC[6a]HN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5930	0.200	3	120.5930	0.040	3	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CClHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CClHH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2950	0.000	1	120.2950	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.1109	0.270	44	120.0501	0.118	56	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CH3){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.3370	0.000	1	120.0501	0.118	56	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.5918	0.628	5	120.0501	0.118	56	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CH3){1|C<3>,1|H<1>,1|S<2>}	H(C[6]C[6]2)	119.9700	0.437	2	120.0501	0.118	56	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CH3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.7080	0.174	2	120.0501	0.118	56	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.1385	0.144	2	120.0501	0.118	56	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CHHN){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.3375	0.354	22	120.3690	0.153	83	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CHHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2657	0.435	33	120.3690	0.153	83	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CHHN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.9323	0.339	3	120.3690	0.153	83	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CHHN){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.4654	0.296	25	120.3690	0.153	83	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CHHO){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.2140	0.120	2	119.7371	2.502	10	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CHHO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2424	0.124	7	119.7371	2.502	10	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CHHO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	115.2460	0.000	1	119.7371	2.502	10	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CHHP){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.2725	0.187	13	120.2487	0.439	30	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CHHP){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0510	0.319	10	120.2487	0.439	30	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CHHP){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.4869	1.330	7	120.2487	0.439	30	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CHHS)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CHHS){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.4376	0.238	16	120.4828	0.067	18	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CHHS)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CHHS){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.8440	0.000	2	120.4828	0.067	18	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CN[3]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CN[3]HH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6560	0.730	4	120.6560	0.533	4	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CN[5]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CN[5]HH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.3160	0.388	13	120.1613	0.171	49	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CN[5]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CN[5]HH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1083	0.423	33	120.1613	0.171	49	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CN[5]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CN[5]HH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0520	0.000	1	120.1613	0.171	49	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CN[5]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CN[5]HH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0850	0.485	2	120.1613	0.171	49	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CN[5a]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CN[5a]HH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.4020	0.000	2	120.4020	0.000	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CN[6]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CN[6]HH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9035	0.571	2	119.9035	0.326	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CPdCO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CPdCO){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	121.0280	0.000	1	121.0280	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CSeHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CSeHH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.4297	0.927	6	120.4297	0.859	6	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CC3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.2835	0.289	2	119.9437	0.388	3	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pt<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CC3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.2640	0.000	1	119.9437	0.388	3	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CCCO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CCCO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0570	0.294	3	120.0570	0.087	3	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CCHH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.6538	1.089	13	119.7055	1.078	15	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CCHH){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.5010	0.000	1	119.7055	1.078	15	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pt<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CCHH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5820	0.000	1	119.7055	1.078	15	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CCHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CCHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5870	0.000	1	120.6875	0.020	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CCHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pt<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CCHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.7880	0.000	1	120.6875	0.020	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CC[6]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CC[6]HH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.7050	0.129	2	120.1223	0.236	6	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CC[6]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CC[6]HH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8310	0.219	4	120.1223	0.236	6	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CC[6]HN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CC[6]HN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2372	0.465	5	120.2372	0.216	5	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CC[6]HS)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CC[6]HS){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0710	0.107	2	120.1458	0.078	4	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CC[6]HS)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pt<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CC[6]HS){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2205	0.448	2	120.1458	0.078	4	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CC[6a]2H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CC[6a]2H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.5130	0.000	1	119.5130	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.7530	0.411	6	119.4361	3.561	22	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CH3){1|C<3>,2|H<1>}	H(C[6]C[6]2)	118.6734	3.074	8	119.4361	3.561	22	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CH3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.9612	0.220	8	119.4361	3.561	22	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CHHN){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.5786	0.434	5	120.3290	0.154	35	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CHHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2202	0.419	18	120.3290	0.154	35	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pt<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CHHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3882	0.290	12	120.3290	0.154	35	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CHHO){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.0090	0.184	3	119.9488	0.028	5	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CHHO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8585	0.131	2	119.9488	0.028	5	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CHHP){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.2657	0.186	7	120.2730	0.129	11	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CHHP){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1100	0.597	3	120.2730	0.129	11	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CHHP){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.8130	0.000	1	120.2730	0.129	11	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CHHS)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CHHS){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.5850	0.133	3	120.9834	0.459	5	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CHHS)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CHHS){1|C<3>,2|H<1>}	H(C[6]C[6]2)	121.5810	0.781	2	120.9834	0.459	5	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CHNP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CHNP){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.8047	0.700	3	120.8047	0.491	3	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CHOO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pt<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CHOO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	121.2200	0.018	2	121.2200	0.000	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CN[5]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(CN[5]HH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0415	0.073	2	120.0415	0.005	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(CCHH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	118.5487	2.365	3	118.5487	5.595	3	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(CCHO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(CCHO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3771	0.395	7	120.3771	0.156	7	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(CCHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(CCHP){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.5988	0.267	6	120.5988	0.071	6	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(CC[6]2O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(CC[6]2O){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3668	0.475	6	120.3668	0.225	6	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(CC[6]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(CC[6]HH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9320	0.367	5	119.9320	0.134	5	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(CC[6]HN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(CC[6]HN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9590	0.000	1	119.9590	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(CH3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.8648	0.223	9	119.8648	0.050	9	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Re<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(CHHN){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.7711	0.405	10	120.5238	0.117	61	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Re<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(CHHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6850	0.000	1	120.5238	0.117	61	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(CHHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4685	0.310	45	120.5238	0.117	61	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Re<6>,2|C<3>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(CHHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2665	0.158	2	120.5238	0.117	61	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Re<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(CHHN){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	121.0860	0.000	1	120.5238	0.117	61	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Re<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(CHHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4270	0.184	2	120.5238	0.117	61	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(CHHO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0330	0.000	1	120.0330	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Re<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(CHHP){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.7750	0.000	1	120.1099	0.181	14	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(CHHP){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.1486	0.236	12	120.1099	0.181	14	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Re<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(CHHP){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	118.9810	0.000	1	120.1099	0.181	14	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(CHHS)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(CHHS){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.5850	1.800	2	120.2122	0.482	10	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(CHHS)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(CHHS){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1190	0.327	8	120.2122	0.482	10	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(CHOO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(CHOO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	121.1320	0.000	1	121.1320	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(CN[5]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(CN[5]HH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.2892	0.774	4	120.2888	0.254	11	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Re)(C[6]C[6]H)(CN[5]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Re)(C[6]C[6]H)(CN[5]HH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2886	0.352	7	120.2888	0.254	11	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(CCCO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Rh<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(CCCO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	118.9233	0.602	3	118.9233	0.362	3	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Rh<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(CCHH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.2120	0.188	2	119.2120	0.035	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(CCHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Rh<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(CCHP){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1950	0.000	1	120.1950	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(CC[6]2O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Rh<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(CC[6]2O){1|C<3>,2|H<1>}	H(C[6]C[6]2)	114.2130	5.811	2	114.2130	33.768	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(CC[6]CC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Rh<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(CC[6]CC){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7728	0.300	5	119.7728	0.090	5	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(CC[6]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Rh<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(CC[6]HH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0090	0.000	1	120.0090	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Rh<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(CH3){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.6573	0.475	4	120.6346	1.559	11	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Rh<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(CH3){1|C<3>,2|H<1>}	H(C[6]C[6]2)	122.8045	1.227	2	120.6346	1.559	11	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Rh<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.6180	0.000	1	120.6346	1.559	11	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Rh<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.7812	0.123	4	120.6346	1.559	11	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Rh<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(CHHN){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.4222	0.087	6	120.3939	1.510	28	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Rh<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(CHHN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.9840	5.521	2	120.3939	1.510	28	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Rh<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(CHHN){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.6650	0.000	1	120.3939	1.510	28	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Rh<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(CHHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5343	0.289	4	120.3939	1.510	28	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Rh<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(CHHN){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.7403	0.142	3	120.3939	1.510	28	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Rh<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(CHHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2870	1.056	9	120.3939	1.510	28	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Rh<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(CHHN){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.3070	0.157	3	120.3939	1.510	28	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Rh<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(CHHO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2325	0.059	2	120.2325	0.003	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Rh<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(CHHP){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.2030	0.226	21	120.1512	0.040	60	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Rh<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(CHHP){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.0983	0.176	27	120.1512	0.040	60	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Rh<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(CHHP){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.1988	0.205	8	120.1512	0.040	60	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Rh<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(CHHP){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2340	0.000	1	120.1512	0.040	60	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Rh<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(CHHP){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1103	0.167	3	120.1512	0.040	60	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(CHHS)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Rh<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(CHHS){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.8240	0.000	1	120.2965	0.132	4	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(CHHS)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Rh<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(CHHS){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1207	0.111	3	120.2965	0.132	4	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(CN[5]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Rh<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(CN[5]HH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.4890	0.000	1	119.4890	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(CN[5a]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Rh<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(CN[5a]HH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7570	0.000	1	119.7570	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(CSeHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Rh<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(CSeHH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3330	0.000	1	120.3330	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CAsHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CAsHH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.8558	0.517	6	119.8558	0.267	6	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CB[5]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CB[5]HH){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.0860	0.000	1	120.0860	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CC3){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.6250	0.000	1	119.6250	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CCCO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CCCO){1|Br<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.6390	0.000	1	119.8312	0.045	5	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CCCO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CCCO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8707	0.256	3	119.8312	0.045	5	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CCCO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<9>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CCCO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9050	0.000	1	119.8312	0.045	5	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CCHH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.9433	0.170	7	119.7633	0.261	45	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CCHH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9150	0.231	6	119.7633	0.261	45	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CCHH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.6928	0.309	11	119.7633	0.261	45	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CCHH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.6534	0.707	19	119.7633	0.261	45	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CCHH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1090	0.451	2	119.7633	0.261	45	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CCHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CCHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2340	0.000	1	120.1070	0.032	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CCHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CCHN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.9800	0.000	1	120.1070	0.032	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CCHO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<9>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CCHO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0450	0.000	1	120.0450	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CCHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CCHP){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.5610	0.226	3	120.5610	0.051	3	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CC[6]2C)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CC[6]2C){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.1424	0.216	7	119.9378	0.060	20	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CC[6]2C)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CC[6]2C){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8275	0.183	13	119.9378	0.060	20	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CC[6]CC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CC[6]CC){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.9130	0.000	1	119.7865	0.032	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CC[6]CC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CC[6]CC){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.6600	0.000	1	119.7865	0.032	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CC[6]CH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CC[6]CH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8630	0.098	2	120.4540	0.472	4	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CC[6]CH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CC[6]CH){1|H<1>,2|C<3>}	H(C[6]C[6]2)	121.0450	0.102	2	120.4540	0.472	4	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CC[6]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CC[6]HH){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	121.2890	0.000	1	120.1390	0.600	5	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CC[6]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CC[6]HH){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3720	0.000	1	120.1390	0.600	5	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CC[6]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CC[6]HH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.1830	0.000	1	120.1390	0.600	5	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CC[6]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<9>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CC[6]HH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9255	0.136	2	120.1390	0.600	5	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CC[6a]CO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CC[6a]CO){1|Br<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8560	0.000	1	119.8560	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CC[6a]HO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CC[6a]HO){1|Br<1>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5990	0.000	2	120.7068	0.042	6	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CC[6a]HO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CC[6a]HO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6623	0.170	3	120.7068	0.042	6	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CC[6a]HO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CC[6a]HO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	121.0560	0.000	1	120.7068	0.042	6	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CH3){1|C<3>,1|H<1>,1|N<5>}	H(C[6]C[6]2)	119.6805	0.033	2	119.7970	0.091	33	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.9083	0.102	3	119.7970	0.091	33	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CH3){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.2625	0.152	6	119.7970	0.091	33	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CH3){1|C<3>,1|H<1>,1|N<5>}	H(C[6]C[6]2)	120.0520	0.000	2	119.7970	0.091	33	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.5990	0.083	2	119.7970	0.091	33	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CH3){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	119.5682	0.199	4	119.7970	0.091	33	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CH3){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.0220	0.000	1	119.7970	0.091	33	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CH3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.7168	0.141	5	119.7970	0.091	33	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CH3){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	119.7108	0.059	4	119.7970	0.091	33	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<7>,1|C<4>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.6120	0.000	1	119.7970	0.091	33	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CH3){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	119.6150	0.044	2	119.7970	0.091	33	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<9>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CH3){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	119.7730	0.000	1	119.7970	0.091	33	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CHHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6520	0.000	1	120.3657	0.689	63	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CHHN){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.8342	0.485	15	120.3657	0.689	63	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CHHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3091	0.333	39	120.3657	0.689	63	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CHHN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5367	0.140	4	120.3657	0.689	63	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CHHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	118.4800	0.000	1	120.3657	0.689	63	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CHHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4490	0.000	1	120.3657	0.689	63	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<9>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CHHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	118.3730	4.476	2	120.3657	0.689	63	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CHHO){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.2530	0.324	2	120.3841	0.441	9	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CHHO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4580	0.991	3	120.3841	0.441	9	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<9>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CHHO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3942	0.686	4	120.3841	0.441	9	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CHHP){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.1440	0.000	1	120.2726	0.136	49	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CHHP){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.5250	0.251	3	120.2726	0.136	49	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CHHP){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.4165	0.013	2	120.2726	0.136	49	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CHHP){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.7470	0.000	1	120.2726	0.136	49	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CHHP){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.2992	0.462	23	120.2726	0.136	49	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CHHP){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.1308	0.145	4	120.2726	0.136	49	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CHHP){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3496	0.222	5	120.2726	0.136	49	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CHHP){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.0904	0.231	10	120.2726	0.136	49	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CHHS)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CHHS){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.1685	0.126	4	120.1827	0.033	10	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CHHS)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<9>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CHHS){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1922	0.223	6	120.1827	0.033	10	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CN[5]CH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CN[5]CH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.8020	0.198	3	120.8020	0.039	3	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CN[5]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CN[5]HH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.1587	0.163	7	120.1071	0.213	32	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CN[5]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CN[5]HH){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3120	0.223	6	120.1071	0.213	32	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CN[5]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CN[5]HH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9835	0.621	15	120.1071	0.213	32	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CN[5]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CN[5]HH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3550	0.000	1	120.1071	0.213	32	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CN[5]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<9>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CN[5]HH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1120	0.338	3	120.1071	0.213	32	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CRu2C)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CRu2C){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1143	0.270	3	120.1143	0.073	3	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CRuHS)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CRuHS){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.0890	0.733	3	120.0890	0.537	3	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CSeHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<9>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CSeHH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9403	0.299	3	119.9403	0.090	3	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CSiHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CSiHH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.8937	0.130	4	119.8924	0.013	5	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CSiHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CSiHH){1|C<3>,1|C<5>,1|H<1>}	H(C[6]C[6]2)	119.8870	0.000	1	119.8924	0.013	5	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Sm)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Sm<9>,1|C<4>,1|H<1>}	C[6](N[6]C[6]Sm)(C[6]C[6]H)(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5850	0.000	1	120.5850	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Sn)(C[6]C[6]H)(CC[6a]NO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Sn<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Sn)(C[6]C[6]H)(CC[6a]NO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3870	0.000	1	120.3870	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Sn)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Sn<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Sn)(C[6]C[6]H)(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5525	0.132	2	120.4785	0.013	6	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Sn)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Sn<6>,1|C<4>,1|H<1>}	C[6](N[6]C[6]Sn)(C[6]C[6]H)(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4415	0.106	4	120.4785	0.013	6	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Sn)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Sn<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Sn)(C[6]C[6]H)(CHHN){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.5160	0.000	1	120.5160	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Sn)(C[6]C[6]H)(CPbSnP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Sn<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Sn)(C[6]C[6]H)(CPbSnP){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0987	0.601	4	120.0987	0.361	4	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Sn)(C[6]C[6]H)(CSn2P)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Sn<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Sn)(C[6]C[6]H)(CSn2P){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8095	0.476	4	119.8095	0.227	4	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Sr)(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Sr<10>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Sr)(C[6]C[6]H)(CCHH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0135	0.179	2	120.0135	0.032	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ta)(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ta<10>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ta)(C[6]C[6]H)(CC3){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9760	0.000	1	119.9760	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Tc)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Tc<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Tc)(C[6]C[6]H)(CHHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0165	0.186	2	119.9795	0.191	6	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Tc)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Tc<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Tc)(C[6]C[6]H)(CHHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9610	0.553	4	119.9795	0.191	6	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ti)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ti<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ti)(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.2730	0.395	2	120.3580	0.048	6	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ti)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ti<8>,1|C<4>,1|H<1>}	C[6](N[6]C[6]Ti)(C[6]C[6]H)(CH3){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.4005	0.143	4	120.3580	0.048	6	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Yb)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Yb<9>,1|C<4>,1|H<1>}	C[6](N[6]C[6]Yb)(C[6]C[6]H)(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1620	0.000	1	120.1620	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Yb)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Yb<13>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Yb)(C[6]C[6]H)(CHHN){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.6130	0.239	6	120.5266	0.100	7	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Yb)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Yb<14>,1|C<4>,1|H<1>}	C[6](N[6]C[6]Yb)(C[6]C[6]H)(CHHN){1|C<3>,1|C<5>,1|H<1>}	H(C[6]C[6]2)	120.0080	0.000	1	120.5266	0.100	7	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CCCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CCCN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9075	0.054	2	119.9075	0.003	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CCHH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0342	0.247	17	119.6487	1.451	22	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CCHH){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.8210	0.058	2	119.6487	1.451	22	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CCHH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	116.0995	1.293	2	119.6487	1.451	22	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CCHH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8490	0.000	1	119.6487	1.451	22	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CCHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CCHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6043	0.565	3	120.5287	0.212	11	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CCHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CCHN){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.6338	0.425	5	120.5287	0.212	11	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CCHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CCHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2780	0.496	3	120.5287	0.212	11	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CC[5]CH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CC[5]CH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2605	0.552	2	120.2605	0.305	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CC[5]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CC[5]HH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.3265	0.936	2	119.4027	0.455	3	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CC[5]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CC[5]HH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.5550	0.000	1	119.4027	0.455	3	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CC[6]2C)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CC[6]2C){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.4925	0.063	2	120.2802	0.043	5	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CC[6]2C)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CC[6]2C){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1387	0.090	3	120.2802	0.043	5	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CC[6]2O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CC[6]2O){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.7590	0.287	3	120.7590	0.083	3	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CC[6]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CC[6]HH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3885	0.114	2	120.3885	0.013	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CC[6]HN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CC[6]HN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.3845	1.937	2	119.3845	3.751	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CC[6]OO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CC[6]OO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	121.0370	0.198	2	121.0370	0.039	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CC[6a]CO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CC[6a]CO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1785	0.161	2	120.1785	0.026	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CC[6a]HN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CC[6a]HN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2968	0.136	4	120.3443	0.017	6	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CC[6a]HN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CC[6a]HN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3930	0.000	1	120.3443	0.017	6	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CC[6a]HN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<6>,1|C<3>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CC[6a]HN){1|C<2>,2|H<1>}	H(C[6]C[6]2)	120.4860	0.000	1	120.3443	0.017	6	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.1357	0.273	3	119.9664	0.131	48	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CH3){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0290	0.393	3	119.9664	0.131	48	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CH3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.1857	0.348	19	119.9664	0.131	48	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CH3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.7549	0.259	23	119.9664	0.131	48	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CHHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2803	0.314	27	120.2775	1.095	258	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CHHN){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.3365	0.449	4	120.2775	1.095	258	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CHHN){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.3790	4.219	3	120.2775	1.095	258	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CHHN){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8080	0.401	19	120.2775	1.095	258	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CHHN){1|C<3>,1|H<1>,1|P<3>}	H(C[6]C[6]2)	120.6985	0.236	4	120.2775	1.095	258	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CHHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2591	0.689	105	120.2775	1.095	258	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CHHN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.9008	0.845	11	120.2775	1.095	258	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<5>,1|C<3>,1|O<2>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CHHN){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.4375	0.131	2	120.2775	1.095	258	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CHHN){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	118.8217	3.474	10	120.2775	1.095	258	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CHHN){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4744	0.181	5	120.2775	1.095	258	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CHHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3733	0.825	65	120.2775	1.095	258	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CHHN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5170	0.659	3	120.2775	1.095	258	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CHHO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5710	0.000	1	120.3595	0.089	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CHHO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.1480	0.000	1	120.3595	0.089	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<3>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CHHP){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.8545	0.117	2	120.4539	0.206	10	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CHHP){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.2097	0.216	7	120.4539	0.206	10	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CHHP){1|H<1>,2|C<3>}	H(C[6]C[6]2)	121.3620	0.000	1	120.4539	0.206	10	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CHHS)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CHHS){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2400	0.000	1	120.5447	0.050	4	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CHHS)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CHHS){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.7100	0.041	2	120.5447	0.050	4	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CHHS)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CHHS){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5190	0.000	1	120.5447	0.050	4	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CHNO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CHNO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6200	0.000	1	120.6200	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CN[5]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CN[5]HH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0510	0.000	1	120.0895	0.003	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CN[5]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CN[5]HH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1280	0.000	1	120.0895	0.003	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CN[5]HS)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CN[5]HS){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6310	0.000	1	120.6310	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CN[6]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CN[6]HH){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.9210	0.000	1	120.7612	0.067	5	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CN[6]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CN[6]HH){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8513	0.128	3	120.7612	0.067	5	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CN[6]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CN[6]HH){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.3310	0.000	1	120.7612	0.067	5	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CN[6a]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CN[6a]HH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4630	0.000	1	120.4630	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CSeHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CSeHH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0710	0.040	3	120.0710	0.002	3	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zr)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zr<9>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zr)(C[6]C[6]H)(CH3){1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1660	0.000	1	120.1660	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]Ga[6]C[6])(C[6]C[6]H)(CC[6a]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ga<5>,1|C<3>,1|H<1>}	C[6](N[6]Ga[6]C[6])(C[6]C[6]H)(CC[6a]HH){2|Cl<1>,1|C<3>,2|H<1>,2|N<3>}	H(C[6]C[6]2)	120.3820	0.000	1	120.3820	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]C)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CHHN){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7380	0.000	1	119.7380	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]C)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CHHO){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	127.4370	0.000	1	127.4370	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]C)(H){1|Cu<3>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CCHH){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.1905	0.163	2	119.2613	0.028	3	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]C)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CCHH){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.4030	0.000	1	119.2613	0.028	3	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]C)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CHHN){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9195	0.032	2	119.9195	0.001	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CC[6]2C)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CC[6]2C){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	119.8030	0.240	2	119.8030	0.058	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHHN){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5280	1.014	2	120.5280	1.028	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHHO){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8697	0.198	4	119.8697	0.039	4	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CCHH){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	119.8970	0.558	4	119.8970	0.312	4	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]C)(H)	C[6](N[6]C[6a]P[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]C)(H){1|C<3>,1|P<3>,2|H<1>}	C[6](N[6]C[6a]P[6])(C[6]C[6]H)(CH3){1|Cl<1>,1|C<4>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	118.1810	0.000	1	118.1810	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]C)(H)	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]C)(H){1|Si<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CH3){2|Br<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	116.9550	0.187	2	116.9550	0.035	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[5])(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]N[6]C)(H){1|Co<5>,1|C<3>,1|H<1>,2|C<4>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CHHP){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	119.9220	0.028	2	119.9220	0.001	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[5])(C[6]N[6]C)(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]N[6]C)(H){1|Ir<6>,1|C<3>,1|H<1>,2|C<4>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CHHP){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.1265	0.018	2	120.1265	0.000	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]C)(H)	C[6](N[6]C[3]C[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]C)(H){1|C<3>,1|C<4>,1|O<2>}	C[6](N[6]C[3]C[6])(C[6]C[6]H)(CH3){1|H<1>,1|O<2>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	119.4117	0.204	3	119.4117	0.041	3	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]C)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CHHN){1|C<3>,1|C<4>,1|O<2>}	H(C[6]C[6]2)	120.9335	0.105	2	120.9335	0.011	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]C)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CCHH){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.1520	0.143	2	120.0935	0.029	4	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]C)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CCHH){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.0350	0.232	2	120.0935	0.029	4	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CCHH){1|C<3>,1|C<4>,1|O<2>}	H(C[6]C[6]2)	120.8380	0.000	1	120.8380	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHHN){1|C<3>,1|C<4>,1|O<2>}	H(C[6]C[6]2)	120.8780	0.284	2	120.8780	0.081	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHHO){1|C<3>,1|C<4>,1|O<2>}	H(C[6]C[6]2)	121.1630	0.000	1	121.1630	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHHS)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHHS){1|C<3>,1|C<4>,1|O<2>}	H(C[6]C[6]2)	120.6033	0.304	4	120.6033	0.093	4	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CN[5]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CN[5]HH){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.7460	0.035	2	120.7460	0.001	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]C)(H)	C[6](N[6]C[6]Mo)(C[6]C[6]H)(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]C)(H){1|Mo<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mo)(C[6]C[6]H)(CHHP){1|C<3>,1|C<4>,1|O<2>}	H(C[6]C[6]2)	119.9845	0.244	2	119.9845	0.060	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHHN){1|C<3>,1|C<4>,1|O<2>}	H(C[6]C[6]2)	120.7800	0.083	2	120.7800	0.007	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHHS)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]C)(H){1|Ni<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHHS){1|C<3>,1|C<4>,1|O<2>}	H(C[6]C[6]2)	120.2410	0.419	2	120.6322	0.166	6	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHHS)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHHS){1|C<3>,1|C<4>,1|O<2>}	H(C[6]C[6]2)	120.8277	0.255	4	120.6322	0.166	6	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]C)(H)	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]C)(H){1|C<4>,1|H<1>,2|C<3>}	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(CH3){1|C<4>,1|H<1>,1|O<1>,3|C<3>}	H(C[6]C[6]2)	118.4690	0.000	1	118.4690	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]C)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]C)(H){1|Co<6>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CHHO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.8020	0.000	1	119.8020	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]C)(H){1|Cu<4>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CH3){3|C<3>}	H(C[6]C[6]2)	119.5464	0.491	12	119.5464	0.241	12	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]C)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CHHS)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]C)(H){1|Cu<5>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CHHS){1|C<4>,2|C<3>}	H(C[6]C[6]2)	119.9855	0.139	2	119.9855	0.019	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]C)(H)	C[6](N[6]C[6]Mo)(C[6]C[6]H)(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]C)(H){1|Mo<6>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Mo)(C[6]C[6]H)(CHHP){1|C<4>,2|C<3>}	H(C[6]C[6]2)	119.4548	0.528	5	119.4548	0.279	5	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]C)(H){1|Ni<6>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CHHO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.4830	0.000	1	119.4830	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]C)(H){1|Zn<6>,1|H<1>,3|C<3>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CHHO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.9590	0.000	1	119.9590	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]N[6]C)(H)	C[6](N[6]C[6a]B[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]N[6]C)(H){1|B<4>,4|C<3>}	C[6](N[6]C[6a]B[6])(C[6]C[6]H)(CH3){1|N<3>,2|F<1>,3|C<3>}	H(C[6]C[6]2)	116.5600	0.000	1	116.5600	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]N[6]C)(H)	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(CFFH)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]N[6]C)(H){1|C<4>,3|C<3>}	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(CFFH){1|H<1>,1|N<2>,4|C<3>}	H(C[6]C[6]2)	121.1890	0.000	1	121.1890	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[4,6]C)(C[6]N[6]C)(H)	C[6](N[6]Nb[4,6]C[6a])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[4,6]C)(C[6]N[6]C)(H){1|Nb<5>,1|C<3>,1|C<4>}	C[6](N[6]Nb[4,6]C[6a])(C[6]C[6]H)(CH3){1|N<2>,2|C<3>,2|C<4>,2|N<3>}	H(C[6]C[6]2)	116.4410	0.000	1	116.4350	0.000	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[4,6]C)(C[6]N[6]C)(H)	C[6](N[6]Nb[4,6]C[6a])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[4,6]C)(C[6]N[6]C)(H){1|Nb<5>,1|C<3>,1|C<4>}	C[6](N[6]Nb[4,6]C[6a])(C[6]C[6]H)(CH3){1|N<3>,2|C<3>,2|C<4>,2|N<2>}	H(C[6]C[6]2)	116.4290	0.000	1	116.4350	0.000	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[5,6]O)(C[6]N[6]C)(H)	C[6](N[6]C[5,6]H)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[5,6]O)(C[6]N[6]C)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](N[6]C[5,6]H)(C[6]C[6]H)(CH3){1|O<1>,2|N<3>}	H(C[6]C[6]2)	117.9535	0.332	2	117.9535	0.110	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[5,6]O)(C[6]N[6]C)(H)	C[6](N[6]C[5,6]Pd)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[5,6]O)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|N<2>}	C[6](N[6]C[5,6]Pd)(C[6]C[6]H)(CH3){1|O<1>,2|N<3>}	H(C[6]C[6]2)	117.9375	0.124	2	117.9375	0.015	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[5a,6]C)(C[6]N[6]C)(H)	C[6](N[6]B[5a,6]C[6a])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[5a,6]C)(C[6]N[6]C)(H){1|B<4>,2|C<3>}	C[6](N[6]B[5a,6]C[6a])(C[6]C[6]H)(CH3){1|C<4>,1|F<1>,1|N<3>,1|O<2>,2|C<3>}	H(C[6]C[6]2)	118.6100	0.000	1	118.6130	0.033	3	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[5a,6]C)(C[6]N[6]C)(H)	C[6](N[6]B[5a,6]C[6a])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[5a,6]C)(C[6]N[6]C)(H){1|B<4>,2|C<3>}	C[6](N[6]B[5a,6]C[6a])(C[6]C[6]H)(CH3){1|C<4>,1|N<3>,2|C<3>,2|O<2>}	H(C[6]C[6]2)	118.6145	0.255	2	118.6130	0.033	3	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6,6]C)(C[6]N[6]C)(H)	C[6](N[6]Nb[6,6]C[6a])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6,6]C)(C[6]N[6]C)(H){1|Nb<5>,2|C<3>}	C[6](N[6]Nb[6,6]C[6a])(C[6]C[6]H)(CH3){1|N<2>,1|N<3>,1|O<2>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	115.4325	0.766	2	115.4325	0.586	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6,6]O)(C[6]N[6]C)(H)	C[6](N[6]C[6,6]Zn)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6,6]O)(C[6]N[6]C)(H){1|Zn<5>,2|C<3>}	C[6](N[6]C[6,6]Zn)(C[6]C[6]H)(CH3){1|C<3>,1|N<3>,1|O<1>}	H(C[6]C[6]2)	118.8520	0.000	1	118.8520	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)(C[6]N[6]H)(H){1|Cu<4>,1|C<3>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CH3){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	121.0350	0.194	2	121.1688	0.484	5	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)(C[6]N[6]H)(H){1|Cu<5>,1|Cu<6>,1|C<3>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CH3){1|N<3>,2|H<1>}	H(C[6]C[6]2)	121.5800	1.103	2	121.1688	0.484	5	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)(C[6]N[6]H)(H){2|Cu<4>,1|C<3>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6140	0.000	1	121.1688	0.484	5	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)(C[6]N[6]O)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)(C[6]N[6]O)(H){1|Mn<4>,1|Mn<9>,1|C<4>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CH3){1|N<3>,1|N<4>,1|O<2>}	H(C[6]C[6]2)	121.7740	0.000	1	121.5520	0.099	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)(C[6]N[6]O)(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)(C[6]N[6]O)(H){1|Mn<9>,1|C<3>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CH3){1|N<2>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	121.3300	0.000	1	121.5520	0.099	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)(C[6]O[6]C)(H)	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)(C[6]O[6]C)(H){1|Ge<3>,1|C<3>}	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CH3){1|Cl<1>,1|C<4>,1|O<2>,2|C<3>}	H(C[6]C[6]2)	117.0820	0.000	1	117.0820	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)(C[6]O[6]C)(H)	C[6](N[6]Ga[3x6]C)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)(C[6]O[6]C)(H){1|Ga<6>,1|C<4>}	C[6](N[6]Ga[3x6]C)(C[6]C[6]H)(CH3){1|C<4>,2|N<3>,3|O<2>}	H(C[6]C[6]2)	117.1490	0.282	3	117.1490	0.079	3	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)(C[6]O[6]C)(H)	C[6](N[6]Ga[6,6]C)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)(C[6]O[6]C)(H){1|Ga<5>,1|C<4>}	C[6](N[6]Ga[6,6]C)(C[6]C[6]H)(CH3){1|Cl<1>,1|C<4>,1|N<3>,2|O<2>}	H(C[6]C[6]2)	116.7550	0.303	3	116.7550	0.092	3	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)(C[6]O[6]C)(H)	C[6](N[6]Ga[6]C)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)(C[6]O[6]C)(H){1|Ga<4>,1|C<4>}	C[6](N[6]Ga[6]C)(C[6]C[6]H)(CH3){1|C<4>,1|O<2>,2|N<3>}	H(C[6]C[6]2)	115.9780	0.000	1	115.9450	0.002	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)(C[6]O[6]C)(H)	C[6](N[6]Ga[6]C)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)(C[6]O[6]C)(H){1|Ga<4>,1|C<4>}	C[6](N[6]Ga[6]C)(C[6]C[6]H)(CH3){2|Cl<1>,1|C<4>,1|O<2>}	H(C[6]C[6]2)	115.9120	0.000	1	115.9450	0.002	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)(C[6]O[6]C)(H)	C[6](N[6]Si[6,6]C)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)(C[6]O[6]C)(H){1|Si<6>,1|C<4>}	C[6](N[6]Si[6,6]C)(C[6]C[6]H)(CH3){1|C<4>,1|N<3>,2|N<2>,2|O<2>}	H(C[6]C[6]2)	118.6237	0.186	3	118.6237	0.035	3	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)(C[6]O[6]C)(H)	C[6](N[6]Si[6,6]C[6a])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)(C[6]O[6]C)(H){1|Si<6>,1|C<3>}	C[6](N[6]Si[6,6]C[6a])(C[6]C[6]H)(CH3){1|C<4>,1|N<3>,2|C<3>,2|N<2>,2|O<2>}	H(C[6]C[6]2)	118.6355	0.039	2	118.6355	0.002	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6]Ag)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Ag<5>,1|C<3>}	C[6](N[6]C[6]Ag)(C[6]C[6]H)(CH3){1|C<4>,1|N<2>,1|S<3>}	H(C[6]C[6]2)	123.0600	0.000	1	123.0600	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6]Cd)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Cd<6>,1|C<3>}	C[6](N[6]C[6]Cd)(C[6]C[6]H)(CH3){1|C<4>,1|N<2>,1|S<2>}	H(C[6]C[6]2)	120.6270	0.000	1	120.3890	0.063	3	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6]Cd)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Cd<6>,1|C<3>}	C[6](N[6]C[6]Cd)(C[6]C[6]H)(CH3){1|C<4>,1|N<2>,1|S<3>}	H(C[6]C[6]2)	120.2700	0.202	2	120.3890	0.063	3	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Co<6>,1|C<3>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(CH3){1|C<4>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.5050	0.208	2	120.5050	0.043	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6]Cr)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Cr<6>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Cr)(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	118.3960	0.000	1	118.3960	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Cu<4>,1|C<3>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CH3){1|C<4>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.4130	0.000	1	120.3050	0.023	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Cu<6>,1|C<4>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(CH3){1|C<4>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.1970	0.000	1	120.3050	0.023	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6]Eu)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Eu<12>,1|C<4>}	C[6](N[6]C[6]Eu)(C[6]C[6]H)(CH3){1|C<4>,1|N<2>,1|S<2>}	H(C[6]C[6]2)	120.2780	0.000	1	120.2780	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CF3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Fe<6>,1|C<3>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CF3){1|C<3>,1|C<4>,1|N<2>}	H(C[6]C[6]2)	120.3500	0.000	1	120.3500	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){2|Fe<6>,1|C<3>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(CHHN){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	121.4933	0.280	4	121.4933	0.078	4	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6]Gd)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Gd<15>,1|C<4>}	C[6](N[6]C[6]Gd)(C[6]C[6]H)(CH3){1|C<4>,1|N<2>,1|N<4>}	H(C[6]C[6]2)	120.5380	0.157	2	120.5380	0.025	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Ir<6>,1|C<3>}	C[6](N[6]C[6]Ir)(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|N<2>}	H(C[6]C[6]2)	119.3860	0.000	1	119.3860	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Mn<6>,1|C<3>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CH3){1|C<4>,1|N<2>,1|S<2>}	H(C[6]C[6]2)	120.7690	0.000	1	120.0975	0.902	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){2|Mn<6>,1|C<3>}	C[6](N[6]C[6]Mn)(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	119.4260	0.000	1	120.0975	0.902	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Ni<6>,1|C<3>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(CH3){1|C<4>,1|N<2>,1|S<2>}	H(C[6]C[6]2)	120.8432	0.203	4	120.8432	0.041	4	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Pd<4>,1|C<3>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(CH3){1|N<2>,2|C<4>}	H(C[6]C[6]2)	119.9844	0.123	5	119.9844	0.015	5	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6]Pr)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Pr<12>,1|C<4>}	C[6](N[6]C[6]Pr)(C[6]C[6]H)(CH3){1|C<4>,1|N<2>,1|S<2>}	H(C[6]C[6]2)	120.2230	0.000	1	120.2230	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6]Rh)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Rh<5>,1|C<4>}	C[6](N[6]C[6]Rh)(C[6]C[6]H)(CH3){1|C<4>,1|N<2>,1|S<2>}	H(C[6]C[6]2)	120.0370	0.000	1	120.0370	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6]Sm)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Sm<12>,1|C<4>}	C[6](N[6]C[6]Sm)(C[6]C[6]H)(CH3){1|C<4>,1|N<2>,1|S<2>}	H(C[6]C[6]2)	120.6460	0.000	1	120.6460	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6]Sn)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Sn<5>,1|C<3>}	C[6](N[6]C[6]Sn)(C[6]C[6]H)(CH3){1|C<4>,1|N<2>,1|S<2>}	H(C[6]C[6]2)	120.4760	0.000	1	120.4760	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]B[6])(C[6]C[6]H)(CBHH)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|B<3>,2|C<3>}	C[6](N[6]C[6a]B[6])(C[6]C[6]H)(CBHH){1|C<4>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	118.8370	0.000	1	118.8370	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]B[6])(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|B<3>,2|C<3>}	C[6](N[6]C[6a]B[6])(C[6]C[6]H)(CC3){1|C<4>,1|F<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	116.2200	0.040	2	116.8447	1.329	10	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]B[6])(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|B<4>,2|C<3>}	C[6](N[6]C[6a]B[6])(C[6]C[6]H)(CC3){1|C<4>,1|F<1>,1|N<3>,1|O<2>,2|C<3>}	H(C[6]C[6]2)	116.6683	1.633	4	116.8447	1.329	10	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]B[6])(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|B<4>,2|C<3>}	C[6](N[6]C[6a]B[6])(C[6]C[6]H)(CC3){1|C<4>,1|N<3>,2|C<3>,2|F<1>}	H(C[6]C[6]2)	116.7525	0.865	2	116.8447	1.329	10	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]B[6])(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|B<4>,2|C<3>}	C[6](N[6]C[6a]B[6])(C[6]C[6]H)(CC3){2|Cl<1>,1|C<4>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	117.9145	0.049	2	116.8447	1.329	10	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]B[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|B<3>,2|C<3>}	C[6](N[6]C[6a]B[6])(C[6]C[6]H)(CH3){1|C<4>,1|N<3>,1|O<2>,2|C<3>}	H(C[6]C[6]2)	118.3920	0.279	2	118.7023	0.377	11	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]B[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|B<3>,2|C<3>}	C[6](N[6]C[6a]B[6])(C[6]C[6]H)(CH3){1|C<4>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	118.4070	0.376	3	118.7023	0.377	11	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]B[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|B<4>,2|C<3>}	C[6](N[6]C[6a]B[6])(C[6]C[6]H)(CH3){1|C<4>,1|N<3>,2|C<3>,2|F<1>}	H(C[6]C[6]2)	118.9230	0.474	2	118.7023	0.377	11	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]B[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|B<4>,2|C<3>}	C[6](N[6]C[6a]B[6])(C[6]C[6]H)(CH3){1|C<4>,1|N<3>,2|C<3>,2|I<1>}	H(C[6]C[6]2)	119.7335	0.095	2	118.7023	0.377	11	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]B[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|B<4>,2|C<3>}	C[6](N[6]C[6a]B[6])(C[6]C[6]H)(CH3){2|Br<1>,1|C<4>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	118.2190	0.000	1	118.7023	0.377	11	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]B[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|B<4>,2|C<3>}	C[6](N[6]C[6a]B[6])(C[6]C[6]H)(CH3){2|Cl<1>,1|C<4>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	118.1880	0.000	1	118.7023	0.377	11	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Cr<6>,1|C<3>,1|C<4>}	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(CH3){1|C<4>,1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	119.9080	0.000	1	119.6052	1.930	5	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|H<1>,2|C<3>}	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(CH3){1|C<4>,1|N<3>,1|O<1>,2|C<3>}	H(C[6]C[6]2)	119.2810	1.853	3	119.6052	1.930	5	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){2|C<3>}	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(CH3){1|C<4>,1|N<2>,1|S<1>,2|C<3>}	H(C[6]C[6]2)	120.2750	0.000	1	119.6052	1.930	5	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Ga<2>,2|C<3>}	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CC3){1|C<4>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	113.5095	0.008	2	114.3375	0.284	8	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Ga<3>,2|C<3>}	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CC3){1|Ga<4>,1|C<4>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	114.3965	0.077	2	114.3375	0.284	8	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Ga<4>,2|C<3>}	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CC3){1|Ga<3>,1|C<4>,1|I<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	114.7550	0.037	2	114.3375	0.284	8	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Ga<4>,2|C<3>}	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CC3){1|Ga<4>,1|C<4>,1|I<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	114.6890	0.072	2	114.3375	0.284	8	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Ga<2>,2|C<3>}	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3){1|C<4>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	116.1295	0.047	2	115.8144	0.196	94	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Ga<3>,2|C<3>}	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3){1|Al<4>,1|C<4>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	116.1245	0.033	2	115.8144	0.196	94	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Ga<3>,2|C<3>}	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3){1|B<4>,1|C<4>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	115.8102	0.119	4	115.8144	0.196	94	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Ga<3>,2|C<3>}	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3){1|C<4>,1|N<3>,1|W<6>,2|C<3>}	H(C[6]C[6]2)	116.0420	0.436	2	115.8144	0.196	94	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Ga<3>,2|C<3>}	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3){1|Co<4>,1|C<4>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	115.6882	0.270	4	115.8144	0.196	94	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Ga<3>,2|C<3>}	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3){1|Ga<4>,1|C<4>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	116.0605	0.013	2	115.8144	0.196	94	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Ga<3>,2|C<3>}	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3){1|Ni<5>,1|C<4>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	116.3435	0.015	2	115.8144	0.196	94	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Ga<3>,2|C<3>}	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3){1|Ni<7>,1|C<4>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	116.0693	0.178	6	115.8144	0.196	94	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Ga<3>,2|C<3>}	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3){1|Rh<4>,1|C<4>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	116.0555	0.080	2	115.8144	0.196	94	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Ga<4>,2|C<3>}	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3){1|As<3>,1|N<3>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	115.3110	0.000	1	115.8144	0.196	94	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Ga<4>,2|C<3>}	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3){1|Bi<3>,1|N<3>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	115.8020	0.148	2	115.8144	0.196	94	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Ga<4>,2|C<3>}	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3){1|C<4>,1|H<1>,1|N<3>,1|O<2>,2|C<3>}	H(C[6]C[6]2)	115.9307	0.164	6	115.8144	0.196	94	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Ga<4>,2|C<3>}	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3){1|C<4>,1|I<1>,1|N<3>,1|P<4>,2|C<3>}	H(C[6]C[6]2)	115.0390	2.100	2	115.8144	0.196	94	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Ga<4>,2|C<3>}	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3){1|C<4>,1|N<2>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	115.4200	0.000	1	115.8144	0.196	94	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Ga<4>,2|C<3>}	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3){1|C<4>,1|N<3>,1|O<2>,1|P<3>,2|C<3>}	H(C[6]C[6]2)	115.5625	0.045	2	115.8144	0.196	94	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Ga<4>,2|C<3>}	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3){1|C<4>,1|N<3>,2|C<3>,2|I<1>}	H(C[6]C[6]2)	115.4350	0.031	2	115.8144	0.196	94	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Ga<4>,2|C<3>}	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3){1|C<4>,1|N<3>,2|C<3>,2|O<2>}	H(C[6]C[6]2)	115.8100	0.103	2	115.8144	0.196	94	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Ga<4>,2|C<3>}	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3){1|C<4>,1|O<2>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	115.2505	0.729	2	115.8144	0.196	94	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Ga<4>,2|C<3>}	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3){1|C<4>,1|P<2>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	116.1585	0.011	2	115.8144	0.196	94	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Ga<4>,2|C<3>}	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3){1|Cl<1>,1|C<4>,1|N<3>,1|O<2>,2|C<3>}	H(C[6]C[6]2)	115.5475	0.124	2	115.8144	0.196	94	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Ga<4>,2|C<3>}	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3){1|Cl<1>,1|C<4>,1|N<3>,1|P<3>,2|C<3>}	H(C[6]C[6]2)	115.8945	0.060	2	115.8144	0.196	94	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Ga<4>,2|C<3>}	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3){1|Cl<1>,1|Co<5>,1|C<4>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	115.3025	0.377	2	115.8144	0.196	94	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Ga<4>,2|C<3>}	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3){1|Cl<1>,1|N<3>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	115.7090	0.023	2	115.8144	0.196	94	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Ga<4>,2|C<3>}	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3){1|Cl<1>,1|Rh<9>,1|C<4>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	116.6190	0.000	1	115.8144	0.196	94	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Ga<4>,2|C<3>}	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3){1|Cl<1>,1|Sb<3>,1|C<4>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	115.7983	0.232	3	115.8144	0.196	94	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Ga<4>,2|C<3>}	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3){1|Cl<1>,1|Si<4>,1|C<4>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	115.2170	0.000	1	115.8144	0.196	94	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Ga<4>,2|C<3>}	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3){1|Cl<1>,1|Sn<4>,1|C<4>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	116.2392	0.089	4	115.8144	0.196	94	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Ga<4>,2|C<3>}	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3){1|In<3>,1|N<3>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	115.5658	0.034	4	115.8144	0.196	94	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Ga<4>,2|C<3>}	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3){1|In<4>,1|N<3>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	115.9025	0.012	2	115.8144	0.196	94	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Ga<4>,2|C<3>}	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3){1|N<3>,2|C<3>,3|C<4>}	H(C[6]C[6]2)	116.0230	0.211	7	115.8144	0.196	94	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Ga<4>,2|C<3>}	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3){1|N<3>,2|C<4>,3|C<3>}	H(C[6]C[6]2)	115.6295	0.047	2	115.8144	0.196	94	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Ga<4>,2|C<3>}	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3){1|Rh<9>,1|C<4>,1|N<3>,1|O<2>,2|C<3>}	H(C[6]C[6]2)	116.0370	0.132	2	115.8144	0.196	94	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Ga<4>,2|C<3>}	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3){1|Te<2>,1|N<3>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	115.2420	0.000	1	115.8144	0.196	94	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Ga<4>,2|C<3>}	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3){1|Zn<2>,1|N<3>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	116.1910	0.115	3	115.8144	0.196	94	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Ga<4>,2|C<3>}	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3){2|Cl<1>,1|C<4>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	115.3245	0.011	2	115.8144	0.196	94	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Ga<4>,2|C<3>}	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3){2|Ni<5>,1|C<4>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	116.0960	0.006	2	115.8144	0.196	94	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Ga<4>,2|C<3>}	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3){2|Te<2>,1|C<4>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	114.6685	0.074	2	115.8144	0.196	94	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Ga<4>,2|C<3>}	C[6](N[6]C[6a]Ga[6])(C[6]C[6]H)(CH3){2|Te<3>,1|C<4>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	115.7780	0.068	2	115.8144	0.196	94	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CBHH)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Ge<2>,2|C<3>}	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CBHH){1|C<4>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	115.6420	0.000	1	115.6420	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Ge<2>,2|C<3>}	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CC3){1|C<4>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	114.1440	0.000	1	114.1440	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CGe[4]HH)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Ge<3>,2|C<3>}	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CGe[4]HH){1|Cl<1>,1|C<4>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	116.5900	0.000	1	116.5900	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Ge<2>,2|C<3>}	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CH3){1|C<4>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	116.0487	0.355	3	116.4057	0.191	112	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Ge<2>,2|C<3>}	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CH3){1|N<3>,3|C<3>}	H(C[6]C[6]2)	115.3880	0.000	1	116.4057	0.191	112	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Ge<3>,2|C<3>}	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CH3){1|C<2>,1|C<4>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	116.0470	0.000	1	116.4057	0.191	112	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Ge<3>,2|C<3>}	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CH3){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	116.3515	0.049	2	116.4057	0.191	112	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Ge<3>,2|C<3>}	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CH3){1|C<4>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	116.5550	0.070	6	116.4057	0.191	112	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Ge<3>,2|C<3>}	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CH3){1|C<4>,1|N<3>,1|O<2>,2|C<3>}	H(C[6]C[6]2)	116.8044	0.387	18	116.4057	0.191	112	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Ge<3>,2|C<3>}	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CH3){1|C<4>,1|N<3>,1|P<1>,2|C<3>}	H(C[6]C[6]2)	116.2785	0.029	2	116.4057	0.191	112	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Ge<3>,2|C<3>}	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CH3){1|C<4>,1|N<3>,1|P<3>,2|C<3>}	H(C[6]C[6]2)	116.6069	0.278	10	116.4057	0.191	112	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Ge<3>,2|C<3>}	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CH3){1|C<4>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	116.1880	0.150	11	116.4057	0.191	112	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Ge<3>,2|C<3>}	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CH3){1|C<4>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	116.3114	0.334	9	116.4057	0.191	112	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Ge<3>,2|C<3>}	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CH3){1|Cl<1>,1|C<4>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	116.3498	0.326	4	116.4057	0.191	112	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Ge<3>,2|C<3>}	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CH3){1|Ge<3>,1|C<4>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	116.6490	0.113	2	116.4057	0.191	112	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Ge<3>,2|C<3>}	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CH3){1|N<3>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	117.0290	0.006	2	116.4057	0.191	112	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Ge<3>,2|C<3>}	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CH3){1|Se<2>,1|C<4>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	116.6558	0.293	6	116.4057	0.191	112	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Ge<3>,2|C<3>}	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CH3){1|Te<2>,1|C<4>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	116.8425	0.084	2	116.4057	0.191	112	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Ge<4>,2|C<3>}	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CH3){1|Ag<2>,1|C<4>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	115.7305	0.013	2	116.4057	0.191	112	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Ge<4>,2|C<3>}	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CH3){1|C<4>,1|F<1>,1|N<3>,1|S<1>,2|C<3>}	H(C[6]C[6]2)	116.2360	0.000	2	116.4057	0.191	112	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Ge<4>,2|C<3>}	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CH3){1|C<4>,1|N<3>,1|S<1>,1|S<2>,2|C<3>}	H(C[6]C[6]2)	116.3910	0.232	4	116.4057	0.191	112	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Ge<4>,2|C<3>}	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CH3){1|Cl<1>,1|C<4>,1|N<3>,1|S<1>,2|C<3>}	H(C[6]C[6]2)	116.1625	0.011	4	116.4057	0.191	112	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Ge<4>,2|C<3>}	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CH3){1|Cl<1>,1|C<4>,1|N<3>,1|W<6>,2|C<3>}	H(C[6]C[6]2)	115.9585	0.015	2	116.4057	0.191	112	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Ge<4>,2|C<3>}	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CH3){1|Cl<1>,1|Se<1>,1|C<4>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	115.8925	0.011	2	116.4057	0.191	112	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Ge<4>,2|C<3>}	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CH3){1|Fe<5>,1|C<4>,1|N<3>,1|O<2>,2|C<3>}	H(C[6]C[6]2)	116.6495	0.076	2	116.4057	0.191	112	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Ge<4>,2|C<3>}	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CH3){1|Mn<8>,1|C<4>,1|N<3>,1|O<2>,2|C<3>}	H(C[6]C[6]2)	116.3655	0.012	2	116.4057	0.191	112	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Ge<4>,2|C<3>}	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CH3){1|N<2>,2|N<3>,3|C<3>}	H(C[6]C[6]2)	114.6200	0.000	1	116.4057	0.191	112	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Ge<4>,2|C<3>}	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CH3){1|N<3>,1|O<1>,4|C<3>}	H(C[6]C[6]2)	115.3170	0.072	2	116.4057	0.191	112	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Ge<4>,2|C<3>}	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CH3){1|N<3>,1|S<1>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	116.6670	0.018	4	116.4057	0.191	112	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Ge<4>,2|C<3>}	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CH3){1|Se<1>,1|C<4>,1|N<3>,1|P<3>,2|C<3>}	H(C[6]C[6]2)	116.2795	0.167	6	116.4057	0.191	112	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CHHP)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Ge<3>,2|C<3>}	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CHHP){1|Cl<1>,1|C<4>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	116.1275	0.494	2	116.1275	0.244	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CSi[4]HH)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Ge<3>,2|C<3>}	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CSi[4]HH){1|Cl<1>,1|C<4>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	115.9900	0.000	1	115.9900	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]In[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|In<2>,2|C<3>}	C[6](N[6]C[6a]In[6])(C[6]C[6]H)(CH3){1|C<4>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	115.1475	0.101	4	114.5987	0.236	23	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]In[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|In<4>,1|C<3>,1|C<4>}	C[6](N[6]C[6a]In[6])(C[6]C[6]H)(CH3){1|C<4>,1|N<3>,2|C<3>,2|S<2>}	H(C[6]C[6]2)	114.4520	0.298	2	114.5987	0.236	23	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]In[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|In<4>,2|C<3>}	C[6](N[6]C[6a]In[6])(C[6]C[6]H)(CH3){1|Bi<3>,1|N<3>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	115.0850	0.000	1	114.5987	0.236	23	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]In[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|In<4>,2|C<3>}	C[6](N[6]C[6a]In[6])(C[6]C[6]H)(CH3){1|Br<1>,1|In<4>,1|C<4>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	115.1710	0.000	1	114.5987	0.236	23	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]In[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|In<4>,2|C<3>}	C[6](N[6]C[6a]In[6])(C[6]C[6]H)(CH3){1|Br<1>,1|N<3>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	114.7765	0.046	2	114.5987	0.236	23	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]In[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|In<4>,2|C<3>}	C[6](N[6]C[6a]In[6])(C[6]C[6]H)(CH3){1|C<4>,1|N<3>,2|C<3>,2|I<1>}	H(C[6]C[6]2)	114.0452	0.347	4	114.5987	0.236	23	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]In[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|In<4>,2|C<3>}	C[6](N[6]C[6a]In[6])(C[6]C[6]H)(CH3){1|Fe<8>,1|C<4>,1|I<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	114.2452	0.174	6	114.5987	0.236	23	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]In[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|In<4>,2|C<3>}	C[6](N[6]C[6a]In[6])(C[6]C[6]H)(CH3){1|I<1>,1|N<3>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	114.4450	0.000	1	114.5987	0.236	23	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]In[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|In<4>,2|C<3>}	C[6](N[6]C[6a]In[6])(C[6]C[6]H)(CH3){1|N<3>,2|C<3>,3|C<4>}	H(C[6]C[6]2)	115.1845	0.028	2	114.5987	0.236	23	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Nb[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Nb<4>,1|C<3>,1|C<4>}	C[6](N[6]C[6a]Nb[6])(C[6]C[6]H)(CH3){1|C<4>,1|N<3>,2|C<3>,2|N<2>}	H(C[6]C[6]2)	114.3070	0.000	1	115.1177	0.532	47	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Nb[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Nb<4>,2|C<3>}	C[6](N[6]C[6a]Nb[6])(C[6]C[6]H)(CH3){1|C<4>,1|N<2>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	113.6360	0.117	2	115.1177	0.532	47	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Nb[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Nb<4>,2|C<3>}	C[6](N[6]C[6a]Nb[6])(C[6]C[6]H)(CH3){1|C<4>,1|N<3>,2|C<3>,2|N<2>}	H(C[6]C[6]2)	114.0387	0.028	4	115.1177	0.532	47	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Nb[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Nb<5>,2|C<3>}	C[6](N[6]C[6a]Nb[6])(C[6]C[6]H)(CH3){1|C<2>,1|C<4>,1|N<2>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	115.5950	0.014	2	115.1177	0.532	47	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Nb[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Nb<5>,2|C<3>}	C[6](N[6]C[6a]Nb[6])(C[6]C[6]H)(CH3){1|C<2>,1|C<4>,1|N<3>,2|C<3>,2|N<2>}	H(C[6]C[6]2)	115.4210	0.051	3	115.1177	0.532	47	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Nb[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Nb<5>,2|C<3>}	C[6](N[6]C[6a]Nb[6])(C[6]C[6]H)(CH3){1|C<4>,1|F<1>,1|N<2>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	115.3955	0.350	6	115.1177	0.532	47	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Nb[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Nb<5>,2|C<3>}	C[6](N[6]C[6a]Nb[6])(C[6]C[6]H)(CH3){1|C<4>,1|H<1>,1|N<2>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	115.7795	0.023	2	115.1177	0.532	47	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Nb[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Nb<5>,2|C<3>}	C[6](N[6]C[6a]Nb[6])(C[6]C[6]H)(CH3){1|C<4>,1|N<2>,1|N<3>,2|C<3>,2|O<2>}	H(C[6]C[6]2)	116.0430	0.010	2	115.1177	0.532	47	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Nb[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Nb<5>,2|C<3>}	C[6](N[6]C[6a]Nb[6])(C[6]C[6]H)(CH3){1|C<4>,1|N<2>,1|N<3>,2|C<3>,2|O<3>}	H(C[6]C[6]2)	115.5040	0.058	2	115.1177	0.532	47	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Nb[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Nb<5>,2|C<3>}	C[6](N[6]C[6a]Nb[6])(C[6]C[6]H)(CH3){1|C<4>,1|N<2>,1|O<1>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	115.3435	0.006	2	115.1177	0.532	47	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Nb[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Nb<5>,2|C<3>}	C[6](N[6]C[6a]Nb[6])(C[6]C[6]H)(CH3){1|C<4>,1|N<2>,1|O<2>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	115.3193	0.365	6	115.1177	0.532	47	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Nb[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Nb<5>,2|C<3>}	C[6](N[6]C[6a]Nb[6])(C[6]C[6]H)(CH3){1|C<4>,1|N<3>,2|N<2>,3|C<3>}	H(C[6]C[6]2)	115.4073	0.378	3	115.1177	0.532	47	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Nb[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Nb<5>,2|C<3>}	C[6](N[6]C[6a]Nb[6])(C[6]C[6]H)(CH3){1|N<2>,1|N<3>,2|C<3>,3|C<4>}	H(C[6]C[6]2)	115.3307	0.102	4	115.1177	0.532	47	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Nb[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Nb<5>,2|C<3>}	C[6](N[6]C[6a]Nb[6])(C[6]C[6]H)(CH3){2|Cl<1>,1|C<4>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	116.0170	0.024	2	115.1177	0.532	47	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Nb[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Nb<6>,2|C<3>}	C[6](N[6]C[6a]Nb[6])(C[6]C[6]H)(CH3){1|C<4>,1|N<2>,1|N<3>,2|C<3>,3|C<2>}	H(C[6]C[6]2)	113.4320	0.038	2	115.1177	0.532	47	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Nb[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Nb<6>,2|C<3>}	C[6](N[6]C[6a]Nb[6])(C[6]C[6]H)(CH3){1|C<4>,1|N<2>,2|C<2>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	114.4330	0.054	2	115.1177	0.532	47	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Nb[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Nb<6>,2|C<3>}	C[6](N[6]C[6a]Nb[6])(C[6]C[6]H)(CH3){1|Li<5>,1|C<2>,2|C<3>,2|C<4>,2|N<3>}	H(C[6]C[6]2)	115.2045	0.139	2	115.1177	0.532	47	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CBHH)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Si<3>,2|C<3>}	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CBHH){1|Ni<4>,1|C<4>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	116.5130	0.134	2	116.5130	0.018	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Si<2>,2|C<3>}	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CH3){1|N<3>,3|C<3>}	H(C[6]C[6]2)	116.2130	0.000	1	116.0842	0.466	40	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Si<3>,2|C<3>}	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CH3){1|Ni<4>,1|C<4>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	116.5715	0.057	2	116.0842	0.466	40	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Si<4>,2|C<3>}	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CH3){1|Br<1>,1|C<4>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	114.7260	0.000	1	116.0842	0.466	40	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Si<4>,2|C<3>}	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CH3){1|Br<1>,2|N<3>,3|C<3>}	H(C[6]C[6]2)	115.9880	0.088	2	116.0842	0.466	40	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Si<4>,2|C<3>}	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CH3){1|Cl<1>,1|C<4>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	115.1730	0.000	1	116.0842	0.466	40	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Si<4>,2|C<3>}	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CH3){1|Cl<1>,1|N<3>,1|P<3>,3|C<3>}	H(C[6]C[6]2)	115.4010	0.000	1	116.0842	0.466	40	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Si<4>,2|C<3>}	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CH3){1|Cl<1>,1|Si<4>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	115.4220	0.000	1	116.0842	0.466	40	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Si<4>,2|C<3>}	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CH3){1|F<1>,1|N<3>,4|C<3>}	H(C[6]C[6]2)	115.7160	0.000	1	116.0842	0.466	40	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Si<4>,2|C<3>}	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CH3){1|H<1>,1|N<3>,1|O<2>,3|C<3>}	H(C[6]C[6]2)	116.0630	0.083	3	116.0842	0.466	40	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Si<4>,2|C<3>}	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CH3){1|H<1>,1|N<3>,4|C<3>}	H(C[6]C[6]2)	116.0757	0.037	3	116.0842	0.466	40	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Si<4>,2|C<3>}	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CH3){1|H<1>,2|N<3>,3|C<3>}	H(C[6]C[6]2)	115.6325	0.165	2	116.0842	0.466	40	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Si<4>,2|C<3>}	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CH3){1|N<3>,2|P<3>,3|C<3>}	H(C[6]C[6]2)	115.4590	0.000	1	116.0842	0.466	40	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Si<4>,2|C<3>}	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CH3){1|Ni<4>,1|C<4>,1|N<2>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	117.1710	0.094	3	116.0842	0.466	40	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Si<4>,2|C<3>}	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CH3){1|Ni<4>,1|C<4>,1|N<3>,1|O<2>,2|C<3>}	H(C[6]C[6]2)	117.0260	0.007	2	116.0842	0.466	40	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Si<4>,2|C<3>}	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CH3){1|Ni<4>,1|C<4>,1|N<3>,1|S<2>,2|C<3>}	H(C[6]C[6]2)	116.9215	0.025	2	116.0842	0.466	40	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Si<4>,2|C<3>}	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CH3){1|O<1>,2|N<3>,3|C<3>}	H(C[6]C[6]2)	115.5710	0.000	1	116.0842	0.466	40	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Si<4>,2|C<3>}	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CH3){1|O<2>,2|N<3>,3|C<3>}	H(C[6]C[6]2)	115.4370	0.000	1	116.0842	0.466	40	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Si<4>,2|C<3>}	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CH3){1|P<3>,2|N<3>,3|C<3>}	H(C[6]C[6]2)	115.3670	0.000	1	116.0842	0.466	40	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Si<4>,2|C<3>}	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CH3){1|Se<1>,1|C<4>,1|N<3>,1|O<2>,2|C<3>}	H(C[6]C[6]2)	117.3020	0.010	2	116.0842	0.466	40	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Si<4>,2|C<3>}	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CH3){1|Se<2>,1|C<4>,1|N<3>,1|O<2>,2|C<3>}	H(C[6]C[6]2)	116.6570	0.000	1	116.0842	0.466	40	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Si<4>,2|C<3>}	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CH3){1|Si<4>,1|N<3>,1|O<2>,3|C<3>}	H(C[6]C[6]2)	115.4700	0.000	1	116.0842	0.466	40	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Si<4>,2|C<3>}	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CH3){2|Br<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	115.6375	0.032	2	116.0842	0.466	40	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Si<4>,2|C<3>}	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CH3){2|Cl<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	115.2840	0.000	1	116.0842	0.466	40	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Si<4>,2|C<3>}	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CH3){2|N<3>,4|C<3>}	H(C[6]C[6]2)	115.9140	0.007	2	116.0842	0.466	40	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Si<4>,2|C<3>}	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CH3){3|C<3>,3|N<3>}	H(C[6]C[6]2)	116.0810	0.000	1	116.0842	0.466	40	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Si<5>,2|C<3>}	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(CH3){1|Br<2>,1|Li<5>,1|N<3>,1|N<4>,3|C<3>}	H(C[6]C[6]2)	115.4760	0.000	1	116.0842	0.466	40	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]Ga[3,3,6]C[6a])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Ga<5>,2|C<3>}	C[6](N[6]Ga[3,3,6]C[6a])(C[6]C[6]H)(CH3){1|Ga<5>,1|C<4>,1|N<3>,2|C<3>,2|O<2>}	H(C[6]C[6]2)	116.2660	0.000	1	116.2660	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]Ga[4,4,6]C[6a])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Ga<4>,2|C<3>}	C[6](N[6]Ga[4,4,6]C[6a])(C[6]C[6]H)(CH3){1|C<4>,1|N<3>,2|C<3>,2|P<3>}	H(C[6]C[6]2)	115.7750	0.108	6	115.7750	0.012	6	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]Ga[4,6]C[6a])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Ga<4>,2|C<3>}	C[6](N[6]Ga[4,6]C[6a])(C[6]C[6]H)(CH3){1|C<4>,1|N<3>,2|C<3>,2|S<2>}	H(C[6]C[6]2)	116.1830	0.025	2	115.9888	0.051	4	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]Ga[4,6]C[6a])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Ga<4>,2|C<3>}	C[6](N[6]Ga[4,6]C[6a])(C[6]C[6]H)(CH3){2|As<2>,1|C<4>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	115.7945	0.006	2	115.9888	0.051	4	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]Ga[5,5,6]C[6a])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Ga<4>,2|C<3>}	C[6](N[6]Ga[5,5,6]C[6a])(C[6]C[6]H)(CH3){1|C<4>,1|N<3>,2|C<3>,2|P<3>}	H(C[6]C[6]2)	115.7557	0.188	8	115.7557	0.035	8	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]Ga[5,6]C[6a])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Ga<4>,2|C<3>}	C[6](N[6]Ga[5,6]C[6a])(C[6]C[6]H)(CH3){1|C<4>,1|N<3>,1|P<3>,1|P<4>,2|C<3>}	H(C[6]C[6]2)	115.7922	0.110	4	115.7189	0.025	7	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]Ga[5,6]C[6a])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Ga<4>,2|C<3>}	C[6](N[6]Ga[5,6]C[6a])(C[6]C[6]H)(CH3){1|C<4>,1|N<3>,2|C<3>,2|P<3>}	H(C[6]C[6]2)	115.5165	0.006	2	115.7189	0.025	7	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]Ga[5,6]C[6a])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Ga<4>,2|C<3>}	C[6](N[6]Ga[5,6]C[6a])(C[6]C[6]H)(CH3){1|C<4>,2|C<3>,3|N<3>}	H(C[6]C[6]2)	115.8300	0.000	1	115.7189	0.025	7	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]Ge[4,6]C[6a])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Ge<4>,2|C<3>}	C[6](N[6]Ge[4,6]C[6a])(C[6]C[6]H)(CH3){1|C<4>,1|N<3>,2|C<3>,2|P<2>}	H(C[6]C[6]2)	116.6095	0.054	2	116.6095	0.003	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]Ge[6]C)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Ge<4>,2|C<4>}	C[6](N[6]Ge[6]C)(C[6]C[6]H)(CH3){1|Cl<1>,1|Cu<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	116.0785	5.595	2	116.1330	15.536	10	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]Ge[6]C)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Ge<4>,2|C<4>}	C[6](N[6]Ge[6]C)(C[6]C[6]H)(CH3){1|Cu<3>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	116.3830	4.808	2	116.1330	15.536	10	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]Ge[6]C)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Ge<4>,2|C<4>}	C[6](N[6]Ge[6]C)(C[6]C[6]H)(CH3){1|Cu<3>,1|N<3>,2|C<4>}	H(C[6]C[6]2)	116.0678	4.129	6	116.1330	15.536	10	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]In[6]C)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|In<4>,1|C<3>,1|C<4>}	C[6](N[6]In[6]C)(C[6]C[6]H)(CH3){1|C<4>,1|N<3>,2|S<2>}	H(C[6]C[6]2)	114.4225	0.282	2	114.4225	0.080	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]Nb[3,3,6,6]C[6a])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Nb<7>,2|C<3>}	C[6](N[6]Nb[3,3,6,6]C[6a])(C[6]C[6]H)(CH3){1|N<2>,1|N<3>,2|C<3>,2|C<4>,3|O<2>}	H(C[6]C[6]2)	115.6190	0.231	4	115.6190	0.053	4	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]Nb[3,3,6]C[6a])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Nb<6>,2|C<3>}	C[6](N[6]Nb[3,3,6]C[6a])(C[6]C[6]H)(CH3){1|N<2>,1|O<2>,2|C<3>,2|C<4>,2|N<3>}	H(C[6]C[6]2)	115.4962	0.254	10	115.4923	0.055	13	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]Nb[3,3,6]C[6a])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Nb<6>,2|C<3>}	C[6](N[6]Nb[3,3,6]C[6a])(C[6]C[6]H)(CH3){1|Nb<6>,1|C<4>,1|N<2>,1|N<3>,2|C<3>,2|O<2>}	H(C[6]C[6]2)	115.6960	0.000	1	115.4923	0.055	13	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]Nb[3,3,6]C[6a])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Nb<6>,2|C<3>}	C[6](N[6]Nb[3,3,6]C[6a])(C[6]C[6]H)(CH3){1|Nb<6>,1|C<4>,1|N<2>,1|N<3>,2|C<3>,2|S<2>}	H(C[6]C[6]2)	115.3710	0.025	2	115.4923	0.055	13	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]Nb[3,3,6]H)(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Nb<7>,1|H<1>}	C[6](N[6]Nb[3,3,6]H)(C[6]C[6]H)(CC3){1|Cl<1>,1|C<4>,1|N<2>,4|N<3>}	H(C[6]C[6]2)	119.0790	0.000	1	119.0790	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]Nb[3,6]C[6a])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Nb<5>,2|C<3>}	C[6](N[6]Nb[3,6]C[6a])(C[6]C[6]H)(CH3){1|N<2>,2|C<3>,2|C<4>,2|N<3>}	H(C[6]C[6]2)	114.4720	0.085	2	115.5314	0.275	16	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]Nb[3,6]C[6a])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Nb<6>,2|C<3>}	C[6](N[6]Nb[3,6]C[6a])(C[6]C[6]H)(CH3){1|B<4>,1|C<4>,1|H<1>,1|N<2>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	116.2340	0.040	2	115.5314	0.275	16	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]Nb[3,6]C[6a])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Nb<6>,2|C<3>}	C[6](N[6]Nb[3,6]C[6a])(C[6]C[6]H)(CH3){1|C<2>,1|C<4>,1|N<2>,1|N<3>,4|C<3>}	H(C[6]C[6]2)	115.5452	0.190	4	115.5314	0.275	16	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]Nb[3,6]C[6a])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Nb<6>,2|C<3>}	C[6](N[6]Nb[3,6]C[6a])(C[6]C[6]H)(CH3){1|C<2>,1|C<4>,1|N<2>,2|N<3>,3|C<3>}	H(C[6]C[6]2)	115.3590	0.171	4	115.5314	0.275	16	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]Nb[3,6]C[6a])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Nb<7>,2|C<3>}	C[6](N[6]Nb[3,6]C[6a])(C[6]C[6]H)(CH3){1|C<4>,2|N<3>,3|C<3>,3|F<1>}	H(C[6]C[6]2)	115.8683	0.192	4	115.5314	0.275	16	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]Nb[3x3,5,6]C[6a])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Nb<7>,2|C<3>}	C[6](N[6]Nb[3x3,5,6]C[6a])(C[6]C[6]H)(CH3){1|N<2>,1|N<3>,2|C<3>,5|C<4>}	H(C[6]C[6]2)	115.0705	0.115	2	115.0705	0.013	2	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]Nb[5x3,6]C[6a])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Nb<8>,2|C<3>}	C[6](N[6]Nb[5x3,6]C[6a])(C[6]C[6]H)(CH3){1|N<2>,1|N<3>,2|C<3>,6|C<4>}	H(C[6]C[6]2)	115.7560	0.067	4	115.9834	0.085	7	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]Nb[5x3,6]C[6a])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Nb<9>,2|C<3>}	C[6](N[6]Nb[5x3,6]C[6a])(C[6]C[6]H)(CH3){1|H<1>,1|N<2>,1|N<3>,2|C<3>,6|C<4>}	H(C[6]C[6]2)	116.2867	0.091	3	115.9834	0.085	7	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]Nb[6]C)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Nb<4>,1|C<3>,1|C<4>}	C[6](N[6]Nb[6]C)(C[6]C[6]H)(CH3){1|C<4>,1|N<3>,2|N<2>}	H(C[6]C[6]2)	114.4550	0.000	1	114.4550	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]Si[3,6]C[6a])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Si<5>,2|C<3>}	C[6](N[6]Si[3,6]C[6a])(C[6]C[6]H)(CH3){1|N<3>,2|O<2>,4|C<3>}	H(C[6]C[6]2)	115.8190	0.000	1	115.8190	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]Si[5,6]C[6a])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Si<4>,2|C<3>}	C[6](N[6]Si[5,6]C[6a])(C[6]C[6]H)(CH3){1|C<4>,2|N<3>,3|C<3>}	H(C[6]C[6]2)	117.4670	0.000	1	116.3321	0.812	7	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]Si[5,6]C[6a])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Si<4>,2|C<3>}	C[6](N[6]Si[5,6]C[6a])(C[6]C[6]H)(CH3){1|N<3>,2|C<4>,3|C<3>}	H(C[6]C[6]2)	115.3860	0.000	1	116.3321	0.812	7	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]Si[5,6]C[6a])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Si<4>,2|C<3>}	C[6](N[6]Si[5,6]C[6a])(C[6]C[6]H)(CH3){1|O<2>,2|N<3>,3|C<3>}	H(C[6]C[6]2)	115.6270	0.051	2	116.3321	0.812	7	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]Si[5,6]C[6a])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Si<4>,2|C<3>}	C[6](N[6]Si[5,6]C[6a])(C[6]C[6]H)(CH3){2|N<3>,4|C<3>}	H(C[6]C[6]2)	115.9110	0.000	1	116.3321	0.812	7	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]Si[5,6]C[6a])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Si<5>,2|C<3>}	C[6](N[6]Si[5,6]C[6a])(C[6]C[6]H)(CH3){1|C<4>,1|H<1>,1|O<2>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	117.1535	0.409	2	116.3321	0.812	7	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)2(H)	C[6](N[6]Si[6,6]C[6a])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]C)2(H){1|Si<4>,2|C<3>}	C[6](N[6]Si[6,6]C[6a])(C[6]C[6]H)(CH3){1|N<3>,2|C<4>,3|C<3>}	H(C[6]C[6]2)	115.0910	0.000	1	115.0910	0.000	1	119.9028	1.832	7488	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NRuHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]N)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NRuHH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.5660	0.000	1	119.5660	0.000	1	120.7024	0.777	5	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(NCoCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(NCoCN){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	122.0450	0.000	1	122.0450	0.000	1	120.7024	0.777	5	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NNi2C)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(NNi2C){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6310	0.020	2	120.6310	0.000	2	120.7024	0.777	5	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NRuHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NRuHH){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.6390	0.000	1	120.6390	0.000	1	120.7024	0.777	5	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:P-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	C[6](N[6]C[6]Ag)(C[6]C[6]H)(PC[6]2O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Ag<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ag)(C[6]C[6]H)(PC[6]2O){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.7833	0.390	3	120.7833	0.152	3	120.6651	0.196	68	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:P-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	C[6](N[6]C[6]Co)(C[6]C[6]H)(PC[6]2O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(C[6]C[6]H)(PC[6]2O){1|C<3>,2|H<1>}	H(C[6]C[6]2)	121.2033	0.577	3	121.2033	0.333	3	120.6651	0.196	68	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:P-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(PC[6]2Cu)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(PC[6]2Cu){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.7957	0.010	3	120.7957	0.000	3	120.6651	0.196	68	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:P-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(PC[6]2O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(PC[6]2O){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.7761	0.233	21	120.7761	0.055	21	120.6651	0.196	68	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:P-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(PC[6]2S)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(PC[6]2S){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.7481	0.411	9	120.7481	0.169	9	120.6651	0.196	68	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:P-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(PC[6]CO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(PC[6]CO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4639	0.504	17	120.4639	0.254	17	120.6651	0.196	68	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:P-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(PC[6]CuO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(PC[6]CuO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.7295	0.030	2	120.7295	0.001	2	120.6651	0.196	68	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:P-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(PC[6]2O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(PC[6]2O){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3683	0.041	3	120.3683	0.002	3	120.6651	0.196	68	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:P-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(PC[6a]2N)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Fe<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(PC[6a]2N){1|C<3>,1|H<1>,1|P<4>}	H(C[6]C[6]2)	120.4860	0.313	4	120.4860	0.098	4	120.6651	0.196	68	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:P-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	C[6](N[6]C[6]Mo)(C[6]C[6]H)(PC[6]2Mo)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Mo<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mo)(C[6]C[6]H)(PC[6]2Mo){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.9370	1.055	2	119.9370	1.113	2	120.6651	0.196	68	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:P-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(PC[6a]2N)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(PC[6a]2N){1|H<1>,2|C<3>}	H(C[6]C[6]2)	121.5820	0.000	1	121.5820	0.000	1	120.6651	0.196	68	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:S-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](N[6]C[6]Ni)(C[6]C[6]H)(SNi3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(C[6]C[6]H)(SNi3){1|C<3>,2|H<1>}	H(C[6]C[6]2)	121.0840	0.034	3	121.0840	0.001	3	120.9586	0.032	5	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:S-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]S)(H)	C[6](N[6]C[6]Pd)(C[6]C[6]H)(SPdOO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]S)(H){1|Pd<5>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Pd)(C[6]C[6]H)(SPdOO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.7705	0.080	2	120.7705	0.006	2	120.9586	0.032	5	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:Si-4:	C[6]-3:	C[6](C[6]N[6]Si)(C[6]C[6]H)(H)	C[6](N[6]C[6]Al)(C[6]C[6]H)(SiC3)	H(C[6]C[6]2)	C[6](C[6]N[6]Si)(C[6]C[6]H)(H){1|Al<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Al)(C[6]C[6]H)(SiC3){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.4040	0.000	1	119.4040	0.000	1	119.5201	0.822	17	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:Si-4:	C[6]-3:	C[6](C[6]N[6]Si)(C[6]C[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(SiC3)	H(C[6]C[6]2)	C[6](C[6]N[6]Si)(C[6]C[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(SiC3){1|C<3>,2|H<1>}	H(C[6]C[6]2)	117.7055	1.925	2	117.7055	3.707	2	119.5201	0.822	17	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:Si-4:	C[6]-3:	C[6](C[6]N[6]Si)(C[6]C[6]H)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(SiC[6]CC)	H(C[6]C[6]2)	C[6](C[6]N[6]Si)(C[6]C[6]H)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(SiC[6]CC){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8825	0.397	8	119.7876	0.142	14	119.5201	0.822	17	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:Si-4:	C[6]-3:	C[6](C[6]N[6]Si)(C[6]C[6]H)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(SiC[6]CC)	H(C[6]C[6]2)	C[6](C[6]N[6]Si)(C[6]C[6]H)(H){1|Pt<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(SiC[6]CC){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.6610	0.340	6	119.7876	0.142	14	119.5201	0.822	17	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	O[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[5,6]C)(C[6]O[6]C)(H)	C[6](O[6]Ga[5,6,6]Li)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[5,6]C)(C[6]O[6]C)(H){1|Ga<6>,1|Li<6>,1|C<4>}	C[6](O[6]Ga[5,6,6]Li)(C[6]C[6]H)(CH3){1|Cl<1>,1|C<4>,1|O<3>,2|N<3>}	H(C[6]C[6]2)	116.6960	0.025	2	116.6960	0.001	2	116.6960	0.001	2	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	P[5,6,6]-3:C[6]-3:Si-4:	C[6]-3:	C[6](C[6]P[5,6,6]Si)(C[6]C[6]H)(H)	C[6](P[5,6,6]C[5,3x6]P[3,5,6])(C[6]C[6]H)(SiC3)	H(C[6]C[6]2)	C[6](C[6]P[5,6,6]Si)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|P<3>}	C[6](P[5,6,6]C[5,3x6]P[3,5,6])(C[6]C[6]H)(SiC3){1|H<1>,1|P<3>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	120.4440	0.000	1	120.4440	0.000	1	120.4440	0.000	1	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	P[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]P[6]C)(H)	C[6](P[6]C[6]Cu)(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]P[6]C)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](P[6]C[6]Cu)(C[6]C[6]H)(CCHH){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	118.0100	0.180	2	118.0100	0.032	2	117.7242	0.123	4	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	P[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]P[6]C)(H)	C[6](P[6]C[6]Mn)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]P[6]C)(H){1|Mn<5>,1|H<1>,3|C<3>}	C[6](P[6]C[6]Mn)(C[6]C[6]H)(CH3){1|C<4>,2|C<3>}	H(C[6]C[6]2)	117.4385	0.105	2	117.4385	0.011	2	117.7242	0.123	4	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:C[6]-3:H-1:	P[6]-3:C[6]-3:Si-4:	C[6]-3:	C[6](C[6]P[6]Si)(C[6]C[6]H)(H)	C[6](P[6]C[6]Ru)(C[6]C[6]H)(SiC3)	H(C[6]C[6]2)	C[6](C[6]P[6]Si)(C[6]C[6]H)(H){1|Ru<6>,1|C<3>,1|C<4>}	C[6](P[6]C[6]Ru)(C[6]C[6]H)(SiC3){1|C<3>,1|H<1>,1|P<4>}	H(C[6]C[6]2)	116.1647	0.651	3	116.1647	0.424	3	116.1647	0.424	3	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:N[6]-3:H-1:	C[6,6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6]C)(N[6]C[6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]N[6]H)(CHHO)	H(C[6]C[6]N[6])	C[6](C[6]C[6,6]C)(N[6]C[6]H)(H){1|C<3>,2|C<4>}	C[6](C[6,6]C[6,6]C[6])(C[6]N[6]H)(CHHO){1|C<3>,2|H<1>,3|O<2>}	H(C[6]C[6]N[6])	119.8880	0.000	1	119.8880	0.000	1	119.8880	0.000	1	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:N[6]-3:H-1:	C[6,6a]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]C)(N[6]S[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(CCHH)	H(C[6]C[6]N[6])	C[6](C[6]C[6,6a]C)(N[6]S[6]C)(H){2|C<3>,2|O<1>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(CCHH){1|C<4>,1|H<1>,1|S<4>,2|C<3>}	H(C[6]C[6]N[6])	117.6800	0.250	2	117.6800	0.063	2	117.6800	0.063	2	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:B-4:	C[6]-3:	C[6](C[6]C[6]B)(N[6]C[6]B)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(BN[6]CC)	H(C[6]C[6]N[6])	C[6](C[6]C[6]B)(N[6]C[6]B)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(BN[6]CC){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6710	1.120	2	118.6710	1.255	2	118.6710	1.255	2	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]2)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]2)(H){2|H<1>,3|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|H<1>,2|C<3>}	H(C[6]C[6]N[6])	119.9090	0.000	1	119.9090	0.000	1	120.1000	4.104	390	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]B)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]B)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|B<3>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	118.8715	0.129	2	118.8715	0.017	2	120.1000	4.104	390	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]C)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(CH3){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	118.8940	0.123	2	118.8940	0.015	2	120.1000	4.104	390	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CCHH)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CCHH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	118.7140	0.000	1	118.7140	0.000	1	120.1000	4.104	390	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CF3)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]C)(H){1|As<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CF3){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	119.4000	0.000	1	119.4000	0.000	1	120.1000	4.104	390	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	119.2070	0.000	1	119.5978	1.036	29	120.1000	4.104	390	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]C)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	122.5630	0.000	1	119.5978	1.036	29	120.1000	4.104	390	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]C)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	119.3300	0.000	1	119.5978	1.036	29	120.1000	4.104	390	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	119.7246	1.179	10	119.5978	1.036	29	120.1000	4.104	390	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|C<3>,2|C<4>}	H(C[6]C[6]N[6])	119.4945	0.337	8	119.5978	1.036	29	120.1000	4.104	390	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|C<4>,2|C<3>}	H(C[6]C[6]N[6])	119.7208	0.236	6	119.5978	1.036	29	120.1000	4.104	390	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]C)(H){2|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|C<3>,2|C<4>}	H(C[6]C[6]N[6])	117.8545	0.035	2	119.5978	1.036	29	120.1000	4.104	390	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHN)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHN){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	119.4290	0.142	3	119.4290	0.020	3	120.1000	4.104	390	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHO)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHO){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	119.5269	0.187	7	119.5269	0.035	7	120.1000	4.104	390	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]C)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]C)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(CH3){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	118.5563	0.111	3	118.5563	0.012	3	120.1000	4.104	390	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]C)(H)	C[6](C[6]C[6]O)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]C)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]O)(C[6]N[6]H)(CH3){1|C<4>,2|C<3>}	H(C[6]C[6]N[6])	118.9590	0.000	1	118.9590	0.000	1	120.1000	4.104	390	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]C)(H)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(CH3){2|C<4>,3|C<3>}	H(C[6]C[6]N[6])	119.4021	0.192	12	119.4021	0.037	12	120.1000	4.104	390	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]C)(H)	C[6](C[6]N[6]H)(C[6]N[6]N)(CN[6]HH)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]C)(H){1|C<4>,1|N<2>,1|N<3>}	C[6](C[6]N[6]H)(C[6]N[6]N)(CN[6]HH){1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	119.4663	3.015	4	119.4663	9.090	4	120.1000	4.104	390	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]C)(H)	C[6](C[6]N[6]H)(C[6]N[6]O)(CH3)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]C)(H){1|N<2>,2|O<1>}	C[6](C[6]N[6]H)(C[6]N[6]O)(CH3){1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	123.1280	0.000	1	120.2720	6.118	3	120.1000	4.104	390	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]C)(H)	C[6](C[6]N[6]H)(C[6]N[6]O)(CH3)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]C)(H){1|N<3>,1|O<1>,1|O<2>}	C[6](C[6]N[6]H)(C[6]N[6]O)(CH3){1|Pd<4>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	118.8440	0.041	2	120.2720	6.118	3	120.1000	4.104	390	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]D)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]D)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|C<3>,1|D<1>,1|H<1>}	H(C[6]C[6]N[6])	119.7190	0.000	1	119.7190	0.000	1	120.1000	4.104	390	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]H)(H)	C[6](C[6]C[5]C[6])(C[6]N[6]H)(CHHO)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]H)(H){1|C<4>,2|C<3>}	C[6](C[6]C[5]C[6])(C[6]N[6]H)(CHHO){1|C<3>,1|H<1>,1|O<2>,2|N<2>}	H(C[6]C[6]N[6])	119.4520	0.000	1	119.4520	0.000	1	120.1000	4.104	390	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]H)(H)	C[6](C[6]C[6]2)(C[6]N[6]H)(CCHH)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]2)(C[6]N[6]H)(CCHH){1|C<4>,2|C<3>,3|H<1>}	H(C[6]C[6]N[6])	118.9320	0.000	1	118.9320	0.000	1	120.1000	4.104	390	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(CH3){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	119.8574	1.655	23	119.9268	2.737	24	120.1000	4.104	390	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]H)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(CH3){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	121.5240	0.000	1	119.9268	2.737	24	120.1000	4.104	390	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(CHHO)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]H)(H){1|C<3>,2|C<4>}	C[6](C[6]C[6]C)(C[6]N[6]H)(CHHO){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]N[6])	119.9554	0.327	10	120.5916	2.149	18	120.1000	4.104	390	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(CHHO)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]H)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6]C)(C[6]N[6]H)(CHHO){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]N[6])	121.3869	1.944	8	120.5916	2.149	18	120.1000	4.104	390	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CCHH)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CCHH){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	122.2760	3.953	2	122.2760	15.624	2	120.1000	4.104	390	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CClHH)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CClHH){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	119.9500	0.000	1	119.9500	0.000	1	120.1000	4.104	390	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CF3)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CF3){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	120.1414	0.065	5	120.1414	0.004	5	120.1000	4.104	390	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]H)(H){1|Br<1>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	119.2130	0.000	1	120.8044	5.852	129	120.1000	4.104	390	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	121.1680	1.652	7	120.8044	5.852	129	120.1000	4.104	390	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	121.2675	2.904	2	120.8044	5.852	129	120.1000	4.104	390	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	120.0977	2.060	38	120.8044	5.852	129	120.1000	4.104	390	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	121.1861	1.941	49	120.8044	5.852	129	120.1000	4.104	390	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	121.1773	3.502	29	120.8044	5.852	129	120.1000	4.104	390	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|H<1>,2|C<3>}	H(C[6]C[6]N[6])	119.5460	0.000	1	120.8044	5.852	129	120.1000	4.104	390	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]H)(H){1|Cl<1>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]N[6])	120.2040	0.000	1	120.8044	5.852	129	120.1000	4.104	390	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	118.1200	0.000	1	120.8044	5.852	129	120.1000	4.104	390	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHN)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHN){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	119.8954	1.140	33	119.8954	1.300	33	120.1000	4.104	390	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHO)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHO){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	123.8485	2.050	2	123.8485	4.202	2	120.1000	4.104	390	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHP)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHP){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	119.8120	0.000	1	119.8120	0.000	1	120.1000	4.104	390	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHS)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHS){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	117.5183	5.018	3	117.5183	25.182	3	120.1000	4.104	390	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CN[5a]HH)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CN[5a]HH){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	119.9400	0.000	1	119.9400	0.000	1	120.1000	4.104	390	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CN[6]CH)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CN[6]CH){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	119.9940	0.661	4	119.9940	0.436	4	120.1000	4.104	390	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]N[6]H)(CH3){2|H<1>,3|C<3>}	H(C[6]C[6]N[6])	119.2690	0.000	1	119.2690	0.000	1	120.1000	4.104	390	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]H)(H)	C[6](C[6]N[6]H)(C[6]N[6]N)(CC[6a]HH)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]H)(H){1|N<2>,2|N<3>}	C[6](C[6]N[6]H)(C[6]N[6]N)(CC[6a]HH){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	120.7697	2.607	27	120.7697	6.795	27	120.1000	4.104	390	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]H)(H)	C[6](C[6]N[6]H)(C[6]N[6]N)(CN[5]HH)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]H)(H){1|C<4>,1|N<2>,1|N<3>}	C[6](C[6]N[6]H)(C[6]N[6]N)(CN[5]HH){1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.9369	1.310	9	119.9369	1.715	9	120.1000	4.104	390	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]H)(H)	C[6](C[6]N[6]H)(C[6]N[6]O)(CCHH)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]H)(H){1|N<3>,1|O<1>,1|S<1>}	C[6](C[6]N[6]H)(C[6]N[6]O)(CCHH){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	118.7220	0.139	2	118.7220	0.019	2	120.1000	4.104	390	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]H)(H)	C[6](C[6]N[6]H)(C[6]N[6]O)(CH3)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]H)(H){1|N<3>,1|O<1>,1|S<1>}	C[6](C[6]N[6]H)(C[6]N[6]O)(CH3){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	120.3855	3.213	4	120.3855	10.325	4	120.1000	4.104	390	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]N[6])	124.0540	0.000	1	124.0540	0.000	1	120.1000	4.104	390	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CCHP)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]O)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CCHP){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]N[6])	119.1780	0.000	1	119.1780	0.000	1	120.1000	4.104	390	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CC[6a]HN)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]O)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CC[6a]HN){1|C<3>,1|C<4>,1|O<1>}	H(C[6]C[6]N[6])	119.6845	0.081	2	119.6845	0.007	2	120.1000	4.104	390	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]O)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|C<3>,1|C<4>,1|O<1>}	H(C[6]C[6]N[6])	119.3700	0.007	2	119.8192	2.375	14	120.1000	4.104	390	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]O)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]N[6])	119.4592	0.348	8	119.8192	2.375	14	120.1000	4.104	390	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]O)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]N[6])	119.1930	0.000	1	119.8192	2.375	14	120.1000	4.104	390	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]O)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|C<3>,1|H<1>,1|O<3>}	H(C[6]C[6]N[6])	119.3845	0.049	2	119.8192	2.375	14	120.1000	4.104	390	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]O)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|C<3>,1|N<3>,1|O<1>}	H(C[6]C[6]N[6])	125.0930	0.000	1	119.8192	2.375	14	120.1000	4.104	390	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]O)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(CH3){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]N[6])	118.2904	0.525	30	118.2841	0.268	31	120.1000	4.104	390	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]O)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]O)(H){1|C<3>,1|N<2>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(CH3){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]N[6])	118.0950	0.000	1	118.2841	0.268	31	120.1000	4.104	390	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]O)(H)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]O)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(CH3){1|C<4>,1|O<1>,3|C<3>}	H(C[6]C[6]N[6])	119.0210	0.000	2	119.0210	0.000	2	120.1000	4.104	390	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]U)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]U)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|U<16>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	120.0910	0.000	1	120.0910	0.000	1	120.1000	4.104	390	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:N-4:	C[6]-3:	C[6](C[6]C[6]N)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(NH3)	H(C[6]C[6]N[6])	C[6](C[6]C[6]N)(N[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(NH3){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	121.7388	2.125	4	121.7388	4.515	4	120.9907	2.811	9	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:N-4:	C[6]-3:	C[6](C[6]C[6]N)(N[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(NH3)	H(C[6]C[6]N[6])	C[6](C[6]C[6]N)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(NH3){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	120.3922	1.108	5	120.3922	1.228	5	120.9907	2.811	9	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:P-4:	C[6]-3:	C[6](C[6]C[6]P)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(PO3)	H(C[6]C[6]N[6])	C[6](C[6]C[6]P)(N[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(PO3){1|C<3>,1|H<1>,1|P<4>}	H(C[6]C[6]N[6])	120.0990	0.287	2	119.8703	0.080	6	119.8703	0.080	6	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:P-4:	C[6]-3:	C[6](C[6]C[6]P)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(PO3)	H(C[6]C[6]N[6])	C[6](C[6]C[6]P)(N[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(PO3){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	119.4820	0.000	1	119.8703	0.080	6	119.8703	0.080	6	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:P-4:	C[6]-3:	C[6](C[6]C[6]P)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(PO3)	H(C[6]C[6]N[6])	C[6](C[6]C[6]P)(N[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(PO3){1|H<1>,2|C<3>}	H(C[6]C[6]N[6])	120.0290	0.000	1	119.8703	0.080	6	119.8703	0.080	6	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:P-4:	C[6]-3:	C[6](C[6]C[6]P)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(PO3)	H(C[6]C[6]N[6])	C[6](C[6]C[6]P)(N[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(PO3){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	119.7565	0.094	2	119.8703	0.080	6	119.8703	0.080	6	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:S-4:	C[6]-3:	C[6](C[6]C[6]S)(N[6]C[6]C)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(SNOO)	H(C[6]C[6]N[6])	C[6](C[6]C[6]S)(N[6]C[6]C)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(SNOO){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	118.8610	0.031	2	118.8610	0.001	2	120.0317	2.979	12	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:S-4:	C[6]-3:	C[6](C[6]C[6]S)(N[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(SO3)	H(C[6]C[6]N[6])	C[6](C[6]C[6]S)(N[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(SO3){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	119.7530	0.000	1	119.7530	0.000	1	120.0317	2.979	12	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:S-4:	C[6]-3:	C[6](C[6]C[6]S)(N[6]C[6]H)(H)	C[6](C[6]C[6]Cl)(C[6]N[6]H)(SO3)	H(C[6]C[6]N[6])	C[6](C[6]C[6]S)(N[6]C[6]H)(H){1|Cl<1>,1|C<3>,1|H<1>}	C[6](C[6]C[6]Cl)(C[6]N[6]H)(SO3){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	119.5660	0.000	1	119.5660	0.000	1	120.0317	2.979	12	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:S-4:	C[6]-3:	C[6](C[6]C[6]S)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(SO3)	H(C[6]C[6]N[6])	C[6](C[6]C[6]S)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(SO3){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	119.6740	0.000	2	120.7627	3.556	3	120.0317	2.979	12	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:S-4:	C[6]-3:	C[6](C[6]C[6]S)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(SO3)	H(C[6]C[6]N[6])	C[6](C[6]C[6]S)(N[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(SO3){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	122.9400	0.000	1	120.7627	3.556	3	120.0317	2.979	12	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:S-4:	C[6]-3:	C[6](C[6]C[6]S)(N[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(SNOO)	H(C[6]C[6]N[6])	C[6](C[6]C[6]S)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(SNOO){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	119.3560	0.240	2	119.3560	0.058	2	120.0317	2.979	12	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:S-4:	C[6]-3:	C[6](C[6]C[6]S)(N[6]C[6]H)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(SO3)	H(C[6]C[6]N[6])	C[6](C[6]C[6]S)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(SO3){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	119.0300	0.048	2	119.0300	0.002	2	120.0317	2.979	12	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:S-4:	C[6]-3:	C[6](C[6]C[6]S)(N[6]C[6]H)(H)	C[6](C[6]C[6]O)(C[6]N[6]H)(SO3)	H(C[6]C[6]N[6])	C[6](C[6]C[6]S)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]O)(C[6]N[6]H)(SO3){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	124.2790	0.000	1	124.2790	0.000	1	120.0317	2.979	12	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:Si-4:	C[6]-3:	C[6](C[6]C[6]Si)(N[6]C[6]C)(H)	C[6](C[6]C[6]O)(C[6]N[6]H)(SiC3)	H(C[6]C[6]N[6])	C[6](C[6]C[6]Si)(N[6]C[6]C)(H){1|H<1>,1|O<1>,2|C<4>}	C[6](C[6]C[6]O)(C[6]N[6]H)(SiC3){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6]N[6])	116.8070	0.000	1	116.8070	0.000	1	117.9810	0.840	23	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:Si-4:	C[6]-3:	C[6](C[6]C[6]Si)(N[6]C[6]Fe)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(SiC3)	H(C[6]C[6]N[6])	C[6](C[6]C[6]Si)(N[6]C[6]Fe)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(SiC3){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.1820	0.000	1	117.1820	0.000	1	117.9810	0.840	23	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:Si-4:	C[6]-3:	C[6](C[6]C[6]Si)(N[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(SiSiCC)	H(C[6]C[6]N[6])	C[6](C[6]C[6]Si)(N[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(SiSiCC){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	118.9760	0.000	1	118.9760	0.000	1	117.9810	0.840	23	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:Si-4:	C[6]-3:	C[6](C[6]C[6]Si)(N[6]C[6]Ir)(H)	C[6](C[6]N[6]H)2(SiC3)	H(C[6]C[6]N[6])	C[6](C[6]C[6]Si)(N[6]C[6]Ir)(H){1|N<3>,2|H<1>}	C[6](C[6]N[6]H)2(SiC3){2|Ir<6>,1|C<3>}	H(C[6]C[6]N[6])	118.6700	0.376	6	118.6700	0.142	6	117.9810	0.840	23	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:Si-4:	C[6]-3:	C[6](C[6]C[6]Si)(N[6]C[6]Pd)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(SiC3)	H(C[6]C[6]N[6])	C[6](C[6]C[6]Si)(N[6]C[6]Pd)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(SiC3){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4285	0.282	2	118.4285	0.080	2	117.9810	0.840	23	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:Si-4:	C[6]-3:	C[6](C[6]C[6]Si)(N[6]C[6]Pd)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(SiC[6]2C)	H(C[6]C[6]N[6])	C[6](C[6]C[6]Si)(N[6]C[6]Pd)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(SiC[6]2C){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2959	0.276	7	118.2959	0.076	7	117.9810	0.840	23	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C[6]-3:Si-4:	C[6]-3:	C[6](C[6]C[6]Si)(N[6]N[6]Re)(H)	C[6](C[6]C[6]Si)(C[6]N[6]H)(SiC3)	H(C[6]C[6]N[6])	C[6](C[6]C[6]Si)(N[6]N[6]Re)(H){1|Re<6>,1|Si<4>,1|C<3>}	C[6](C[6]C[6]Si)(C[6]N[6]H)(SiC3){1|Re<6>,1|H<1>,1|N<3>}	H(C[6]C[6]N[6])	116.7302	0.784	5	116.7302	0.614	5	117.9810	0.840	23	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6]C)(H)	C[6](C[6]N[6]H)(N[6]C[6]C)(CH3)	H(C[6]C[6]N[6])	C[6](C[6]N[6]C)(N[6]C[6]C)(H){1|C<4>,2|C<3>}	C[6](C[6]N[6]H)(N[6]C[6]C)(CH3){1|H<1>,2|C<3>}	H(C[6]C[6]N[6])	119.3125	0.101	2	119.3125	0.010	2	119.2481	0.496	19	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6]C)(H)	C[6](C[6]N[6]H)(N[6]C[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](C[6]N[6]C)(N[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]N[6]H)(N[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	120.1480	0.000	1	120.1480	0.000	1	119.2481	0.496	19	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6]H)(H)	C[6](C[6]N[6]H)(N[6]C[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](C[6]N[6]C)(N[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]N[6]H)(N[6]C[6]H)(CH3){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	120.9300	0.450	2	120.9300	0.202	2	119.2481	0.496	19	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6]O)(H)	C[6](C[6]N[6]H)(N[6]C[6]O)(CH3)	H(C[6]C[6]N[6])	C[6](C[6]N[6]C)(N[6]C[6]O)(H){1|C<3>,1|C<4>,1|O<1>}	C[6](C[6]N[6]H)(N[6]C[6]O)(CH3){1|C<3>,1|C<4>,1|O<1>}	H(C[6]C[6]N[6])	119.0770	0.000	1	118.9344	0.066	14	119.2481	0.496	19	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6]O)(H)	C[6](C[6]N[6]H)(N[6]C[6]O)(CH3)	H(C[6]C[6]N[6])	C[6](C[6]N[6]C)(N[6]C[6]O)(H){1|C<3>,1|C<4>,1|O<1>}	C[6](C[6]N[6]H)(N[6]C[6]O)(CH3){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]N[6])	118.7022	0.187	6	118.9344	0.066	14	119.2481	0.496	19	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6]O)(H)	C[6](C[6]N[6]H)(N[6]C[6]O)(CH3)	H(C[6]C[6]N[6])	C[6](C[6]N[6]C)(N[6]C[6]O)(H){1|C<3>,1|C<4>,1|O<1>}	C[6](C[6]N[6]H)(N[6]C[6]O)(CH3){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]N[6])	119.0840	0.000	1	118.9344	0.066	14	119.2481	0.496	19	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6]O)(H)	C[6](C[6]N[6]H)(N[6]C[6]O)(CH3)	H(C[6]C[6]N[6])	C[6](C[6]N[6]C)(N[6]C[6]O)(H){1|C<3>,1|C<4>,1|O<2>}	C[6](C[6]N[6]H)(N[6]C[6]O)(CH3){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]N[6])	119.2480	0.000	1	118.9344	0.066	14	119.2481	0.496	19	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6]O)(H)	C[6](C[6]N[6]H)(N[6]C[6]O)(CH3)	H(C[6]C[6]N[6])	C[6](C[6]N[6]C)(N[6]C[6]O)(H){1|C<3>,1|C<4>,1|O<2>}	C[6](C[6]N[6]H)(N[6]C[6]O)(CH3){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]N[6])	118.8300	0.000	1	118.9344	0.066	14	119.2481	0.496	19	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6]O)(H)	C[6](C[6]N[6]H)(N[6]C[6]O)(CH3)	H(C[6]C[6]N[6])	C[6](C[6]N[6]C)(N[6]C[6]O)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]N[6]H)(N[6]C[6]O)(CH3){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]N[6])	119.1573	0.067	4	118.9344	0.066	14	119.2481	0.496	19	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:N[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]C)(N[6]C[6]C)(H)	C[6](N[6]C[6a]C[6])(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](C[6]N[6]C)(N[6]C[6]C)(H){1|C<4>,1|H<1>,2|C<3>}	C[6](N[6]C[6a]C[6])(C[6]N[6]H)(CH3){1|C<4>,1|O<1>,3|C<3>}	H(C[6]C[6]N[6])	119.7160	0.000	1	119.7160	0.000	1	119.7160	0.000	1	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	C[6]-3:P[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(P[6]C[6]W)(H)	C[6](C[6]C[6]C)(C[6]P[6]H)(CH3)	H(C[6]C[6]P[6])	C[6](C[6]C[6]C)(P[6]C[6]W)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6]C)(C[6]P[6]H)(CH3){1|C<3>,1|H<1>,1|W<6>}	H(C[6]C[6]P[6])	117.6947	0.057	3	117.6947	0.003	3	117.6947	0.003	3	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[5,6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6,6a]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[5,6]H)(CC3)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]C[6,6a]C)(H){1|O<1>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[5,6]H)(CC3){1|H<1>,4|C<3>}	H(C[6]N[5,6]C[6])	118.6840	0.000	1	118.6840	0.000	1	118.6840	0.000	1	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[5,6]C[5,6]B[5])(C[6]C[6]C)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(CF3)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]B[5])(C[6]C[6]C)(H){2|Br<1>,1|H<1>,3|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(CF3){1|B<4>,1|C<3>,1|H<1>}	H(C[6]N[5,6]C[6])	119.6680	0.000	1	119.6680	0.000	1	118.9625	0.514	13	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[5,6]C[5,6]B[5])(C[6]C[6]C)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(CH3)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]B[5])(C[6]C[6]C)(H){1|Cl<1>,1|H<1>,2|C<3>,2|C<4>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(CH3){1|B<4>,1|C<3>,1|C<4>}	H(C[6]N[5,6]C[6])	119.3455	0.019	2	119.3455	0.000	2	118.9625	0.514	13	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]C)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(CF3)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]C)(H){1|C<3>,1|C<4>,1|N<3>,3|H<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(CF3){1|C<3>,1|C<4>,1|H<1>}	H(C[6]N[5,6]C[6])	120.5180	0.000	1	120.5180	0.000	1	118.9625	0.514	13	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]C)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(CH3)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]C)(H){1|Si<5>,1|C<3>,1|O<2>,3|H<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|N<3>}	H(C[6]N[5,6]C[6])	119.1077	0.195	4	119.1077	0.038	4	118.9625	0.514	13	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[5,6]C[5,6]In[5])(C[6]C[6]C)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(CH3)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]In[5])(C[6]C[6]C)(H){3|Cl<1>,1|H<1>,1|N<3>,1|O<2>,2|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(CH3){1|In<6>,1|C<3>,1|H<1>}	H(C[6]N[5,6]C[6])	118.1187	0.113	3	118.2408	0.037	5	118.9625	0.514	13	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[5,6]C[5,6]In[5])(C[6]C[6]C)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]H)(CH3)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]In[5])(C[6]C[6]C)(H){3|Cl<1>,1|H<1>,1|N<3>,1|O<3>,2|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]H)(CH3){1|In<6>,1|C<3>,1|H<1>}	H(C[6]N[5,6]C[6])	118.4240	0.103	2	118.2408	0.037	5	118.9625	0.514	13	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[5a,6]C[5a,6a]C[5a,6])(C[6]C[6]C)(H)	C[6](C[6]N[5a,6]H)(C[6]C[6]C)(CH3)	H(C[6]N[5a,6]C[6])	C[6](N[5a,6]C[5a,6a]C[5a,6])(C[6]C[6]C)(H){1|N<2>,4|C<3>}	C[6](C[6]N[5a,6]H)(C[6]C[6]C)(CH3){3|C<3>}	H(C[6]N[5a,6]C[6])	119.9230	0.000	1	119.9230	0.000	1	120.0825	0.051	2	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[5a,6]C[5a,6a]C[5a,6])(C[6]C[6]C)(H)	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(CH3)	H(C[6]N[5a,6]C[6])	C[6](N[5a,6]C[5a,6a]C[5a,6])(C[6]C[6]C)(H){1|H<1>,1|N<2>,3|C<3>}	C[6](C[6]N[5a,6]H)(C[6]C[6]H)(CH3){1|H<1>,2|C<3>}	H(C[6]N[5a,6]C[6])	120.2420	0.000	1	120.2420	0.000	1	120.0825	0.051	2	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[5a,6]-3:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](N[5a,6]C[5a,6a]C[5a,6])(C[6]N[6]C)(H)	C[6](C[6]N[5a,6]H)(N[6]C[6]O)(CH3)	H(C[6]N[5a,6]C[6])	C[6](N[5a,6]C[5a,6a]C[5a,6])(C[6]N[6]C)(H){1|O<1>,4|C<3>}	C[6](C[6]N[5a,6]H)(N[6]C[6]O)(CH3){1|C<4>,2|C<3>}	H(C[6]N[5a,6]C[6])	119.7310	0.000	1	119.7310	0.000	1	119.7310	0.000	1	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[5a,6]-3:C[6]-3:H-1:	N[5,6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[5a,6]C[5a,6a]C[5a,6])(C[6]N[5,6]C)(H)	C[6](N[5,6]C[5,6a]C[5,6])(C[6]N[5a,6]H)(CH3)	H(C[6]N[5a,6]C[6])	C[6](N[5a,6]C[5a,6a]C[5a,6])(C[6]N[5,6]C)(H){5|C<3>}	C[6](N[5,6]C[5,6a]C[5,6])(C[6]N[5a,6]H)(CH3){1|N<2>,1|N<3>,3|C<3>}	H(C[6]N[5a,6]C[6])	118.2140	0.000	1	118.2140	0.000	1	118.2140	0.000	1	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[5a,6]-3:C[6]-3:H-1:	N[5a,6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[5a,6]C[5a,6a]C[5a,6])(C[6]N[5a,6]C)(H)	C[6](N[5a,6]C[5a,6a]C[5a,6])(C[6]N[5a,6]H)(CH3)	H(C[6]N[5a,6]C[6])	C[6](N[5a,6]C[5a,6a]C[5a,6])(C[6]N[5a,6]C)(H){5|C<3>}	C[6](N[5a,6]C[5a,6a]C[5a,6])(C[6]N[5a,6]H)(CH3){1|N<2>,4|C<3>}	H(C[6]N[5a,6]C[6])	119.1160	0.000	1	119.1160	0.000	1	119.1160	0.000	1	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6,6]C[6,6,6a]C[6])(C[6]C[6]C)(H)	C[6](C[6]C[6,6a]C)(C[6]N[6,6]H)(CH3)	H(C[6]N[6,6]C[6])	C[6](N[6,6]C[6,6,6a]C[6])(C[6]C[6]C)(H){2|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[6,6a]C)(C[6]N[6,6]H)(CH3){1|C<4>,2|C<3>}	H(C[6]N[6,6]C[6])	119.0970	0.000	1	119.0970	0.000	1	119.1412	0.135	4	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6,6]C[6,6]B[6])(C[6]C[6]C)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(CH3)	H(C[6]N[6,6]C[6])	C[6](N[6,6]C[6,6]B[6])(C[6]C[6]C)(H){1|F<1>,1|H<1>,1|O<2>,3|C<3>}	C[6](C[6]N[6,6]H)(C[6]C[6]H)(CH3){1|B<4>,1|C<3>,1|H<1>}	H(C[6]N[6,6]C[6])	118.6380	0.000	1	118.6380	0.000	1	119.1412	0.135	4	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]C)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]H)(CH3)	H(C[6]N[6,6]C[6])	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]C)(H){1|C<4>,2|C<3>,3|H<1>}	C[6](C[6]N[6,6]H)(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|H<1>}	H(C[6]N[6,6]C[6])	119.4150	0.010	2	119.4150	0.000	2	119.1412	0.135	4	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6,6a]-3:C[6]-3:H-1:	C[5a,6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6,6a]C[6,6a]C[6a])(C[6]C[5a,6]C)(H)	C[6](C[5a,6]C[5a,6a]C[5a,6])(C[6]N[6,6a]H)(CH3)	H(C[6]N[6,6a]C[6])	C[6](N[6,6a]C[6,6a]C[6a])(C[6]C[5a,6]C)(H){1|N<2>,1|O<1>,3|C<3>}	C[6](C[5a,6]C[5a,6a]C[5a,6])(C[6]N[6,6a]H)(CH3){1|N<3>,4|C<3>}	H(C[6]N[6,6a]C[6])	118.6750	0.000	1	118.6750	0.000	1	118.6750	0.000	1	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6a]C[6])(C[6]C[6,6a]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(CCCH)	H(C[6]C[6]N[6])	C[6](N[6]C[6a]C[6])(C[6]C[6,6a]C)(H){1|C<4>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]N[6]H)(CCCH){1|H<1>,4|C<3>}	H(C[6]C[6]N[6])	118.5590	0.000	1	118.5590	0.000	1	118.5590	0.000	1	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:B-4:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]B)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(BO3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]B)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(BO3){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.1180	0.000	1	117.1180	0.000	1	117.1180	0.000	1	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]B[3,3,5,3x6]C[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]B[3,3,5,3x6]C[6])(C[6]C[6]C)(H){1|Rh<6>,1|B<5>,1|C<3>,1|H<2>,2|B<6>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|B<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	121.8720	0.000	1	121.8720	0.000	1	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[5]C[6])(C[6]C[6]C)(H)	C[6](C[6]N[6]H)(C[6]N[6]O)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[5]C[6])(C[6]C[6]C)(H){1|C<4>,1|H<1>,1|N<2>,1|O<2>,2|O<1>}	C[6](C[6]N[6]H)(C[6]N[6]O)(CH3){1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	119.0600	2.034	5	119.0600	4.137	5	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6,6]Os)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6]Os)(C[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(CH3){1|Os<8>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	118.3300	0.474	2	118.3300	0.224	2	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6,6a]C)(C[6]C[6]C)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]C)(C[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(CH3){1|C<4>,2|C<3>}	H(C[6]C[6]N[6])	118.6180	0.000	1	118.6180	0.000	1	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6,6a]Cd)(C[6]C[6]C)(H)	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Cd)(C[6]C[6]C)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(CH3){1|Cd<8>,2|C<3>}	H(C[6]C[6]N[6])	117.7155	0.238	4	117.7155	0.056	4	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6,6a]Co)(C[6]C[6]C)(H)	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Co)(C[6]C[6]C)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(CH3){1|Co<6>,2|C<3>}	H(C[6]C[6]N[6])	119.1008	0.475	4	119.1008	0.225	4	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6,6a]Cr)(C[6]C[6]C)(H)	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Cr)(C[6]C[6]C)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(CH3){1|Cr<10>,2|C<3>}	H(C[6]C[6]N[6])	116.3650	0.000	1	117.5457	1.047	3	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6,6a]Cr)(C[6]C[6]C)(H)	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Cr)(C[6]C[6]C)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(CH3){1|Cr<6>,2|C<3>}	H(C[6]C[6]N[6])	118.1360	0.051	2	117.5457	1.047	3	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6,6a]Cu)(C[6]C[6]C)(H)	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Cu)(C[6]C[6]C)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(CH3){1|Cu<4>,2|C<3>}	H(C[6]C[6]N[6])	117.4620	0.317	6	117.4581	0.073	8	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6,6a]Cu)(C[6]C[6]C)(H)	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Cu)(C[6]C[6]C)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(CH3){1|Cu<6>,2|C<3>}	H(C[6]C[6]N[6])	117.4465	0.100	2	117.4581	0.073	8	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6,6a]Cu)(C[6]C[6]C)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Cu)(C[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(CH3){1|Cu<5>,2|C<3>}	H(C[6]C[6]N[6])	117.6257	0.225	3	117.6257	0.051	3	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6,6a]Fe)(C[6]C[6]C)(H)	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Fe)(C[6]C[6]C)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(CH3){1|Fe<6>,2|C<3>}	H(C[6]C[6]N[6])	118.7887	0.609	8	118.7887	0.371	8	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6,6a]Mn)(C[6]C[6]C)(H)	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Mn)(C[6]C[6]C)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(CH3){1|Mn<6>,2|C<3>}	H(C[6]C[6]N[6])	117.6338	0.382	11	117.6338	0.146	11	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6,6a]Ni)(C[6]C[6]C)(H)	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Ni)(C[6]C[6]C)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(CH3){1|Ni<6>,2|C<3>}	H(C[6]C[6]N[6])	117.7190	0.411	50	117.7190	0.169	50	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6,6a]O)(C[6]C[6]C)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]O)(C[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(CH3){1|O<1>,2|C<3>}	H(C[6]C[6]N[6])	118.8060	0.000	1	118.8060	0.000	1	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6,6a]Pt)(C[6]C[6]C)(H)	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(CCHH)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Pt)(C[6]C[6]C)(H){1|C<2>,2|C<3>}	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(CCHH){1|Pt<4>,2|C<3>}	H(C[6]C[6]N[6])	118.2375	0.168	2	118.2375	0.028	2	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6,6a]Re)(C[6]C[6]C)(H)	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Re)(C[6]C[6]C)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(CH3){1|Re<6>,2|C<3>}	H(C[6]C[6]N[6])	118.0007	0.588	6	118.0007	0.346	6	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6,6a]Zn)(C[6]C[6]C)(H)	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Zn)(C[6]C[6]C)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(CH3){1|Zn<6>,2|C<3>}	H(C[6]C[6]N[6])	117.0225	1.201	2	117.0225	1.443	2	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6,6a]Zn)(C[6]C[6]C)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]Zn)(C[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]H)(CH3){1|Zn<4>,2|C<3>}	H(C[6]C[6]N[6])	117.4950	0.000	1	117.4950	0.000	1	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Ag)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHN)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ag)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHN){1|Ag<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.0555	0.442	2	118.0555	0.195	2	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Al)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Al)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Al<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2237	0.193	3	118.1945	0.028	4	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Al)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Al)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Al<3>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.1070	0.000	1	118.1945	0.028	4	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Au)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CF3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Au)(C[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CF3){1|Au<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8625	0.329	2	118.8625	0.108	2	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Ca)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ca)(C[6]C[6]C)(H){1|Al<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Ca<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.4890	0.077	6	117.4890	0.006	6	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Cd)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cd)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Cd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4573	0.255	4	118.4573	0.065	4	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Cd)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHN)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cd)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHN){1|Cd<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4920	0.000	1	118.4920	0.000	1	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Cd)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CN[6a]HH)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cd)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CN[6a]HH){1|Cd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.9485	0.353	2	118.9485	0.125	2	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Cd)(C[6]C[6]C)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cd)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(CH3){1|Cd<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.2675	0.036	2	117.2675	0.001	2	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]C)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(CH3){1|Co<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.9255	0.186	4	117.9255	0.035	4	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CCHH)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CCHH){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.1620	0.000	1	118.1620	0.000	1	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Co<4>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	118.6077	0.106	4	118.4589	0.048	7	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Co<6>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	118.2425	0.209	2	118.4589	0.048	7	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Co<8>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2960	0.000	1	118.4589	0.048	7	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHN)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHN){1|Co<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.1780	0.000	1	118.1500	0.002	2	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHN)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHN){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.1220	0.000	1	118.1500	0.002	2	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]C)(H)	C[6](C[6]C[6]O)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]C)(H){1|C<3>,1|C<4>,1|O<2>}	C[6](C[6]C[6]O)(C[6]N[6]H)(CH3){1|Co<6>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	118.4150	0.000	1	118.4150	0.000	1	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Cr)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cr)(C[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Cr<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5265	0.090	2	118.5265	0.008	2	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CCHH)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CCHH){1|Cu<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5050	0.000	1	118.1467	0.188	3	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CCHH)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CCHH){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.9675	0.429	2	118.1467	0.188	3	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Cu<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3860	0.000	1	118.2153	0.290	37	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Cu<3>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.6750	0.126	2	118.2153	0.290	37	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Cu<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.1690	0.942	3	118.2153	0.290	37	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Cu<5>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	117.9900	0.173	2	118.2153	0.290	37	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.1472	0.351	8	118.2153	0.290	37	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Cu<6>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	118.4590	0.000	1	118.2153	0.290	37	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Cu<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3089	0.716	14	118.2153	0.290	37	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2972	0.141	6	118.2153	0.290	37	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHN)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHN){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6651	0.363	8	118.6651	0.131	8	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHO)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHO){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.9590	0.000	1	118.4620	0.494	2	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHO)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHO){1|Cu<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.9650	0.000	1	118.4620	0.494	2	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CN[5]HH)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CN[5]HH){1|Cu<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3160	0.000	1	118.3160	0.000	1	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]C)(H)	C[6](C[6]C[6]O)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]C)(H){1|C<3>,1|C<4>,1|O<2>}	C[6](C[6]C[6]O)(C[6]N[6]H)(CH3){1|Cu<4>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	117.8390	0.322	2	118.2780	0.271	26	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Cu)(C[6]C[6]C)(H)	C[6](C[6]C[6]O)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Cu)(C[6]C[6]C)(H){1|C<3>,1|C<4>,1|O<2>}	C[6](C[6]C[6]O)(C[6]N[6]H)(CH3){1|Cu<5>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	118.3145	0.522	24	118.2780	0.271	26	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Eu)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Eu)(C[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Eu<13>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.7100	0.281	2	117.5342	0.049	5	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Eu)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Eu)(C[6]C[6]C)(H){1|Sn<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Eu<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.4170	0.086	3	117.5342	0.049	5	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Fe)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CCHH)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Fe)(C[6]C[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CCHH){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.1958	0.192	8	118.1835	0.030	10	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Fe)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CCHH)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Fe)(C[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CCHH){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.1345	0.056	2	118.1835	0.030	10	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Fe)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Fe)(C[6]C[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2772	0.284	5	118.0354	0.164	23	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Fe)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Fe)(C[6]C[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Fe<8>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.4260	0.000	1	118.0354	0.164	23	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Fe)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Fe)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.5228	0.150	5	118.0354	0.164	23	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Fe)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Fe)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Fe<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8180	0.000	1	118.0354	0.164	23	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Fe)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Fe)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Fe<8>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5820	0.000	1	118.0354	0.164	23	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Fe)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Fe)(C[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.0989	0.175	10	118.0354	0.164	23	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Fe)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHN)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Fe)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHN){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.0768	0.288	5	118.0768	0.083	5	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Fe)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CN[5]HH)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Fe)(C[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CN[5]HH){1|Fe<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5530	0.254	3	118.5530	0.065	3	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Fe)(C[6]C[6]C)(H)	C[6](C[6]C[6]O)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Fe)(C[6]C[6]C)(H){1|C<3>,1|C<4>,1|O<2>}	C[6](C[6]C[6]O)(C[6]N[6]H)(CH3){1|Fe<6>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	118.4087	0.096	3	118.4087	0.009	3	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Ga)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ga)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Ga<4>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	120.3916	2.014	8	120.3916	4.056	8	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Hg)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Hg)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Hg<4>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	118.7454	0.519	8	118.7002	0.219	10	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Hg)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Hg)(C[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Hg<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5195	0.016	2	118.7002	0.219	10	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CF3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CF3){1|Ir<9>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	120.1650	0.000	1	118.9479	0.314	9	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CF3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CF3){1|Ir<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7957	0.347	8	118.9479	0.314	9	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Ir<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.1163	0.291	7	118.1163	0.085	7	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHO)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHO){1|Ir<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.0850	0.000	1	118.0153	0.268	11	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHO)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHO){1|Ir<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.5120	0.000	1	118.0153	0.268	11	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHO)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHO){1|Ir<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.0634	0.548	9	118.0153	0.268	11	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Li)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Li)(C[6]C[6]C)(H){1|Al<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Li<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.3477	0.034	3	117.9514	1.398	22	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Li)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Li)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Li<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	120.5403	1.114	3	117.9514	1.398	22	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Li)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Li)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Li<4>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	117.9640	0.181	4	117.9514	1.398	22	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Li)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Li)(C[6]C[6]C)(H){1|Sn<3>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Li<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.4508	0.483	12	117.9514	1.398	22	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Mg)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mg)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Mg<4>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	118.2030	0.169	4	118.9668	1.804	6	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Mg)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mg)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Mg<6>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	120.4945	1.391	2	118.9668	1.804	6	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Mn)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mn)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Mn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.1710	0.174	2	117.7173	0.280	9	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Mn)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mn)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Mn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	116.7800	0.000	1	117.7173	0.280	9	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Mn)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mn)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Mn<6>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	118.1340	0.064	2	117.7173	0.280	9	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Mn)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mn)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Mn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.0165	0.089	4	117.7173	0.280	9	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Mn)(C[6]C[6]C)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mn)(C[6]C[6]C)(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(CH3){1|Mn<6>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	117.8495	0.136	2	117.8495	0.019	2	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Mn)(C[6]C[6]C)(H)	C[6](C[6]C[6]O)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mn)(C[6]C[6]C)(H){1|C<3>,1|C<4>,1|O<2>}	C[6](C[6]C[6]O)(C[6]N[6]H)(CH3){1|Mn<6>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	117.9347	0.233	3	117.9347	0.054	3	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Mo)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mo)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Mo<6>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	118.5103	0.112	7	118.3842	0.138	8	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Mo)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mo)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Mo<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.5020	0.000	1	118.3842	0.138	8	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CCHH)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CCHH){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.8130	0.000	1	117.8130	0.000	1	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]C[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Ni<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.1710	0.000	1	118.0030	0.200	24	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Ni<6>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	118.0604	0.563	9	118.0030	0.200	24	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.9483	0.403	8	118.0030	0.200	24	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Ni<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.0550	0.074	4	118.0030	0.200	24	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2755	0.101	2	118.0030	0.200	24	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHN)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHN){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3472	0.328	9	118.3472	0.107	9	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Os)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Os)(C[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Os<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.9294	0.374	9	117.9294	0.140	9	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]C)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(CH3){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2880	0.000	1	118.2880	0.000	1	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CCHH)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CCHH){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2720	0.000	1	118.4582	0.028	5	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CCHH)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CCHH){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5048	0.153	4	118.4582	0.028	5	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CF3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CF3){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.9860	0.000	1	119.0865	0.177	4	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CF3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|S<4>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CF3){1|Pd<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.4135	0.016	2	119.0865	0.177	4	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CF3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CF3){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5330	0.000	1	119.0865	0.177	4	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3745	0.262	2	118.7939	0.251	16	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Pd<4>,1|C<2>,1|C<3>}	H(C[6]C[6]N[6])	119.1780	0.000	1	118.7939	0.251	16	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Pd<4>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	118.6538	0.314	8	118.7939	0.251	16	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	120.2760	0.000	1	118.7939	0.251	16	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Pd<4>,1|C<3>,1|N<3>}	H(C[6]C[6]N[6])	118.8787	0.229	3	118.7939	0.251	16	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6340	0.000	1	118.7939	0.251	16	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Pd)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHO)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pd)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHO){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.1195	0.418	6	119.1195	0.175	6	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]C)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(CH3){1|Pt<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4880	0.000	1	118.4880	0.000	1	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CCHH)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CCHH){1|Pt<4>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	118.9425	0.866	2	118.9425	0.750	2	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CF3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CF3){1|Pt<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	119.1923	0.284	12	119.1923	0.081	12	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Pt<4>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	118.2043	0.250	7	118.3366	0.089	30	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Pt<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.1750	0.885	2	118.3366	0.089	30	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Pt<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3761	0.255	18	118.3366	0.089	30	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Pt<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5167	0.042	3	118.3366	0.089	30	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHO)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHO){1|Pt<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3335	0.265	2	118.4493	0.048	16	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHO)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHO){1|Pt<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4659	0.217	14	118.4493	0.048	16	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]C)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(CH3){1|Pt<4>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	118.8083	0.066	4	118.8083	0.004	4	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Re)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CC[5]HH)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Re)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CC[5]HH){1|Re<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.5930	0.000	1	117.5930	0.000	1	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Re)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CClHH)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Re)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CClHH){1|Re<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.6855	0.740	2	117.6855	0.548	2	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Re)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Re)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Re<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.3420	0.369	10	118.2278	0.126	27	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Re)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Re)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Re<6>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	118.3958	0.360	5	118.2278	0.126	27	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Re)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Re)(C[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Re<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.0627	0.293	12	118.2278	0.126	27	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Re)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHO)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Re)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHO){1|Re<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2450	0.000	1	118.4710	0.102	2	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Re)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHO)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Re)(C[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHO){1|Re<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6970	0.000	1	118.4710	0.102	2	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Rh)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Rh)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Rh<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.0800	0.000	1	118.0800	0.000	1	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Rh)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHO)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Rh)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHO){1|Rh<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5515	0.301	2	118.5515	0.090	2	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Rh)(C[6]C[6]C)(H)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Rh)(C[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(CH3){1|Rh<6>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.1010	0.000	1	118.1010	0.000	1	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CCHH)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CCHH){1|Ru<9>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8480	0.000	1	118.8480	0.000	1	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CF3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CF3){1|Ru<9>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8460	0.570	2	118.8460	0.325	2	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Ru<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	114.3252	0.860	4	117.2102	2.969	18	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Ru<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5085	0.275	4	117.2102	2.969	18	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Ru<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.8449	0.663	10	117.2102	2.969	18	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHN)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHN){1|Ru<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.0530	0.201	2	118.0530	0.040	2	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Ru)(C[6]C[6]C)(H)	C[6](C[6]N[6]H)(C[6]N[6]N)(CC[6a]HH)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru)(C[6]C[6]C)(H){1|N<2>,2|N<3>}	C[6](C[6]N[6]H)(C[6]N[6]N)(CC[6a]HH){1|Ru<9>,1|C<3>}	H(C[6]C[6]N[6])	117.6710	0.352	2	117.6710	0.124	2	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Si)(C[6]C[6]C)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Si)(C[6]C[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(CH3){1|Si<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2310	0.000	1	118.2310	0.000	1	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Si)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Si)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Si<6>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	118.9818	0.097	4	118.8777	0.087	6	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Si)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Si)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Si<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6695	0.527	2	118.8777	0.087	6	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Ti)(C[6]C[6]C)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ti)(C[6]C[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]N[6]H)(CH3){1|Ti<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.1010	0.000	1	118.1010	0.000	1	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Ti)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ti)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Ti<12>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	118.0910	0.121	4	118.0910	0.015	4	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CCHH)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CCHH){1|Zn<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.8440	0.000	1	118.3020	0.158	3	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CCHH)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CCHH){1|Zn<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5310	0.028	2	118.3020	0.158	3	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Zn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.3710	0.000	1	118.1884	0.151	24	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Zn<4>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	118.2331	0.161	8	118.1884	0.151	24	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Zn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.8647	0.293	3	118.1884	0.151	24	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Zn<5>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	118.4195	0.387	2	118.1884	0.151	24	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Zn<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.8650	0.000	1	118.1884	0.151	24	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Zn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2398	0.463	4	118.1884	0.151	24	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Zn<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2755	0.235	2	118.1884	0.151	24	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Zn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.4927	0.613	3	118.1884	0.151	24	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHN)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHN){1|Zn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2833	0.133	3	118.1318	0.107	14	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHN)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHN){1|Zn<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7600	0.000	1	118.1318	0.107	14	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHN)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CHHN){1|Zn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.0235	0.293	10	118.1318	0.107	14	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CN[5]HH)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CN[5]HH){1|Zn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.1160	0.072	2	118.1160	0.005	2	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CN[5a]HH)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CN[5a]HH){1|Zn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.1870	0.000	1	118.1485	0.003	2	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CN[5a]HH)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CN[5a]HH){1|Zn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.1100	0.000	1	118.1485	0.003	2	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]C)(H)	C[6](C[6]C[6]N)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N)(C[6]N[6]H)(CH3){1|Zn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.4280	0.000	1	117.4280	0.000	1	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]C)(H)	C[6](C[6]C[6]O)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]C)(H){1|C<3>,1|C<4>,1|O<2>}	C[6](C[6]C[6]O)(C[6]N[6]H)(CH3){1|Zn<4>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	118.0580	0.000	1	118.0480	0.000	2	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]C[6]C)(H)	C[6](C[6]C[6]O)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]C[6]C)(H){1|C<3>,1|C<4>,1|O<2>}	C[6](C[6]C[6]O)(C[6]N[6]H)(CH3){1|Zn<6>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	118.0380	0.000	1	118.0480	0.000	2	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6a]C[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]O)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6a]C[6])(C[6]C[6]C)(H){1|C<4>,1|H<1>,1|O<1>,3|C<3>}	C[6](C[6]C[6]O)(C[6]N[6]H)(CH3){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6]N[6])	116.7900	0.000	1	116.7900	0.000	1	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6a]C[6])(C[6]C[6]C)(H)	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6a]C[6])(C[6]C[6]C)(H){5|C<3>}	C[6](C[6]C[6a]C[6])(C[6]N[6]H)(CH3){1|C<4>,4|C<3>}	H(C[6]C[6]N[6])	119.1430	0.199	2	119.1430	0.040	2	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6a]C[6])(C[6]C[6]C)(H)	C[6](C[6]C[6a]N[6])(C[6]N[6]H)(CCCH)	H(C[6]C[6]N[6])	C[6](N[6]C[6a]C[6])(C[6]C[6]C)(H){1|C<4>,1|N<2>,4|C<3>}	C[6](C[6]C[6a]N[6])(C[6]N[6]H)(CCCH){1|C<4>,3|C<3>}	H(C[6]C[6]N[6])	118.5950	0.000	1	118.5950	0.000	1	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]Ga[3x6]C[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]Ga[3x6]C[6])(C[6]C[6]C)(H){1|C<3>,2|H<1>,3|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Ga<4>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	118.5953	0.181	7	118.5953	0.033	7	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]Ga[6]C[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]Ga[6]C[6])(C[6]C[6]C)(H){1|Br<1>,1|C<3>,2|H<1>,2|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Ga<4>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	118.9056	0.117	5	119.7281	1.955	20	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]Ga[6]C[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]Ga[6]C[6])(C[6]C[6]C)(H){1|Br<1>,2|Se<2>,1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Ga<4>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	118.9293	0.174	9	119.7281	1.955	20	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]Ga[6]C[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]Ga[6]C[6])(C[6]C[6]C)(H){1|Cl<1>,1|C<3>,2|H<1>,2|S<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){1|Ga<4>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	121.6117	1.135	6	119.7281	1.955	20	118.2737	0.716	665	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-4:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]S)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(SO3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]S)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(SO3){1|Co<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	120.8940	0.246	3	120.8940	0.061	3	120.8243	3.023	7	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:S-4:	C[6]-3:	C[6](N[6]C[6]Ni)(C[6]C[6]S)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(SO3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ni)(C[6]C[6]S)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(SO3){1|Ni<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	120.7720	2.449	4	120.7720	5.996	4	120.8243	3.023	7	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Fe)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(C[6]N[6]H)(CHHP)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Fe)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]N[6]H)(CHHP){1|Fe<6>,2|C<3>}	H(C[6]C[6]N[6])	118.7897	0.250	3	118.7897	0.063	3	118.5420	0.264	7	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]N[6]C)(H)	C[6](N[6]C[6]Pt)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]N[6]C)(H){1|Pt<4>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Pt)(C[6]N[6]H)(CH3){1|Pt<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.8540	0.331	2	117.8540	0.110	2	118.5420	0.264	7	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	N[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Zn)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]N[6]H)(CCHO)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Zn)(C[6]N[6]C)(H){1|Zn<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]N[6]H)(CCHO){1|Zn<6>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.8585	0.129	2	118.8585	0.017	2	118.5420	0.264	7	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	P[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](P[6]C[6]Mn)(C[6]C[6]C)(H)	C[6](C[6]C[6]C)(C[6]P[6]H)(CH3)	H(C[6]C[6]P[6])	C[6](P[6]C[6]Mn)(C[6]C[6]C)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6]C)(C[6]P[6]H)(CH3){1|Mn<5>,1|C<3>,1|H<1>}	H(C[6]C[6]P[6])	118.1590	0.037	2	118.1590	0.001	2	117.3053	0.463	7	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	P[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](P[6]C[6]Sm)(C[6]C[6]C)(H)	C[6](C[6]C[6]C)(C[6]P[6]H)(CH3)	H(C[6]C[6]P[6])	C[6](P[6]C[6]Sm)(C[6]C[6]C)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6]C)(C[6]P[6]H)(CH3){1|Sm<12>,1|C<3>,1|H<1>}	H(C[6]C[6]P[6])	117.0650	0.000	1	117.0650	0.000	1	117.3053	0.463	7	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	P[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](P[6]C[6]Tm)(C[6]C[6]C)(H)	C[6](C[6]C[6]C)(C[6]P[6]H)(CH3)	H(C[6]C[6]P[6])	C[6](P[6]C[6]Tm)(C[6]C[6]C)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6]C)(C[6]P[6]H)(CH3){1|Tm<12>,1|C<3>,1|H<1>}	H(C[6]C[6]P[6])	117.2195	0.425	2	117.2195	0.181	2	117.3053	0.463	7	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:4:	3:	P[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](P[6]C[6]Yb)(C[6]C[6]C)(H)	C[6](C[6]C[6]C)(C[6]P[6]H)(CH3)	H(C[6]C[6]P[6])	C[6](P[6]C[6]Yb)(C[6]C[6]C)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6]C)(C[6]P[6]H)(CH3){1|Yb<12>,1|C<3>,1|H<1>}	H(C[6]C[6]P[6])	116.6575	0.474	2	116.6575	0.225	2	117.3053	0.463	7	119.6821	1.733	15547	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:5:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-5:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CDy2OO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CDy2OO){1|C<2>,2|H<1>}	H(C[6]C[6]2)	120.5250	0.000	1	120.5250	0.000	1	120.4958	0.135	5	120.5450	0.798	14	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:5:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-5:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(CRu2NN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CRu2NN){1|C<2>,2|H<1>}	H(C[6]C[6]2)	120.2190	0.000	1	120.2190	0.000	1	120.4958	0.135	5	120.5450	0.798	14	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:5:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-5:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(CPdCCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){2|C<3>}	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(CPdCCH){1|C<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	121.1170	0.000	1	121.1170	0.000	1	120.4958	0.135	5	120.5450	0.798	14	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:5:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-3:C-5:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)2(COOWW)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(COOWW){1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.3090	0.093	2	120.3090	0.009	2	120.4958	0.135	5	120.5450	0.798	14	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:5:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-5:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CRuSiHH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CRuSiHH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.5900	0.000	1	120.5900	0.000	1	120.5970	0.000	2	120.5450	0.798	14	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:5:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:C-5:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ti)(C[6]C[6]H)(CTiHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ti<10>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ti)(C[6]C[6]H)(CTiHHO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6040	0.000	1	120.6040	0.000	1	120.5970	0.000	2	120.5450	0.798	14	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:5:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-5:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Os)(C[6]C[6]H)(NOs4)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Os<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Os)(C[6]C[6]H)(NOs4){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.0530	0.000	1	120.0530	0.000	1	120.0918	0.079	6	120.5450	0.798	14	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:5:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-5:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NRu4)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NRu4){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.0090	0.429	2	120.0996	0.098	5	120.0918	0.079	6	120.5450	0.798	14	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:5:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-5:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NRu4)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NRu4){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.3340	0.000	2	120.0996	0.098	5	120.0918	0.079	6	120.5450	0.798	14	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:5:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:N-5:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NRu4)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ru<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(NRu4){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.8120	0.000	1	120.0996	0.098	5	120.0918	0.079	6	120.5450	0.798	14	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:3:5:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-3:Si-5:	C[6]-3:	C[6](C[6]N[6]Si)(C[6]C[6]H)(H)	C[6](N[6]C[6]Cu)(C[6]C[6]H)(SiCuC3)	H(C[6]C[6]2)	C[6](C[6]N[6]Si)(C[6]C[6]H)(H){1|Cu<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(C[6]C[6]H)(SiCuC3){1|C<3>,2|H<1>}	H(C[6]C[6]2)	123.4060	0.000	1	123.4060	0.000	1	123.4060	0.000	1	120.5450	0.798	14	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[4,6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:O-1:	C[6]-3:	C[6](C[4,6,6]C[4,3x6]C[4,6,6])(C[6]C[6]O)(H)	C[6](C[6]C[4,6,6]H)(C[6]C[6]HH)(O)	H(C[6]C[4,6,6]C[6])	C[6](C[4,6,6]C[4,3x6]C[4,6,6])(C[6]C[6]O)(H){3|H<1>,4|C<4>}	C[6](C[6]C[4,6,6]H)(C[6]C[6]HH)(O){2|C<4>,2|H<1>}	H(C[6]C[4,6,6]C[6])	120.8350	0.132	2	120.8350	0.017	2	120.8350	0.017	2	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[4,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:O-1:	C[6]-3:	C[6](C[4,6]C[4,6]C[4])(C[6]C[6]O)(H)	C[6](C[6]C[4,6]H)(C[6]C[6]HH)(O)	H(C[6]C[4,6]C[6])	C[6](C[4,6]C[4,6]C[4])(C[6]C[6]O)(H){1|C<3>,2|C<4>,4|H<1>}	C[6](C[6]C[4,6]H)(C[6]C[6]HH)(O){2|C<4>,2|H<1>}	H(C[6]C[4,6]C[6])	120.9270	0.000	1	120.9270	0.000	1	120.9270	0.000	1	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[5,6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:O-1:	C[6]-3:	C[6](C[5,6,6]C[5,6,6]C[5,6])(C[6]C[6]O)(H)	C[6](C[6]C[5,6,6]H)(C[6]C[6]HH)(O)	H(C[6]C[5,6,6]C[6])	C[6](C[5,6,6]C[5,6,6]C[5,6])(C[6]C[6]O)(H){1|O<2>,3|H<1>,4|C<4>}	C[6](C[6]C[5,6,6]H)(C[6]C[6]HH)(O){2|C<4>,2|H<1>}	H(C[6]C[5,6,6]C[6])	119.6925	0.213	2	119.7597	0.036	3	119.7597	0.036	3	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[5,6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:O-1:	C[6]-3:	C[6](C[5,6,6]C[5,6,6]C[5,6])(C[6]C[6]O)(H)	C[6](C[6]C[5,6,6]H)(C[6]C[6]HH)(O)	H(C[6]C[5,6,6]C[6])	C[6](C[5,6,6]C[5,6,6]C[5,6])(C[6]C[6]O)(H){1|S<2>,3|H<1>,4|C<4>}	C[6](C[6]C[5,6,6]H)(C[6]C[6]HH)(O){2|C<4>,2|H<1>}	H(C[6]C[5,6,6]C[6])	119.8940	0.000	1	119.7597	0.036	3	119.7597	0.036	3	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[5,6]C[5,6,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]HO)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6,6]C[5])(C[6]C[6]H)(H){1|C<3>,1|N<3>,1|O<2>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]HO)(H){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[5,6]C[6])	119.4787	0.121	3	119.4787	0.015	3	119.9215	0.364	8	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|C<3>,2|C<4>,4|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[5,6]C[6])	120.3530	0.000	1	120.0907	0.465	4	119.9215	0.364	8	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|O<1>,1|O<2>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H){2|C<3>,2|H<1>}	H(C[6]C[5,6]C[6])	120.9350	0.000	1	120.0907	0.465	4	119.9215	0.364	8	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|O<2>,3|C<4>,3|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H){1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	119.5375	0.028	2	120.0907	0.465	4	119.9215	0.364	8	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]N[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]OO)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]N[5])(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|O<2>}	C[6](C[6]C[5,6]H)(C[6]C[6]OO)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[5,6]C[6])	120.5730	0.000	1	120.5730	0.000	1	119.9215	0.364	8	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:O-1:	C[6]-3:	C[6](C[5,6]C[5,5,6]C[5])(C[6]C[6]O)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(O)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,5,6]C[5])(C[6]C[6]O)(H){1|C<3>,3|C<4>,4|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(O){1|H<1>,3|C<4>}	H(C[6]C[5,6]C[6])	119.5010	0.016	2	119.5010	0.000	2	119.6706	0.879	18	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:O-1:	C[6]-3:	C[6](C[5,6]C[5,6,6]O[5])(C[6]C[6]O)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(O)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6,6]O[5])(C[6]C[6]O)(H){2|H<1>,4|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(O){1|C<4>,1|O<2>,2|H<1>}	H(C[6]C[5,6]C[6])	120.1880	0.000	1	120.1880	0.000	1	119.6706	0.879	18	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:O-1:	C[6]-3:	C[6](C[5,6]C[5,6]2)(C[6]C[6]O)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(O)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]2)(C[6]C[6]O)(H){3|H<1>,5|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(O){2|C<4>,2|H<1>}	H(C[6]C[5,6]C[6])	119.0010	0.000	1	119.0010	0.000	1	119.6706	0.879	18	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:O-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]O)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(O)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]O)(H){1|C<4>,1|O<2>,3|C<3>,3|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(O){2|C<4>,2|H<1>}	H(C[6]C[5,6]C[6])	119.7845	0.054	2	119.5362	0.218	5	119.6706	0.879	18	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:O-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]O)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(O)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]O)(H){1|O<1>,2|H<1>,4|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(O){1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	119.9690	0.000	1	119.5362	0.218	5	119.6706	0.879	18	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:O-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]O)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(O)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]O)(H){3|C<4>,5|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(O){2|C<4>,2|H<1>}	H(C[6]C[5,6]C[6])	119.3240	0.000	1	119.5362	0.218	5	119.6706	0.879	18	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:O-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]O)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(O)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]O)(H){3|H<1>,5|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(O){2|C<4>,2|H<1>}	H(C[6]C[5,6]C[6])	118.8190	0.000	1	119.5362	0.218	5	119.6706	0.879	18	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:O-1:	C[6]-3:	C[6](C[5,6]C[5,6]N[5])(C[6]C[6]O)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(O)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]N[5])(C[6]C[6]O)(H){1|P<4>,2|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(O){1|C<4>,1|N<3>,2|H<1>}	H(C[6]C[5,6]C[6])	119.9965	0.438	2	119.9965	0.192	2	119.6706	0.879	18	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:O-1:	C[6]-3:	C[6](C[5,6]C[5,6]O[5])(C[6]C[6]O)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]CC)(O)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]O[5])(C[6]C[6]O)(H){6|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]CC)(O){1|H<1>,1|O<2>,2|C<4>}	H(C[6]C[5,6]C[6])	118.6520	0.000	1	118.6520	0.000	1	119.6706	0.879	18	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:O-1:	C[6]-3:	C[6](C[5,6]C[5,6]O[5])(C[6]C[6]O)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]CO)(O)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]O[5])(C[6]C[6]O)(H){1|O<2>,2|C<3>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]CO)(O){1|C<3>,1|O<2>,2|H<1>}	H(C[6]C[5,6]C[6])	121.4510	0.000	1	121.4510	0.000	1	119.6706	0.879	18	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:O-1:	C[6]-3:	C[6](C[5,6]C[5,6]O[5])(C[6]C[6]O)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(O)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]O[5])(C[6]C[6]O)(H){1|O<2>,2|H<1>,3|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(O){1|C<4>,1|O<2>,2|H<1>}	H(C[6]C[5,6]C[6])	120.5330	0.000	1	120.5273	0.034	3	119.6706	0.879	18	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:O-1:	C[6]-3:	C[6](C[5,6]C[5,6]O[5])(C[6]C[6]O)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(O)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]O[5])(C[6]C[6]O)(H){2|C<4>,2|H<1>,2|O<2>}	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(O){1|C<4>,1|H<1>,1|O<2>,1|P<4>}	H(C[6]C[5,6]C[6])	120.7090	0.000	1	120.5273	0.034	3	119.6706	0.879	18	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:O-1:	C[6]-3:	C[6](C[5,6]C[5,6]O[5])(C[6]C[6]O)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(O)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]O[5])(C[6]C[6]O)(H){2|H<1>,4|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(O){1|C<4>,1|O<2>,2|H<1>}	H(C[6]C[5,6]C[6])	120.3400	0.000	1	120.5273	0.034	3	119.6706	0.879	18	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:O-1:	C[6]-3:	C[6](C[5,6]C[5,6a]C[5,6])(C[6]C[6]O)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(O)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6a]C[5,6])(C[6]C[6]O)(H){1|C<4>,1|O<2>,2|H<1>,3|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(O){1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	119.3440	0.000	1	118.2600	2.350	2	119.6706	0.879	18	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:O-1:	C[6]-3:	C[6](C[5,6]C[5,6a]C[5,6])(C[6]C[6]O)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(O)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6a]C[5,6])(C[6]C[6]O)(H){2|C<4>,2|H<1>,3|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(O){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[5,6]C[6])	117.1760	0.000	1	118.2600	2.350	2	119.6706	0.879	18	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)(C[6]C[6]HO)(H)	H(C[6]C[5a,6]C[6])	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H){1|C<3>,1|C<4>,2|H<1>,2|O<2>}	C[6](C[6]C[5a,6]H)(C[6]C[6]HO)(H){1|H<1>,3|C<3>}	H(C[6]C[5a,6]C[6])	120.2590	0.000	1	120.2590	0.000	1	120.6780	0.351	2	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[5a,6]C[5a,6]N[5a])(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]H)(C[6]C[6]HH)(H)	H(C[6]C[5a,6]C[6])	C[6](C[5a,6]C[5a,6]N[5a])(C[6]C[6]H)(H){1|C<4>,2|H<1>,3|C<3>}	C[6](C[6]C[5a,6]H)(C[6]C[6]HH)(H){1|C<3>,1|N<3>,2|H<1>}	H(C[6]C[5a,6]C[6])	121.0970	0.000	1	121.0970	0.000	1	120.6780	0.351	2	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6]C[5,6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6,6]C[6])(C[6]C[6]H)(H){2|H<1>,5|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6,6]C[6])	118.5960	0.000	1	118.5960	0.000	1	119.1882	1.021	17	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]2)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]O[6]CC)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2)(C[6]C[6]H)(H){1|Cr<9>,1|C<3>,1|O<2>,4|C<4>}	C[6](C[6]C[6,6]H)(C[6]O[6]CC)(H){1|C<3>,1|C<4>}	H(C[6]C[6,6]C[6])	122.0130	0.000	1	122.0130	0.000	1	119.1882	1.021	17	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]CH)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){3|H<1>,4|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]CH)(H){1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6,6]C[6])	118.4390	0.235	5	118.4390	0.055	5	119.1882	1.021	17	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]CO)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|C<4>,2|O<2>}	C[6](C[6]C[6,6]H)(C[6]C[6]CO)(H){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6,6]C[6])	118.5850	0.000	1	118.5850	0.000	1	119.1882	1.021	17	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,3|C<4>,3|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H){1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6,6]C[6])	118.4680	0.000	1	118.4680	0.000	1	119.1882	1.021	17	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]HN)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>,3|C<3>}	C[6](C[6]C[6,6]H)(C[6]C[6]HN)(H){1|H<1>,2|C<3>}	H(C[6]C[6,6]C[6])	120.6200	0.000	1	120.6200	0.000	1	119.1882	1.021	17	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]OV)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<4>,1|O<1>,1|O<2>,1|V<7>,2|C<3>}	C[6](C[6]C[6,6]H)(C[6]C[6]OV)(H){1|O<2>,2|C<3>}	H(C[6]C[6,6]C[6])	119.1520	0.000	1	119.1520	0.000	1	119.1882	1.021	17	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]OW)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|W<10>,1|C<4>,1|O<1>,1|O<2>,2|C<3>}	C[6](C[6]C[6,6]H)(C[6]C[6]OW)(H){1|O<2>,2|C<3>}	H(C[6]C[6,6]C[6])	118.9710	0.000	1	118.9710	0.000	1	119.1882	1.021	17	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]CH)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>,3|C<4>}	C[6](C[6]C[6,6]H)(C[6]N[6]CH)(H){1|C<4>,2|C<3>}	H(C[6]C[6,6]C[6])	119.2840	0.059	2	119.2840	0.004	2	119.1882	1.021	17	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]HH)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|N<3>,2|C<4>,4|H<1>}	C[6](C[6]C[6,6]H)(C[6]N[6]HH)(H){1|C<3>,2|C<4>}	H(C[6]C[6,6]C[6])	118.7630	0.000	1	118.7630	0.000	1	119.1882	1.021	17	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]O[6]CC)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|O<1>,1|O<2>,3|C<4>}	C[6](C[6]C[6,6]H)(C[6]O[6]CC)(H){2|C<3>}	H(C[6]C[6,6]C[6])	120.0750	0.000	1	120.1345	0.007	2	119.1882	1.021	17	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]O[6]CC)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|O<1>,1|O<2>,4|C<4>}	C[6](C[6]C[6,6]H)(C[6]O[6]CC)(H){2|C<3>}	H(C[6]C[6,6]C[6])	120.1940	0.000	1	120.1345	0.007	2	119.1882	1.021	17	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:O-1:	C[6]-3:	C[6](C[6,6]C[3,6]C[6,6])(C[6]C[6]O)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[3,6]C[6,6])(C[6]C[6]O)(H){1|O<2>,3|H<1>,4|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(O){2|C<4>,2|H<1>}	H(C[6]C[6,6]C[6])	118.0680	0.000	1	117.9067	0.021	3	117.9602	0.933	150	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:O-1:	C[6]-3:	C[6](C[6,6]C[3,6]C[6,6])(C[6]C[6]O)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[3,6]C[6,6])(C[6]C[6]O)(H){3|H<1>,5|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(O){2|C<4>,2|H<1>}	H(C[6]C[6,6]C[6])	117.8260	0.055	2	117.9067	0.021	3	117.9602	0.933	150	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:O-1:	C[6]-3:	C[6](C[6,6]C[6,6]2)(C[6]C[6]O)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2)(C[6]C[6]O)(H){1|C<2>,1|C<3>,2|H<1>,4|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(O){1|H<1>,3|C<4>}	H(C[6]C[6,6]C[6])	117.6740	0.000	2	117.9704	0.142	5	117.9602	0.933	150	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:O-1:	C[6]-3:	C[6](C[6,6]C[6,6]2)(C[6]C[6]O)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2)(C[6]C[6]O)(H){1|C<3>,2|H<1>,5|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(O){2|C<4>,2|H<1>}	H(C[6]C[6,6]C[6])	118.5750	0.000	1	117.9704	0.142	5	117.9602	0.933	150	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:O-1:	C[6]-3:	C[6](C[6,6]C[6,6]2)(C[6]C[6]O)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2)(C[6]C[6]O)(H){2|C<3>,2|H<1>,4|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(O){2|C<4>,2|H<1>}	H(C[6]C[6,6]C[6])	117.9645	0.168	2	117.9704	0.142	5	117.9602	0.933	150	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:O-1:	C[6]-3:	C[6](C[6,6]C[6,6]2)(C[6]C[6]O)(H)	C[6](C[6]C[6,6]H)(C[6]O[6]CH)(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2)(C[6]C[6]O)(H){2|H<1>,2|O<2>,4|C<4>}	C[6](C[6]C[6,6]H)(C[6]O[6]CH)(O){2|C<4>}	H(C[6]C[6,6]C[6])	118.8565	0.146	2	118.8565	0.021	2	117.9602	0.933	150	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:O-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]CH)(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){1|C<3>,2|H<1>,4|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]CH)(O){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6,6]C[6])	118.1550	0.000	1	118.1550	0.000	1	117.9602	0.933	150	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:O-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]CO)(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|O<2>,4|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]CO)(O){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6,6]C[6])	118.0940	0.000	1	118.7240	0.510	3	117.9602	0.933	150	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:O-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]CO)(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){1|C<3>,1|H<1>,2|O<2>,4|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]CO)(O){1|H<1>,1|O<2>,2|C<4>}	H(C[6]C[6,6]C[6])	118.5780	0.000	1	118.7240	0.510	3	117.9602	0.933	150	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:O-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]CO)(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){1|H<1>,1|O<2>,2|C<3>,2|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]CO)(O){1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6,6]C[6])	119.5000	0.000	1	118.7240	0.510	3	117.9602	0.933	150	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:O-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){1|Br<1>,1|C<3>,2|H<1>,3|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(O){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6,6]C[6])	118.1870	0.000	1	117.9006	0.991	131	117.9602	0.933	150	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:O-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){1|C<2>,2|H<1>,5|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(O){2|C<4>,2|H<1>}	H(C[6]C[6,6]C[6])	117.5440	0.000	1	117.9006	0.991	131	117.9602	0.933	150	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:O-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){1|C<3>,1|O<1>,2|H<1>,3|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(O){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6,6]C[6])	117.1900	0.000	1	117.9006	0.991	131	117.9602	0.933	150	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:O-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){1|C<3>,1|O<2>,2|H<1>,3|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(O){1|C<3>,1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[6,6]C[6])	118.7570	0.000	1	117.9006	0.991	131	117.9602	0.933	150	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:O-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){1|C<3>,1|O<2>,3|C<4>,3|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(O){2|C<4>,2|H<1>}	H(C[6]C[6,6]C[6])	117.9307	0.595	3	117.9006	0.991	131	117.9602	0.933	150	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:O-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){1|C<3>,2|C<4>,4|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(O){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6,6]C[6])	118.0282	0.309	5	117.9006	0.991	131	117.9602	0.933	150	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:O-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){1|C<3>,2|H<1>,4|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(O){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6,6]C[6])	118.2740	0.000	1	117.9006	0.991	131	117.9602	0.933	150	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:O-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){1|C<3>,3|C<4>,3|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(O){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6,6]C[6])	118.0858	0.182	5	117.9006	0.991	131	117.9602	0.933	150	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:O-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){1|C<3>,3|C<4>,4|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(O){2|C<4>,2|H<1>}	H(C[6]C[6,6]C[6])	113.5570	5.616	2	117.9006	0.991	131	117.9602	0.933	150	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:O-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){1|F<1>,3|H<1>,4|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(O){2|C<4>,2|H<1>}	H(C[6]C[6,6]C[6])	118.3100	0.000	1	117.9006	0.991	131	117.9602	0.933	150	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:O-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){1|O<1>,2|H<1>,4|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(O){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6,6]C[6])	118.3508	0.170	4	117.9006	0.991	131	117.9602	0.933	150	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:O-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){1|O<2>,3|C<4>,4|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(O){2|C<4>,2|H<1>}	H(C[6]C[6,6]C[6])	118.1295	0.095	2	117.9006	0.991	131	117.9602	0.933	150	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:O-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){2|C<3>,2|C<4>,4|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(O){2|C<4>,2|H<1>}	H(C[6]C[6,6]C[6])	118.4090	0.000	1	117.9006	0.991	131	117.9602	0.933	150	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:O-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){3|C<4>,5|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(O){1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6,6]C[6])	118.6810	0.000	1	117.9006	0.991	131	117.9602	0.933	150	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:O-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){3|C<4>,5|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(O){2|C<4>,2|H<1>}	H(C[6]C[6,6]C[6])	118.0872	1.006	20	117.9006	0.991	131	117.9602	0.933	150	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:O-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){3|H<1>,5|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(O){2|C<4>,2|H<1>}	H(C[6]C[6,6]C[6])	117.6267	0.378	3	117.9006	0.991	131	117.9602	0.933	150	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:O-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){4|C<4>,4|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(O){1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6,6]C[6])	118.2255	0.090	2	117.9006	0.991	131	117.9602	0.933	150	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:O-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){4|C<4>,4|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(O){1|H<1>,1|O<2>,2|C<4>}	H(C[6]C[6,6]C[6])	118.4210	0.372	3	117.9006	0.991	131	117.9602	0.933	150	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:O-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){4|C<4>,4|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(O){1|H<1>,1|S<2>,2|C<4>}	H(C[6]C[6,6]C[6])	118.2880	0.000	1	117.9006	0.991	131	117.9602	0.933	150	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:O-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){4|C<4>,4|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(O){1|H<1>,3|C<4>}	H(C[6]C[6,6]C[6])	118.1890	0.011	2	117.9006	0.991	131	117.9602	0.933	150	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:O-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){4|C<4>,4|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(O){2|C<4>,2|H<1>}	H(C[6]C[6,6]C[6])	117.8518	0.678	71	117.9006	0.991	131	117.9602	0.933	150	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:O-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]HO)(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){1|O<2>,3|C<4>,4|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]HO)(O){2|C<4>,2|H<1>}	H(C[6]C[6,6]C[6])	118.5820	0.000	1	118.5820	0.000	1	117.9602	0.933	150	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:O-1:	C[6]-3:	C[6](C[6,6]C[6,6]O[6])(C[6]C[6]O)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]O[6])(C[6]C[6]O)(H){1|O<2>,2|H<1>,3|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(O){1|C<4>,1|O<2>,2|H<1>}	H(C[6]C[6,6]C[6])	118.9440	0.000	1	118.9440	0.000	1	117.9602	0.933	150	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:O-1:	C[6]-3:	C[6](C[6,6]C[6,6a]C[6,6])(C[6]C[6]O)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]C[6,6])(C[6]C[6]O)(H){2|C<3>,2|C<4>,3|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(O){1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6,6]C[6])	117.8970	0.000	1	118.0835	0.070	2	117.9602	0.933	150	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:O-1:	C[6]-3:	C[6](C[6,6]C[6,6a]C[6,6])(C[6]C[6]O)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]C[6,6])(C[6]C[6]O)(H){2|C<4>,2|H<1>,3|C<3>}	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(O){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6,6]C[6])	118.2700	0.000	1	118.0835	0.070	2	117.9602	0.933	150	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:O-1:	C[6]-3:	C[6](C[6,6]C[6,6a]C[6,6])(C[6]C[6]O)(H)	C[6](C[6]C[6,6]H)(C[6]O[6]HH)(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]C[6,6])(C[6]C[6]O)(H){1|O<2>,2|H<1>,3|C<3>}	C[6](C[6]C[6,6]H)(C[6]O[6]HH)(O){2|C<3>}	H(C[6]C[6,6]C[6])	119.7560	0.000	1	119.7560	0.000	1	117.9602	0.933	150	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:Br-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]Br)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]HH)(Br)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]Br)(H){1|N<3>,2|C<3>,3|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]HH)(Br){3|C<3>}	H(C[6]C[6,6a]C[6])	120.5920	0.000	1	120.5920	0.000	1	120.5920	0.000	1	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]O[6]CC)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H){1|N<3>,1|O<2>,2|C<3>,2|C<4>}	C[6](C[6]C[6,6a]H)(C[6]O[6]CC)(H){2|C<3>}	H(C[6]C[6,6a]C[6])	120.1290	0.203	12	120.1290	0.041	12	119.7746	1.103	237	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]2)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]O[6]CC)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]2)(C[6]C[6]H)(H){2|C<3>,2|C<4>,2|O<2>}	C[6](C[6]C[6,6a]H)(C[6]O[6]CC)(H){2|C<3>}	H(C[6]C[6,6a]C[6])	120.3008	0.726	6	120.3008	0.527	6	119.7746	1.103	237	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]2H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){2|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]C[6]2H)(H){1|N<3>,2|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6,6a]C[6])	119.0490	0.204	2	119.1223	0.037	3	119.7746	1.103	237	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]2H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){2|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]C[6]2H)(H){1|O<2>,2|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6,6a]C[6])	119.2690	0.000	1	119.1223	0.037	3	119.7746	1.103	237	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]Au2)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){2|Au<3>,1|H<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]Au2)(H){1|H<1>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.8200	0.000	1	119.8200	0.000	1	119.7746	1.103	237	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]CH)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){2|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]C[6]CH)(H){1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.0330	0.000	1	118.7047	0.371	3	119.7746	1.103	237	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]CH)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){2|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]C[6]CH)(H){1|H<1>,1|O<2>,2|C<3>}	H(C[6]C[6,6a]C[6])	118.5405	0.762	2	118.7047	0.371	3	119.7746	1.103	237	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]CaN)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Ca<8>,1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]CaN)(H){1|C<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.4420	0.078	2	119.4420	0.006	2	119.7746	1.103	237	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]CeO)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Ce<12>,1|H<1>,1|O<3>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]CeO)(H){3|C<3>}	H(C[6]C[6,6a]C[6])	119.5947	0.325	6	119.5381	0.529	37	119.7746	1.103	237	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]CeO)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Ce<13>,1|H<1>,1|O<3>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]CeO)(H){3|C<3>}	H(C[6]C[6,6a]C[6])	119.2397	1.272	10	119.5381	0.529	37	119.7746	1.103	237	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]CeO)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Ce<14>,1|H<1>,1|O<3>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]CeO)(H){3|C<3>}	H(C[6]C[6,6a]C[6])	119.6641	0.368	21	119.5381	0.529	37	119.7746	1.103	237	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]ClC)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Cl<1>,1|H<1>,4|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]ClC)(H){1|O<1>,2|C<3>}	H(C[6]C[6,6a]C[6])	118.2450	0.000	1	118.2450	0.000	1	119.7746	1.103	237	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]CuH)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Cu<5>,1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]C[6]CuH)(H){1|C<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.8450	0.000	1	119.8450	0.000	1	119.7746	1.103	237	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]EuO)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Eu<12>,1|H<1>,1|O<2>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]EuO)(H){3|C<3>}	H(C[6]C[6,6a]C[6])	119.4871	0.643	11	119.5220	0.273	17	119.7746	1.103	237	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]EuO)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Eu<12>,1|H<1>,1|O<3>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]EuO)(H){3|C<3>}	H(C[6]C[6,6a]C[6])	119.5860	0.199	6	119.5220	0.273	17	119.7746	1.103	237	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]HH)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|O<2>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]C[6]HH)(H){1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.5910	0.000	1	119.6818	0.133	5	119.7746	1.103	237	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]HH)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|O<2>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]C[6]HH)(H){1|H<1>,3|C<3>}	H(C[6]C[6,6a]C[6])	119.8467	0.374	3	119.6818	0.133	5	119.7746	1.103	237	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]HH)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,2|C<3>,3|H<1>}	C[6](C[6]C[6,6a]H)(C[6]C[6]HH)(H){1|H<1>,1|O<2>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.2780	0.000	1	119.6818	0.133	5	119.7746	1.103	237	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]HN)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]C[6]HN)(H){1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.1350	0.000	1	119.3436	0.057	5	119.7746	1.103	237	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]HN)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]C[6]HN)(H){1|H<1>,1|O<2>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.3958	0.241	4	119.3436	0.057	5	119.7746	1.103	237	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]HO)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,2|C<3>,2|O<2>}	C[6](C[6]C[6,6a]H)(C[6]C[6]HO)(H){1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.2250	0.000	1	119.1002	0.148	9	119.7746	1.103	237	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]HO)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|O<2>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]C[6]HO)(H){1|C<4>,1|S<2>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.1700	0.000	1	119.1002	0.148	9	119.7746	1.103	237	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]HO)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|O<2>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]C[6]HO)(H){1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.0870	0.000	1	119.1002	0.148	9	119.7746	1.103	237	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]HO)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|O<2>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]C[6]HO)(H){1|H<1>,1|O<2>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.1488	0.589	4	119.1002	0.148	9	119.7746	1.103	237	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]HO)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|O<2>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]C[6]HO)(H){1|O<2>,3|C<3>}	H(C[6]C[6,6a]C[6])	119.0630	0.000	1	119.1002	0.148	9	119.7746	1.103	237	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]HO)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|O<2>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]C[6]HO)(H){2|C<3>,2|H<1>}	H(C[6]C[6,6a]C[6])	118.7620	0.000	1	119.1002	0.148	9	119.7746	1.103	237	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]HP)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|P<4>,2|H<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]HP)(H){3|C<3>}	H(C[6]C[6,6a]C[6])	120.4020	0.000	1	120.4020	0.000	1	119.7746	1.103	237	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]HW)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|W<7>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]C[6]HW)(H){1|H<1>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.0820	0.000	1	119.0820	0.000	1	119.7746	1.103	237	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]IrO)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Ir<9>,1|C<4>,1|H<1>,1|O<2>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]IrO)(H){3|C<3>}	H(C[6]C[6,6a]C[6])	118.8710	0.206	2	118.8710	0.043	2	119.7746	1.103	237	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]LaO)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|La<12>,1|H<1>,1|O<2>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]LaO)(H){3|C<3>}	H(C[6]C[6,6a]C[6])	120.0630	0.018	4	119.7520	0.230	9	119.7746	1.103	237	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]LaO)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|La<12>,1|H<1>,1|O<3>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]LaO)(H){3|C<3>}	H(C[6]C[6,6a]C[6])	119.5032	0.535	5	119.7520	0.230	9	119.7746	1.103	237	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]LuO)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Lu<12>,1|H<1>,1|O<3>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]LuO)(H){3|C<3>}	H(C[6]C[6,6a]C[6])	119.2295	0.131	6	119.2295	0.017	6	119.7746	1.103	237	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]MoH)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Mo<7>,1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]C[6]MoH)(H){1|H<1>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.8420	0.000	1	119.8420	0.000	1	119.7746	1.103	237	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]NiH)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Ni<4>,1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]C[6]NiH)(H){1|H<1>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.4280	0.000	1	119.4280	0.000	1	119.7746	1.103	237	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]OU)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|U<13>,1|H<1>,1|O<3>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]OU)(H){3|C<3>}	H(C[6]C[6,6a]C[6])	119.2948	0.626	12	119.2948	0.392	12	119.7746	1.103	237	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]OV)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|O<2>,1|V<7>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]OV)(H){3|C<3>}	H(C[6]C[6,6a]C[6])	119.1860	0.000	1	119.2402	0.049	6	119.7746	1.103	237	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]OV)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|O<2>,1|V<9>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]OV)(H){3|C<3>}	H(C[6]C[6,6a]C[6])	119.2450	0.000	1	119.2402	0.049	6	119.7746	1.103	237	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]OV)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|V<10>,1|H<1>,1|O<2>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]OV)(H){3|C<3>}	H(C[6]C[6,6a]C[6])	119.2525	0.285	4	119.2402	0.049	6	119.7746	1.103	237	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]OY)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Y<12>,1|H<1>,1|O<2>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]OY)(H){3|C<3>}	H(C[6]C[6,6a]C[6])	119.6390	0.144	2	119.6390	0.021	2	119.7746	1.103	237	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]Os2)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Os<5>,1|Os<6>,1|C<4>,1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]Os2)(H){1|H<1>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.8770	0.000	3	119.8770	0.000	3	119.7746	1.103	237	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]PdH)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Pd<4>,2|H<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]PdH)(H){3|C<3>}	H(C[6]C[6,6a]C[6])	119.8875	0.186	2	119.8875	0.035	2	119.7746	1.103	237	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]Re2)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Re<6>,1|Re<7>,1|C<4>,1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]Re2)(H){1|H<1>,2|C<3>}	H(C[6]C[6,6a]C[6])	118.7290	0.000	1	118.7290	0.000	1	119.7746	1.103	237	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]ReH)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Re<7>,1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]C[6]ReH)(H){1|H<1>,2|C<3>}	H(C[6]C[6,6a]C[6])	123.5010	0.000	1	123.5010	0.000	1	119.7746	1.103	237	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]RhH)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Rh<8>,1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]C[6]RhH)(H){1|Rh<7>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.7750	0.000	1	119.7750	0.000	1	119.7746	1.103	237	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]RhO)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Rh<9>,1|C<4>,1|H<1>,1|O<2>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]RhO)(H){3|C<3>}	H(C[6]C[6,6a]C[6])	119.2730	0.095	2	119.2730	0.009	2	119.7746	1.103	237	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]RuH)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Ru<7>,1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]C[6]RuH)(H){3|C<3>}	H(C[6]C[6,6a]C[6])	119.4530	0.000	1	119.4530	0.000	1	119.7746	1.103	237	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]RuO)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Ru<8>,1|C<4>,1|H<1>,1|O<2>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]RuO)(H){1|C<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	118.9310	0.269	2	118.9310	0.072	2	119.7746	1.103	237	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]RuP)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Ru<8>,1|C<4>,1|H<1>,1|P<5>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]RuP)(H){3|C<3>}	H(C[6]C[6,6a]C[6])	119.2100	0.000	1	119.2100	0.000	1	119.7746	1.103	237	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]YbO)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Yb<12>,1|H<1>,1|O<2>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]YbO)(H){3|C<3>}	H(C[6]C[6,6a]C[6])	119.8775	0.112	2	119.8775	0.013	2	119.7746	1.103	237	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]CH)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<2>,1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]CH)(H){3|C<3>}	H(C[6]C[6,6a]C[6])	115.8320	3.336	3	118.2721	7.278	8	119.7746	1.103	237	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]CH)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]CH)(H){1|Re<6>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.8770	0.021	2	118.2721	7.278	8	119.7746	1.103	237	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]CH)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]CH)(H){3|C<3>}	H(C[6]C[6,6a]C[6])	119.6423	0.139	3	118.2721	7.278	8	119.7746	1.103	237	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]HH)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,3|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]HH)(H){3|C<3>}	H(C[6]C[6,6a]C[6])	119.7780	0.313	2	119.7780	0.098	2	119.7746	1.103	237	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]NiO)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Ni<6>,1|H<1>,1|N<3>,1|O<2>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]NiO)(H){2|C<3>}	H(C[6]C[6,6a]C[6])	119.4530	0.000	1	119.4530	0.000	1	119.7746	1.103	237	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]ReO)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Re<8>,1|H<1>,1|N<3>,1|O<2>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]ReO)(H){2|C<3>}	H(C[6]C[6,6a]C[6])	119.1530	0.000	1	119.1530	0.000	1	119.7746	1.103	237	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]RuH)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Ru<9>,1|N<4>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]RuH)(H){1|Ru<8>,2|C<3>}	H(C[6]C[6,6a]C[6])	122.7260	3.407	2	122.7260	11.607	2	119.7746	1.103	237	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]RuO)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Ru<7>,1|H<1>,1|N<3>,1|O<2>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]N[6]RuO)(H){2|C<3>}	H(C[6]C[6,6a]C[6])	119.6950	0.000	1	119.6950	0.000	1	119.7746	1.103	237	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]O[6]CC)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<3>,1|O<1>,2|C<4>,2|O<2>}	C[6](C[6]C[6,6a]H)(C[6]O[6]CC)(H){2|C<3>}	H(C[6]C[6,6a]C[6])	120.5920	0.000	1	120.4946	1.034	42	119.7746	1.103	237	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]O[6]CC)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|O<2>,2|C<3>,2|C<4>}	C[6](C[6]C[6,6a]H)(C[6]O[6]CC)(H){2|C<3>}	H(C[6]C[6,6a]C[6])	119.9244	0.191	9	120.4946	1.034	42	119.7746	1.103	237	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]O[6]CC)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,1|O<2>,2|C<3>,2|C<4>}	C[6](C[6]C[6,6a]H)(C[6]O[6]CC)(H){2|C<3>}	H(C[6]C[6,6a]C[6])	119.9000	0.000	1	120.4946	1.034	42	119.7746	1.103	237	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]O[6]CC)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|O<2>,2|C<4>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]O[6]CC)(H){2|C<3>}	H(C[6]C[6,6a]C[6])	120.0220	0.000	1	120.4946	1.034	42	119.7746	1.103	237	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]O[6]CC)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){2|C<3>,2|C<4>,2|O<2>}	C[6](C[6]C[6,6a]H)(C[6]O[6]CC)(H){2|C<3>}	H(C[6]C[6,6a]C[6])	120.6980	1.135	30	120.4946	1.034	42	119.7746	1.103	237	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]O[6]CH)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|O<2>,2|H<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]O[6]CH)(H){2|C<3>}	H(C[6]C[6,6a]C[6])	119.7760	0.000	1	119.7760	0.000	1	119.7746	1.103	237	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]HH)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H){1|C<4>,2|H<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]HH)(H){2|C<3>,2|H<1>}	H(C[6]C[6,6a]C[6])	119.5720	0.000	1	119.5720	0.000	1	119.7746	1.103	237	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]HO)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<2>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]HO)(H){1|H<1>,1|O<2>,2|C<3>}	H(C[6]C[6,6a]C[6])	120.5090	0.000	1	120.5090	0.000	1	119.7746	1.103	237	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]O[6]CC)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H){1|N<3>,1|O<2>,2|C<3>,2|C<4>}	C[6](C[6]C[6,6a]H)(C[6]O[6]CC)(H){2|C<3>}	H(C[6]C[6,6a]C[6])	120.2500	0.000	1	120.5551	0.415	16	119.7746	1.103	237	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]O[6]CC)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H){1|O<2>,2|C<4>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]O[6]CC)(H){2|C<3>}	H(C[6]C[6,6a]C[6])	120.3115	0.603	4	120.5551	0.415	16	119.7746	1.103	237	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]O[6]CC)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H){2|C<3>,2|C<4>,2|O<2>}	C[6](C[6]C[6,6a]H)(C[6]O[6]CC)(H){2|C<3>}	H(C[6]C[6,6a]C[6])	120.6714	0.682	11	120.5551	0.415	16	119.7746	1.103	237	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]O[6]HH)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H){1|O<2>,2|H<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]O[6]HH)(H){2|C<3>}	H(C[6]C[6,6a]C[6])	120.0040	0.044	2	120.0040	0.002	2	119.7746	1.103	237	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]HH)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|C<4>,2|H<1>,4|C<3>}	C[6](C[6]N[5,6]H)(C[6]C[6]HH)(H){1|C<3>,1|C<4>,2|H<1>}	H(C[6]N[5,6]C[6])	119.1190	0.000	1	119.1190	0.000	1	119.2555	0.037	2	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](N[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]CH)(H)	H(C[6]N[5,6]C[6])	C[6](N[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>,3|C<4>}	C[6](C[6]N[5,6]H)(C[6]C[6]CH)(H){1|H<1>,1|N<3>,2|C<3>}	H(C[6]N[5,6]C[6])	119.3920	0.000	1	119.3920	0.000	1	119.2555	0.037	2	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	N[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](N[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H)	C[6](C[6]N[5a,6]H)(C[6]C[6]HH)(H)	H(C[6]N[5a,6]C[6])	C[6](N[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H){1|C<4>,1|N<2>,2|C<3>,2|H<1>}	C[6](C[6]N[5a,6]H)(C[6]C[6]HH)(H){1|H<1>,1|O<2>,2|C<3>}	H(C[6]N[5a,6]C[6])	120.5230	0.000	1	120.5230	0.000	1	120.5230	0.000	1	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:1:	3:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](N[6,6]N[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]HH)(H)	H(C[6]N[6,6]C[6])	C[6](N[6,6]N[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|O<1>,2|C<4>,2|H<1>}	C[6](C[6]N[6,6]H)(C[6]C[6]HH)(H){1|C<3>,1|N<3>,2|H<1>}	H(C[6]N[6,6]C[6])	118.7130	0.031	2	118.7130	0.001	2	118.7130	0.001	2	119.1454	1.732	444	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:2:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:N-2:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]N)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(NC[6a])	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]N)(H){1|O<1>,2|H<1>,4|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(NC[6a]){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6,6]C[6])	117.8445	0.064	2	117.8445	0.004	2	118.0934	0.505	5	119.8911	4.928	25	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:2:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:N-2:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]N)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(NN)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]N)(H){4|C<4>,4|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(NN){2|C<4>,2|H<1>}	H(C[6]C[6,6]C[6])	117.7175	0.216	2	117.7175	0.047	2	118.0934	0.505	5	119.8911	4.928	25	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:2:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:N-2:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]N)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(NO)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]N)(H){4|C<4>,4|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(NO){2|C<4>,2|H<1>}	H(C[6]C[6,6]C[6])	119.3430	0.000	1	119.3430	0.000	1	118.0934	0.505	5	119.8911	4.928	25	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:2:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:O-2:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(OC)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]O)(H){3|C<4>,4|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(OC){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6,6]C[6])	119.1790	0.000	1	119.1790	0.000	1	119.1790	0.000	1	119.8911	4.928	25	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:2:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C-4:O[6]-2:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]O[6]C)(H)	C[6](C[6]C[6,6a]H)(CC[6a]HH)(O[6]C[6])	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]O[6]C)(H){1|H<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(CC[6a]HH)(O[6]C[6]){1|S<1>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.8150	0.000	1	119.8150	0.000	1	119.8150	0.000	1	119.8911	4.928	25	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:2:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[5]-4:O[6]-2:	C[6]-3:	C[6](C[6,6a]C[6,6,6a]C[6a])(C[6]C[5]O[6])(H)	C[6](C[6]C[6,6a]H)(C[5]C[5]2Fe)(O[6]C[6,6])	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6,6a]C[6a])(C[6]C[5]O[6])(H){1|Fe<10>,1|H<1>,2|C<4>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[5]C[5]2Fe)(O[6]C[6,6]){2|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6,6a]C[6])	119.8320	0.000	1	119.8320	0.000	1	119.8320	0.000	1	119.8911	4.928	25	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:2:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:O-2:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]O)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]HH)(OSi)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]O)(H){1|C<4>,2|C<3>,3|H<1>}	C[6](C[6]C[6,6a]H)(C[6]C[6]HH)(OSi){1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.8960	0.000	1	119.8960	0.000	1	119.8960	0.000	1	119.8911	4.928	25	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:2:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:O[6]-2:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]O[6])(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]2H)(O[6]C[6])	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]O[6])(H){2|C<4>,2|H<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]2H)(O[6]C[6]){1|N<2>,2|C<3>,2|C<4>,4|H<1>}	H(C[6]C[6,6a]C[6])	119.8020	0.000	1	119.5627	0.043	3	119.5627	0.043	3	119.8911	4.928	25	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:2:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:O[6]-2:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]O[6])(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]2H)(O[6]C[6])	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]O[6])(H){2|C<4>,2|H<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]2H)(O[6]C[6]){1|S<1>,2|C<3>,2|C<4>,4|H<1>}	H(C[6]C[6,6a]C[6])	119.4430	0.000	2	119.5627	0.043	3	119.5627	0.043	3	119.8911	4.928	25	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C-4:C[6]-2:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(CC[6a]HH)(C[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]C)(H){1|C<3>,1|O<1>}	C[6](C[6]C[6]H)(CC[6a]HH)(C[6]C[6]){2|Br<1>,1|C<3>}	H(C[6]C[6]2)	115.5900	0.000	1	118.4780	16.681	2	120.2922	15.099	4	119.8911	4.928	25	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C-4:C[6]-2:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(CC[6a]HH)(C[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]C)(H){1|C<3>,1|O<2>}	C[6](C[6]C[6]H)(CC[6a]HH)(C[6]C[6]){2|Br<1>,1|C<3>}	H(C[6]C[6]2)	121.3660	0.000	1	118.4780	16.681	2	120.2922	15.099	4	119.8911	4.928	25	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C-4:C[6]-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(CC[6a]2O)(C[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(CC[6a]2O)(C[6]C[6]){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.3270	0.000	1	119.3270	0.000	1	120.2922	15.099	4	119.8911	4.928	25	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C-4:C[6]-2:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]H)(CC[6a]HH)(C[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|N<2>}	C[6](C[6]C[6]H)(CC[6a]HH)(C[6]C[6]){1|C<3>,2|C<4>}	H(C[6]C[6]2)	124.8860	0.000	1	124.8860	0.000	1	120.2922	15.099	4	119.8911	4.928	25	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:P-4:C[6]-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](C[6]C[6]H)(PC[6]2Mo)(C[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|Cl<1>,1|C<3>}	C[6](C[6]C[6]H)(PC[6]2Mo)(C[6]C[6]){1|C<3>,2|H<1>}	H(C[6]C[6]2)	124.6980	0.000	1	124.6980	0.000	1	121.1009	6.867	7	119.8911	4.928	25	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:P-4:C[6]-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](C[6]C[6]H)(PC[6]MoC)(C[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(PC[6]MoC)(C[6]C[6]){1|C<3>,2|H<1>}	H(C[6]C[6]2)	117.9200	0.000	1	117.9200	0.000	1	121.1009	6.867	7	119.8911	4.928	25	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:P-4:C[6]-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](C[6]C[6]H)(PC[6]ReO)(C[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<3>}	C[6](C[6]C[6]H)(PC[6]ReO)(C[6]C[6]){1|C<2>,2|H<1>}	H(C[6]C[6]2)	124.3900	0.000	1	124.3900	0.000	1	121.1009	6.867	7	119.8911	4.928	25	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:P-4:C[6]-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](C[6]C[6]H)(PC[6a]2N)(C[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(PC[6a]2N)(C[6]C[6]){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.8515	1.118	2	120.8515	1.250	2	121.1009	6.867	7	119.8911	4.928	25	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:P-4:C[6]-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](C[6]C[6]H)(PC[6a]2O)(C[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(PC[6a]2O)(C[6]C[6]){1|C<3>,2|H<1>}	H(C[6]C[6]2)	118.8610	0.000	1	118.8610	0.000	1	121.1009	6.867	7	119.8911	4.928	25	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:P-4:C[6]-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](C[6]C[6]H)(PC[6a]CI)(C[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(PC[6a]CI)(C[6]C[6]){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1340	0.000	1	120.1340	0.000	1	121.1009	6.867	7	119.8911	4.928	25	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:2:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:C-4:O[6]-2:	C[6]-3:	C[6](C[6]O[6]C)(N[6]C[6]S)(H)	C[6](C[6]N[6]H)(CC[6a]HH)(O[6]C[6])	H(C[6]C[6]N[6])	C[6](C[6]O[6]C)(N[6]C[6]S)(H){1|C<4>,2|H<1>}	C[6](C[6]N[6]H)(CC[6a]HH)(O[6]C[6]){1|H<1>,1|S<4>,2|C<4>}	H(C[6]C[6]N[6])	119.3960	0.000	1	119.3960	0.000	1	119.3960	0.000	1	119.8911	4.928	25	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:2:	3:	C[6]-3:N[6]-3:H-1:	C[6]-3:S-4:N[6]-2:	C[6]-3:	C[6](C[6]N[6]S)(N[6]C[6]O)(H)	C[6](C[6]N[6]H)(SC[6a]OO)(N[6]C[6])	H(C[6]C[6]N[6])	C[6](C[6]N[6]S)(N[6]C[6]O)(H){1|C<3>,1|H<1>}	C[6](C[6]N[6]H)(SC[6a]OO)(N[6]C[6]){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]N[6])	121.1300	0.000	1	121.1300	0.000	1	121.1300	0.000	1	119.8911	4.928	25	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:3:	3:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:C-3:	C[6]-3:	C[6](C[5a,6]C[5a,6a]C[5a,6])(C[6]C[6]C)(H)	C[6](C[6]C[5a,6]H)(C[6]C[6]HH)(COO)	H(C[6]C[5a,6]C[6])	C[6](C[5a,6]C[5a,6a]C[5a,6])(C[6]C[6]C)(H){1|C<4>,1|O<2>,2|C<3>,2|H<1>}	C[6](C[6]C[5a,6]H)(C[6]C[6]HH)(COO){1|C<4>,3|C<3>}	H(C[6]C[5a,6]C[6])	120.8140	0.000	1	120.8140	0.000	1	120.8140	0.000	1	119.4753	1.719	194	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:C-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]C)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(CCC)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]C)(H){1|C<3>,2|C<4>,4|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(CCC){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6,6]C[6])	118.4170	0.000	1	118.4170	0.000	1	118.7095	0.171	2	119.4753	1.719	194	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:C-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]C)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(CCH)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]C)(H){3|C<4>,5|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(CCH){2|C<4>,2|H<1>}	H(C[6]C[6,6]C[6])	119.0020	0.000	1	119.0020	0.000	1	118.7095	0.171	2	119.4753	1.719	194	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:3:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:C-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]CH)(CC[6a]O)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H){1|Br<1>,1|C<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]CH)(CC[6a]O){1|H<1>,3|C<3>}	H(C[6]C[6,6a]C[6])	118.5580	0.000	1	118.7725	0.092	2	119.0128	0.556	15	119.4753	1.719	194	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:3:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:C-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]CH)(CC[6a]O)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H){1|C<4>,1|H<1>,1|N<3>,1|O<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]CH)(CC[6a]O){1|H<1>,3|C<3>}	H(C[6]C[6,6a]C[6])	118.9870	0.000	1	118.7725	0.092	2	119.0128	0.556	15	119.4753	1.719	194	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:3:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:C-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]CH)(CN[5]O)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H){1|C<4>,2|H<1>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]CH)(CN[5]O){1|H<1>,3|C<3>}	H(C[6]C[6,6a]C[6])	117.6810	0.000	1	117.6810	0.000	1	119.0128	0.556	15	119.4753	1.719	194	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:3:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:C-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]HO)(CCO)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H){1|C<3>,1|C<4>,1|H<1>,1|O<1>,2|O<2>}	C[6](C[6]C[6,6a]H)(C[6]C[6]HO)(CCO){2|C<3>,2|O<2>}	H(C[6]C[6,6a]C[6])	119.0820	0.000	1	119.0820	0.000	1	119.0128	0.556	15	119.4753	1.719	194	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:3:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:C-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]CH)(CHO)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]CH)(CHO){1|S<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.5840	0.000	1	119.5840	0.000	1	119.0128	0.556	15	119.4753	1.719	194	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:3:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:C-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]HH)(CC[6a]O)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H){1|N<3>,2|C<3>,3|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]HH)(CC[6a]O){1|S<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.2060	0.000	1	119.2060	0.000	1	119.0128	0.556	15	119.4753	1.719	194	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:3:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:C-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H)	C[6](C[6]C[6,6a]H)(C[6]O[6]CO)(CCO)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H){1|C<4>,1|H<1>,2|C<3>,2|O<2>}	C[6](C[6]C[6,6a]H)(C[6]O[6]CO)(CCO){2|C<3>}	H(C[6]C[6,6a]C[6])	119.1593	0.242	3	119.1593	0.059	3	119.0128	0.556	15	119.4753	1.719	194	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:3:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:C-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H)	C[6](C[6]C[6,6a]H)(C[6]O[6]CO)(CC[6a]O)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H){1|C<4>,1|H<1>,2|C<3>,2|O<2>}	C[6](C[6]C[6,6a]H)(C[6]O[6]CO)(CC[6a]O){2|C<3>}	H(C[6]C[6,6a]C[6])	118.9660	0.000	1	118.9660	0.000	1	119.0128	0.556	15	119.4753	1.719	194	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:3:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:C-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H)	C[6](C[6]C[6,6a]H)(C[6]O[6]HH)(CCO)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H){1|O<2>,2|C<3>,3|H<1>}	C[6](C[6]C[6,6a]H)(C[6]O[6]HH)(CCO){2|C<3>}	H(C[6]C[6,6a]C[6])	119.4660	0.000	1	119.4660	0.000	1	119.0128	0.556	15	119.4753	1.719	194	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:3:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:C-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H)	C[6](C[6]C[6,6a]H)(C[6]O[6]HH)(CHO)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H){1|O<2>,2|C<3>,3|H<1>}	C[6](C[6]C[6,6a]H)(C[6]O[6]HH)(CHO){2|C<3>}	H(C[6]C[6,6a]C[6])	119.6150	0.000	1	119.6150	0.000	1	119.0128	0.556	15	119.4753	1.719	194	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:3:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:C-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H)	C[6](C[6]C[6,6a]H)(C[6]S[6]HH)(CCH)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H){1|S<2>,2|C<3>,3|H<1>}	C[6](C[6]C[6,6a]H)(C[6]S[6]HH)(CCH){2|C<3>}	H(C[6]C[6,6a]C[6])	117.2370	0.000	1	117.2370	0.000	1	119.0128	0.556	15	119.4753	1.719	194	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:3:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:C-3:	C[6]-3:	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]C)(H)	C[6](C[6]C[6,6a]H)(C[6]O[6]CH)(COO)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]C)(H){1|H<1>,1|O<2>,4|C<3>}	C[6](C[6]C[6,6a]H)(C[6]O[6]CH)(COO){2|C<3>}	H(C[6]C[6,6a]C[6])	120.2460	0.000	1	120.2460	0.000	1	119.0128	0.556	15	119.4753	1.719	194	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:3:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:C-3:	C[6]-3:	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]C)(H)	C[6](C[6]C[6,6a]H)(C[6]O[6]CO)(CCO)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]C)(H){1|C<4>,2|C<3>,3|O<2>}	C[6](C[6]C[6,6a]H)(C[6]O[6]CO)(CCO){2|C<3>}	H(C[6]C[6,6a]C[6])	119.0860	0.000	1	119.0860	0.000	1	119.0128	0.556	15	119.4753	1.719	194	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:3:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:N-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]N)(H)	C[6](C[6]C[6,6a]H)(C[6]S[6]CH)(NOO)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]N)(H){1|C<4>,1|S<2>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]S[6]CH)(NOO){2|C<3>}	H(C[6]C[6,6a]C[6])	118.4880	0.000	1	118.4880	0.000	1	118.4880	0.000	1	119.4753	1.719	194	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:3:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:P[6]-4:C[6]-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]P[6])(H)	C[6](C[6]C[6,6a]H)(P[6]O[6]2O)(C[6]O[6]C)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]P[6])(H){1|H<1>,1|O<1>,3|C<3>,3|O<2>}	C[6](C[6]C[6,6a]H)(P[6]O[6]2O)(C[6]O[6]C){2|C<3>,2|C<4>}	H(C[6]C[6,6a]C[6])	119.4500	0.000	1	119.4500	0.000	1	119.4500	0.000	1	119.4753	1.719	194	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6]C)(H)	C[6](C[5]N[5]S[5])(C[6]C[6]TiO)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6]C)(H){1|Ti<8>,1|C<3>,1|H<1>,1|N<3>,1|O<2>,1|S<2>}	C[6](C[5]N[5]S[5])(C[6]C[6]TiO)(C[6]C[6]H){2|C<4>,3|C<3>}	H(C[6]C[6]2)	118.9825	0.347	4	118.9825	0.120	4	119.2174	0.366	5	119.4753	1.719	194	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H)	C[6](C[5]N[5]O[5])(C[6]C[6]Li2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H){2|Li<4>,1|C<3>,1|H<1>,1|N<3>,1|O<2>}	C[6](C[5]N[5]O[5])(C[6]C[6]Li2)(C[6]C[6]H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	120.1570	0.000	1	120.1570	0.000	1	119.2174	0.366	5	119.4753	1.719	194	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H)	C[6](C[5a]C[5a]N[5a])(C[6]C[6]CuH)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H){1|Cu<4>,1|N<2>,2|C<3>,2|H<1>}	C[6](C[5a]C[5a]N[5a])(C[6]C[6]CuH)(C[6]C[6]H){1|C<3>,1|N<2>,1|N<3>,1|P<4>,2|H<1>}	H(C[6]C[6]2)	119.9470	0.000	1	119.9470	0.000	1	118.2545	0.802	8	119.4753	1.719	194	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H)	C[6](C[5a]C[5a]N[5a])(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]H)(H){1|N<3>,2|C<3>,3|H<1>}	C[6](C[5a]C[5a]N[5a])(C[6]C[6]HH)(C[6]C[6]H){1|Pt<5>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	117.1560	0.000	2	117.1560	0.000	2	118.2545	0.802	8	119.4753	1.719	194	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]O)(H)	C[6](C[5a]C[5a]N[5a])(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|N<3>,4|H<1>}	C[6](C[5a]C[5a]N[5a])(C[6]C[6]HH)(C[6]C[6]H){1|C<4>,1|O<1>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	117.9140	0.000	1	118.2167	0.069	3	118.2545	0.802	8	119.4753	1.719	194	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]O)(H)	C[6](C[5a]C[5a]N[5a])(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]O)(H){1|C<4>,1|N<2>,2|C<3>,3|H<1>}	C[6](C[5a]C[5a]N[5a])(C[6]C[6]HH)(C[6]C[6]H){1|C<4>,1|N<3>,1|O<1>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	118.3820	0.000	1	118.2167	0.069	3	118.2545	0.802	8	119.4753	1.719	194	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]O)(H)	C[6](C[5a]C[5a]N[5a])(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]O)(H){1|C<4>,1|N<3>,2|C<3>,3|H<1>}	C[6](C[5a]C[5a]N[5a])(C[6]C[6]HH)(C[6]C[6]H){1|C<4>,1|H<1>,1|N<2>,1|O<2>,2|C<3>,2|O<1>}	H(C[6]C[6]2)	118.3540	0.000	1	118.2167	0.069	3	118.2545	0.802	8	119.4753	1.719	194	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]O)(H)	C[6](C[5a]C[5a]O[5a])(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]O)(H){1|C<4>,1|O<2>,2|C<3>,3|H<1>}	C[6](C[5a]C[5a]O[5a])(C[6]C[6]HH)(C[6]C[6]H){1|C<4>,1|O<1>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	118.6150	0.000	1	118.6150	0.000	1	118.2545	0.802	8	119.4753	1.719	194	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:3:	3:	C[6]-3:C[6]-3:H-1:	C[5a]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]O)(H)	C[6](C[5a]C[5a]S[5a])(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|S<2>,4|H<1>}	C[6](C[5a]C[5a]S[5a])(C[6]C[6]HH)(C[6]C[6]H){1|H<1>,1|O<1>,1|O<2>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	118.5120	0.000	1	118.5120	0.000	1	118.2545	0.802	8	119.4753	1.719	194	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:3:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6]C[6])(C[6]C[5,6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6a]2H)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]C[6])(C[6]C[5,6]H)(H){1|C<4>,1|H<1>,5|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6a]2H)(C[6]C[6]H){1|C<2>,1|C<4>,2|H<1>,5|C<3>}	H(C[6]C[6]2)	111.2480	0.000	1	111.2480	0.000	1	111.2480	0.000	1	119.4753	1.719	194	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:3:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C-4:C[6]-3:	C[6]-3:	C[6](C[6]C[3x6]N[6])(C[6]C[6,6a]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(CC[6,6]HO)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[3x6]N[6])(C[6]C[6,6a]C)(H){1|O<1>,2|C<3>,3|C<4>}	C[6](C[6,6a]C[6,6a]C[6a])(CC[6,6]HO)(C[6]C[6]H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	117.5880	0.000	1	117.5880	0.000	1	119.3406	0.906	14	119.4753	1.719	194	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:3:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(CC[6,6]HO)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H){1|C<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(CC[6,6]HO)(C[6]C[6]H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.2458	1.486	4	119.4755	0.705	13	119.3406	0.906	14	119.4753	1.719	194	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:3:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(CC[6,6]HO)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(CC[6,6]HO)(C[6]C[6]H){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.5776	0.438	9	119.4755	0.705	13	119.3406	0.906	14	119.4753	1.719	194	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:3:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[4]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]C[4])(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[4]C[4]2H)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C[4])(C[6]N[6]H)(H){1|H<1>,2|C<3>,3|C<4>}	C[6](C[6,6a]C[6,6a]C[6a])(C[4]C[4]2H)(C[6]C[6]H){1|C<4>,1|N<3>,4|C<3>,4|H<1>}	H(C[6]C[6]2)	122.1470	0.000	1	120.5320	2.280	3	120.5320	2.280	3	119.4753	1.719	194	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:3:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[4]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]C[4])(C[6]N[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[4]C[4]2H)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C[4])(C[6]N[6]H)(H){2|C<3>,2|C<4>,2|H<1>}	C[6](C[6,6a]C[6,6a]C[6a])(C[4]C[4]2H)(C[6]C[6]H){1|C<4>,1|N<3>,4|C<3>,4|H<1>}	H(C[6]C[6]2)	119.7245	0.805	2	120.5320	2.280	3	120.5320	2.280	3	119.4753	1.719	194	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:3:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]C[6])(C[6]C[6]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6a]C[6]H)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<1>,3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6a]C[6]H)(C[6]C[6]H){1|C<4>,1|S<4>,3|H<1>,5|C<3>}	H(C[6]C[6]2)	118.6290	0.000	1	118.6290	0.000	1	118.5200	0.024	2	119.4753	1.719	194	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:3:	3:	C[6]-3:C[6]-3:H-1:	C[6,6a]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]C[6])(C[6]C[6]O)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]2H)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C[6])(C[6]C[6]O)(H){1|C<4>,1|H<1>,1|O<1>,3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]2H)(C[6]C[6]H){1|C<4>,1|O<1>,4|C<3>,4|H<1>}	H(C[6]C[6]2)	118.4110	0.000	1	118.4110	0.000	1	118.5200	0.024	2	119.4753	1.719	194	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6]C)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]OV)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6]C)(H){1|H<1>,1|N<3>,1|O<2>,1|V<7>,2|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]OV)(C[6]C[6]H){1|H<1>,2|C<4>,3|C<3>}	H(C[6]C[6]2)	118.8585	0.088	2	118.8748	0.011	4	119.1327	0.377	16	119.4753	1.719	194	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6]C)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]OV)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6]C)(H){1|H<1>,1|N<3>,1|O<2>,1|V<8>,2|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]OV)(C[6]C[6]H){1|H<1>,2|C<4>,3|C<3>}	H(C[6]C[6]2)	118.8910	0.158	2	118.8748	0.011	4	119.1327	0.377	16	119.4753	1.719	194	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6]C)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]TaO)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6]C)(H){1|Ta<8>,1|H<1>,1|N<3>,1|O<2>,2|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]TaO)(C[6]C[6]H){1|H<1>,2|C<4>,3|C<3>}	H(C[6]C[6]2)	118.9425	0.396	6	118.9425	0.157	6	119.1327	0.377	16	119.4753	1.719	194	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6]C)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]TiO)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6]C)(H){1|Ti<7>,1|H<1>,1|N<3>,1|O<2>,2|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]TiO)(C[6]C[6]H){1|H<1>,2|C<4>,3|C<3>}	H(C[6]C[6]2)	119.2940	0.252	2	119.2940	0.063	2	119.1327	0.377	16	119.4753	1.719	194	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6]C)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]ZrO)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6]C)(H){1|Zr<10>,1|H<1>,1|N<3>,1|O<2>,2|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]ZrO)(C[6]C[6]H){1|H<1>,2|C<4>,3|C<3>}	H(C[6]C[6]2)	119.1870	0.000	1	119.1870	0.000	1	119.1327	0.377	16	119.4753	1.719	194	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]Fe2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6]H)(H){1|Fe<5>,1|Fe<6>,1|C<3>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]Fe2)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.7313	1.258	3	119.7313	1.582	3	119.1327	0.377	16	119.4753	1.719	194	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:N[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Cu2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){2|Cu<4>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Cu2)(C[6]C[6]H){1|H<1>,5|C<3>}	H(C[6]C[6]2)	119.6010	0.165	2	119.6010	0.027	2	119.6010	0.027	2	119.4753	1.719	194	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-3:P[5]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6]P[5])(C[6]C[6]H)(H)	C[6](C[6]C[6]P[5])(P[5]C[5]2Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]P[5])(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,1|P<4>,3|C<4>}	C[6](C[6]C[6]P[5])(P[5]C[5]2Pt)(C[6]C[6]H){1|C<3>,5|H<1>,6|C<4>}	H(C[6]C[6]2)	120.3790	0.000	1	120.3790	0.000	1	120.3790	0.000	1	119.4753	1.719	194	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[5,6]O)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[5,6]O)(H){1|C<4>,2|H<1>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]HH)(C[6]C[6]H){1|C<4>,1|O<1>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	117.9990	0.000	1	117.6655	0.222	2	118.7688	0.998	41	119.4753	1.719	194	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[5,6]O)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[5,6]O)(H){1|C<4>,2|H<1>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]HH)(C[6]C[6]H){1|O<1>,2|C<3>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	117.3320	0.000	1	117.6655	0.222	2	118.7688	0.998	41	119.4753	1.719	194	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]CF)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|C<4>,1|F<1>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]CF)(C[6]C[6]H){1|C<4>,1|O<2>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.2160	0.000	1	119.2160	0.000	1	118.7688	0.998	41	119.4753	1.719	194	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]CO)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|O<2>,2|C<4>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]CO)(C[6]C[6]H){1|F<1>,3|H<1>,4|C<3>}	H(C[6]C[6]2)	120.0650	0.000	1	120.0650	0.000	1	118.7688	0.998	41	119.4753	1.719	194	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N)(H){1|C<4>,2|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]HH)(C[6]C[6]H){1|N<1>,3|H<1>,4|C<3>}	H(C[6]C[6]2)	119.1820	0.000	1	119.1100	0.010	3	118.7688	0.998	41	119.4753	1.719	194	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N)(H){1|C<4>,2|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]HH)(C[6]C[6]H){1|N<3>,3|H<1>,4|C<3>}	H(C[6]C[6]2)	119.0740	0.107	2	119.1100	0.010	3	118.7688	0.998	41	119.4753	1.719	194	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]CH)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N[6])(H){1|Al<5>,1|C<4>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]CH)(C[6]C[6]H){1|N<3>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.3000	0.000	1	119.3000	0.000	1	118.7688	0.998	41	119.4753	1.719	194	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]O)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]CO)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]O)(H){1|C<4>,1|O<2>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]CO)(C[6]C[6]H){1|O<1>,1|O<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	118.5150	0.000	1	118.5150	0.000	1	118.7688	0.998	41	119.4753	1.719	194	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]O)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]O)(H){1|C<4>,1|S<4>,2|C<3>,3|H<1>}	C[6](C[6a]C[6a]2)(C[6]C[6]HH)(C[6]C[6]H){1|C<4>,1|O<1>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	117.7170	0.201	2	118.3341	0.317	19	118.7688	0.998	41	119.4753	1.719	194	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]O)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]O)(H){1|C<4>,2|C<3>,4|H<1>}	C[6](C[6a]C[6a]2)(C[6]C[6]HH)(C[6]C[6]H){1|C<4>,1|N<3>,1|O<1>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	118.5410	0.000	1	118.3341	0.317	19	118.7688	0.998	41	119.4753	1.719	194	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]O)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]O)(H){1|C<4>,2|C<3>,4|H<1>}	C[6](C[6a]C[6a]2)(C[6]C[6]HH)(C[6]C[6]H){1|C<4>,1|O<1>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	118.3910	0.000	1	118.3341	0.317	19	118.7688	0.998	41	119.4753	1.719	194	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]O)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]O)(H){1|C<4>,2|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]HH)(C[6]C[6]H){1|O<1>,3|H<1>,4|C<3>}	H(C[6]C[6]2)	119.0585	0.036	2	118.3341	0.317	19	118.7688	0.998	41	119.4753	1.719	194	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]O)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]O)(H){1|C<4>,3|C<3>,3|H<1>}	C[6](C[6a]C[6a]2)(C[6]C[6]HH)(C[6]C[6]H){1|C<4>,1|O<1>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	118.0847	0.232	9	118.3341	0.317	19	118.7688	0.998	41	119.4753	1.719	194	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]O)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]O)(H){1|C<4>,3|C<3>,3|H<1>}	C[6](C[6a]C[6a]2)(C[6]C[6]HH)(C[6]C[6]H){1|Cl<1>,1|C<4>,1|O<1>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	118.3700	0.178	3	118.3341	0.317	19	118.7688	0.998	41	119.4753	1.719	194	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]O)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]O)(H){2|C<4>,2|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]HH)(C[6]C[6]H){1|C<4>,1|O<1>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	119.9930	0.000	1	118.3341	0.317	19	118.7688	0.998	41	119.4753	1.719	194	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]O)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]HO)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]O)(H){1|C<4>,1|O<2>,2|C<3>,3|H<1>}	C[6](C[6a]C[6a]2)(C[6]C[6]HO)(C[6]C[6]H){1|C<4>,1|O<1>,1|O<2>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	118.8240	0.000	1	118.8240	0.000	1	118.7688	0.998	41	119.4753	1.719	194	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]CO)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6a]N[6])(H){1|O<2>,2|C<4>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]CO)(C[6]C[6]H){1|N<2>,1|O<2>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.6000	0.000	1	119.6000	0.000	1	118.7688	0.998	41	119.4753	1.719	194	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6a]O[6])(H)	C[6](C[6a]C[6a]2)(C[6]B[6]HH)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6a]O[6])(H){1|B<4>,2|H<1>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]B[6]HH)(C[6]C[6]H){1|O<2>,2|F<1>,5|C<3>}	H(C[6]C[6]2)	119.7865	0.176	2	119.7865	0.031	2	118.7688	0.998	41	119.4753	1.719	194	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]O)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]CH)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]O)(H){1|C<4>,1|H<1>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]CH)(C[6]C[6]H){1|N<3>,1|O<1>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	121.3980	2.189	2	121.3980	4.793	2	118.7688	0.998	41	119.4753	1.719	194	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]O)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]O)(H){1|C<4>,1|S<4>,2|C<3>,2|H<1>}	C[6](C[6a]C[6a]2)(C[6]C[6]HH)(C[6]C[6]H){1|N<3>,1|O<1>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	117.9460	0.000	1	118.0503	0.086	3	118.7688	0.998	41	119.4753	1.719	194	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]O)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]O)(H){1|C<4>,2|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]HH)(C[6]C[6]H){1|C<4>,1|N<3>,1|O<1>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	117.8230	0.000	1	118.0503	0.086	3	118.7688	0.998	41	119.4753	1.719	194	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]O)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]O)(H){2|H<1>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]HH)(C[6]C[6]H){1|N<3>,2|C<3>,2|H<1>,2|O<1>}	H(C[6]C[6]2)	118.3820	0.000	1	118.0503	0.086	3	118.7688	0.998	41	119.4753	1.719	194	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]O[6]O)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]O[6]O)(H){2|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]HH)(C[6]C[6]H){1|O<2>,2|C<3>,2|H<1>,2|O<1>}	H(C[6]C[6]2)	119.6935	0.394	2	119.6935	0.155	2	118.7688	0.998	41	119.4753	1.719	194	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])2(H)	C[6](C[6a]C[6a]2)(C[6]C[6]CH)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])2(H){1|C<4>,2|H<1>,5|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]CH)(C[6]C[6]H){1|C<4>,2|H<1>,5|C<3>}	H(C[6]C[6]2)	118.1890	0.000	1	118.5420	0.249	2	118.7688	0.998	41	119.4753	1.719	194	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])2(H)	C[6](C[6a]C[6a]2)(C[6]C[6]CH)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])2(H){1|Si<4>,1|C<4>,1|H<1>,5|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]CH)(C[6]C[6]H){1|C<4>,3|H<1>,4|C<3>}	H(C[6]C[6]2)	118.8950	0.000	1	118.5420	0.249	2	118.7688	0.998	41	119.4753	1.719	194	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:3:	3:	C[6]-3:C[6]-3:H-1:	C[6a]-3:S[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6a]S[6])(H)	C[6](C[6a]C[6a]2)(S[6]O[6]OO)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6a]S[6])(H){1|O<2>,2|O<1>,5|C<3>}	C[6](C[6a]C[6a]2)(S[6]O[6]OO)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	116.7830	0.000	1	116.7830	0.000	1	116.7830	0.000	1	119.4753	1.719	194	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:3:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:P-4:C[6]-3:	C[6]-3:	C[6](C[6]N[5,6]P)(C[6]C[6]H)(H)	C[6](N[5,6]Ga[5,5]C[5,6])(PC[6a]2Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]P)(C[6]C[6]H)(H){1|Ga<5>,1|C<3>,1|H<1>}	C[6](N[5,6]Ga[5,5]C[5,6])(PC[6a]2Pd)(C[6]C[6]H){1|Cl<1>,1|H<1>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	120.4175	0.185	2	120.4175	0.034	2	120.6080	0.075	4	119.4753	1.719	194	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:3:	3:	C[6]-3:C[6]-3:H-1:	N[5,6]-3:P-4:C[6]-3:	C[6]-3:	C[6](C[6]N[5,6]P)(C[6]C[6]H)(H)	C[6](N[5,6]In[5,5]C[5,6])(PC[6a]2Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]P)(C[6]C[6]H)(H){1|In<6>,1|C<3>,1|H<1>}	C[6](N[5,6]In[5,5]C[5,6])(PC[6a]2Pd)(C[6]C[6]H){2|Cl<1>,1|H<1>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	120.7985	0.211	2	120.7985	0.045	2	120.6080	0.075	4	119.4753	1.719	194	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:3:	3:	C[6]-3:C[6]-3:H-1:	N[5]-3:N[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]Cu2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]H)(H){2|Cu<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](N[5]C[5]N[5])(N[6]C[6]Cu2)(C[6]C[6]H){1|C<4>,1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	121.3695	0.474	2	121.3695	0.225	2	121.3695	0.225	2	119.4753	1.719	194	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:As-4:C[6]-3:	C[6]-3:	C[6](C[6]N[6]As)(C[6]C[6]H)(H)	C[6](N[6]C[6]Co)(AsC[6a]2O)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[6]As)(C[6]C[6]H)(H){1|Co<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(AsC[6a]2O)(C[6]C[6]H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	121.5780	0.571	2	121.5780	0.326	2	121.5780	0.326	2	119.4753	1.719	194	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]B[6,6]C[6])(CB[6,6]HH)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](N[6]B[6,6]C[6])(CB[6,6]HH)(C[6]C[6]H){1|C<3>,2|H<1>,3|C<4>}	H(C[6]C[6]2)	118.9710	0.250	2	118.9710	0.063	2	119.2735	0.145	4	119.4753	1.719	194	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Li)(CB[6,6]HH)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Li<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Li)(CB[6,6]HH)(C[6]C[6]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.6270	0.000	1	119.6270	0.000	1	119.2735	0.145	4	119.4753	1.719	194	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(CB[6,6]HH)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(CB[6,6]HH)(C[6]C[6]H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	119.5250	0.000	1	119.5250	0.000	1	119.2735	0.145	4	119.4753	1.719	194	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6,6]H)(H)	C[6](N[6]C[6,6]Rh)(C[5]C[5]2Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6,6]H)(H){1|Fe<10>,1|Rh<4>,2|C<3>,2|C<4>}	C[6](N[6]C[6,6]Rh)(C[5]C[5]2Fe)(C[6]C[6]H){1|C<3>,1|N<3>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	119.5205	0.373	2	119.5205	0.139	2	119.8363	0.369	3	119.4753	1.719	194	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[5]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H)	C[6](N[6]C[6,6a]Pd)(C[5]C[5]2Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H){1|Fe<10>,1|Pd<4>,2|C<3>,2|C<4>}	C[6](N[6]C[6,6a]Pd)(C[5]C[5]2Fe)(C[6]C[6]H){2|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	120.4680	0.000	1	120.4680	0.000	1	119.8363	0.369	3	119.4753	1.719	194	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H)	C[6](N[6]C[6,6a]Re)(C[6]N[6]2H)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]N[6])(H){1|Re<6>,1|H<1>,1|N<3>,1|N<4>,2|C<3>}	C[6](N[6]C[6,6a]Re)(C[6]N[6]2H)(C[6]C[6]H){2|C<3>,2|H<1>,3|C<4>}	H(C[6]C[6]2)	120.4600	0.000	1	120.4600	0.000	1	120.4600	0.000	1	119.4753	1.719	194	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:N-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](N[6]C[6]Ni)(NC[6a]Ni2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni)(NC[6a]Ni2)(C[6]C[6]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	122.7930	3.076	2	122.7930	9.461	2	122.7930	9.461	2	119.4753	1.719	194	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:P-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]P)(H)	C[6](N[6]C[6]Cu)(PC[6a]2Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]P)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(PC[6a]2Cu)(C[6]C[6]H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.5308	0.195	5	119.5308	0.038	5	120.3215	0.339	57	119.4753	1.719	194	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:P-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	C[6](N[6]C[6]Al)(PC[6a]2Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Al<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Al)(PC[6a]2Pd)(C[6]C[6]H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.5115	0.373	8	120.5115	0.139	8	120.3215	0.339	57	119.4753	1.719	194	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:P-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	C[6](N[6]C[6]Al)(PC[6a]2Rh)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Al<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Al)(PC[6a]2Rh)(C[6]C[6]H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.4810	0.197	2	120.4810	0.039	2	120.3215	0.339	57	119.4753	1.719	194	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:P-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	C[6](N[6]C[6]Co)(PC[6a]2Co)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Co<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co)(PC[6a]2Co)(C[6]C[6]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8990	0.225	2	119.8990	0.051	2	120.3215	0.339	57	119.4753	1.719	194	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:P-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	C[6](N[6]C[6]Cu)(PC[6a]2Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Cu<3>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(PC[6a]2Cu)(C[6]C[6]H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.5730	0.247	11	120.3223	0.137	25	120.3215	0.339	57	119.4753	1.719	194	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:P-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	C[6](N[6]C[6]Cu)(PC[6a]2Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Cu<3>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(PC[6a]2Cu)(C[6]C[6]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5457	0.252	3	120.3223	0.137	25	120.3215	0.339	57	119.4753	1.719	194	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:P-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	C[6](N[6]C[6]Cu)(PC[6a]2Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(PC[6a]2Cu)(C[6]C[6]H){1|C<3>,1|F<1>,1|H<1>}	H(C[6]C[6]2)	119.8610	0.000	1	120.3223	0.137	25	120.3215	0.339	57	119.4753	1.719	194	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:P-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	C[6](N[6]C[6]Cu)(PC[6a]2Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Cu)(PC[6a]2Cu)(C[6]C[6]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0257	0.262	10	120.3223	0.137	25	120.3215	0.339	57	119.4753	1.719	194	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:P-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	C[6](N[6]C[6]Fe)(PC[6a]2Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Fe<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(PC[6a]2Fe)(C[6]C[6]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3610	0.000	1	120.3610	0.000	1	120.3215	0.339	57	119.4753	1.719	194	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:P-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	C[6](N[6]C[6]Ir)(PC[6a]2Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Ir<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(PC[6a]2Ir)(C[6]C[6]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2700	0.197	2	120.5002	0.358	4	120.3215	0.339	57	119.4753	1.719	194	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:P-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	C[6](N[6]C[6]Ir)(PC[6a]2Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Ir<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(PC[6a]2Ir)(C[6]C[6]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.7305	0.907	2	120.5002	0.358	4	120.3215	0.339	57	119.4753	1.719	194	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:P-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	C[6](N[6]C[6]Ir)(PC[6a]IrC)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Ir<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ir)(PC[6a]IrC)(C[6]C[6]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.9770	0.000	1	120.9770	0.000	1	120.3215	0.339	57	119.4753	1.719	194	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:P-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	C[6](N[6]C[6]Li)(PC[6a]2Rh)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Li<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Li)(PC[6a]2Rh)(C[6]C[6]H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.4320	0.000	1	120.4320	0.000	1	120.3215	0.339	57	119.4753	1.719	194	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:P-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	C[6](N[6]C[6]Mo)(PC[6a]2Mo)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Mo<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mo)(PC[6a]2Mo)(C[6]C[6]H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.2200	0.000	1	120.2200	0.000	1	120.3215	0.339	57	119.4753	1.719	194	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:P-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	C[6](N[6]C[6]Pd)(PC[6a]2Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Pd)(PC[6a]2Pd)(C[6]C[6]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1625	0.091	2	120.1625	0.008	2	120.3215	0.339	57	119.4753	1.719	194	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:P-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	C[6](N[6]C[6]Rh)(PC[6a]2Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Rh<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(PC[6a]2Ir)(C[6]C[6]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9310	0.000	1	119.9310	0.000	1	120.3215	0.339	57	119.4753	1.719	194	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:P-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	C[6](N[6]C[6]Rh)(PC[6a]2Rh)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Rh<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Rh)(PC[6a]2Rh)(C[6]C[6]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1980	0.000	1	120.1980	0.000	1	120.3215	0.339	57	119.4753	1.719	194	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:P-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	C[6](N[6]C[6]Ru)(PC[6a]2Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Ru<9>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(PC[6a]2Ir)(C[6]C[6]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5990	0.000	1	120.5990	0.000	1	120.3215	0.339	57	119.4753	1.719	194	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:P-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	C[6](N[6]C[6]Zn)(PC[6a]2Re)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Zn<3>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(PC[6a]2Re)(C[6]C[6]H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	123.1660	0.000	1	123.1660	0.000	1	120.3215	0.339	57	119.4753	1.719	194	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:P-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	C[6](N[6]C[6a]C[6])(PC[6a]2Au)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|H<1>,2|C<3>}	C[6](N[6]C[6a]C[6])(PC[6a]2Au)(C[6]C[6]H){2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.5520	0.000	1	119.5520	0.000	1	120.3215	0.339	57	119.4753	1.719	194	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:3:	3:	C[6]-3:N[6]-3:H-1:	C[6a]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(N[6]C[6a]C[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]CH)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[6a]C[6])(N[6]C[6a]C[6])(H){1|C<4>,2|H<1>,5|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]CH)(C[6]N[6]H){2|C<4>,5|C<3>}	H(C[6]C[6]N[6])	117.6845	0.153	2	117.6845	0.024	2	117.6845	0.024	2	119.4753	1.719	194	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:3:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:C-3:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]C)(H)	C[6](C[6]N[5,6]H)(C[6]C[6]HH)(COO)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]C)(H){1|C<3>,3|C<4>,4|H<1>}	C[6](C[6]N[5,6]H)(C[6]C[6]HH)(COO){2|C<4>,2|H<1>}	H(C[6]N[5,6]C[6])	118.2700	0.000	1	118.2700	0.000	1	118.2700	0.000	1	119.4753	1.719	194	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:3:	3:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:C-3:	C[6]-3:	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]C)(H)	C[6](C[6]N[6,6]H)(C[6]C[6]CH)(COO)	H(C[6]N[6,6]C[6])	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]C)(H){2|C<3>,2|C<4>,4|H<1>}	C[6](C[6]N[6,6]H)(C[6]C[6]CH)(COO){2|C<4>,2|H<1>}	H(C[6]N[6,6]C[6])	119.5570	2.826	2	119.5570	7.984	2	119.5570	7.984	2	119.4753	1.719	194	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:4:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:C-4:	C[6]-3:	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]C)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(CCCH)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]C)(H){2|C<3>,2|H<1>,3|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(CCCH){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[5,6]C[6])	119.0545	0.234	2	119.0545	0.055	2	118.8100	0.134	6	118.8806	0.313	29	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:4:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:C-4:	C[6]-3:	C[6](C[5,6]C[5,6]N[5])(C[6]C[6]C)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]CH)(CC3)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]N[5])(C[6]C[6]C)(H){1|In<5>,1|C<4>,1|H<1>,1|O<2>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]CH)(CC3){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[5,6]C[6])	118.6877	0.381	4	118.6877	0.145	4	118.8100	0.134	6	118.8806	0.313	29	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:4:	3:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:C-4:	C[6]-3:	C[6](C[5a,6]N[5a,6]C[5a])(C[6]C[6]C)(H)	C[6](C[6]C[5a,6]H)(C[6]C[6]CH)(CHHO)	H(C[6]C[5a,6]C[6])	C[6](C[5a,6]N[5a,6]C[5a])(C[6]C[6]C)(H){1|C<3>,1|N<2>,2|C<4>,2|H<1>}	C[6](C[6]C[5a,6]H)(C[6]C[6]CH)(CHHO){1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[5a,6]C[6])	119.5650	0.000	1	119.5650	0.000	1	119.5650	0.000	1	118.8806	0.313	29	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:4:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:C-4:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]C)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(CCCH)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]C)(H){3|C<4>,4|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(CCCH){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6,6]C[6])	118.0050	0.000	1	118.0050	0.000	1	118.0050	0.000	1	118.8806	0.313	29	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:4:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[5]-4:C[6]-4:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5]C[6])(H)	C[6](C[6]C[6,6a]H)(C[5]C[5]2Ti)(C[6]C[6]TiO)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5]C[6])(H){1|Ti<9>,1|H<1>,1|O<2>,2|C<4>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[5]C[5]2Ti)(C[6]C[6]TiO){3|C<3>,4|C<4>}	H(C[6]C[6,6a]C[6])	119.6103	0.296	3	119.6103	0.088	3	119.6103	0.088	3	118.8806	0.313	29	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:4:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:C-4:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]HH)(CCCH)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H){1|C<4>,2|C<3>,3|H<1>}	C[6](C[6]C[6,6a]H)(C[6]C[6]HH)(CCCH){2|C<3>,2|H<1>}	H(C[6]C[6,6a]C[6])	118.7580	0.000	1	118.7580	0.000	1	119.2377	0.186	6	118.8806	0.313	29	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:4:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:C-4:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]HO)(CH3)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H){1|C<4>,1|O<2>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]H)(C[6]C[6]HO)(CH3){2|C<3>,2|C<4>}	H(C[6]C[6,6a]C[6])	118.9905	0.323	2	118.9905	0.104	2	119.2377	0.186	6	118.8806	0.313	29	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:4:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:C-4:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H)	C[6](C[6]C[6,6a]H)(C[6]N[6]HH)(CH3)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H){1|N<3>,2|C<3>,3|H<1>}	C[6](C[6]C[6,6a]H)(C[6]N[6]HH)(CH3){3|C<3>}	H(C[6]C[6,6a]C[6])	119.5480	0.000	1	119.5480	0.000	1	119.2377	0.186	6	118.8806	0.313	29	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:4:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:C-4:	C[6]-3:	C[6](C[6,6a]C[6,6a]O[6a])(C[6]C[6]C)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]HO)(CH3)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]O[6a])(C[6]C[6]C)(H){1|C<4>,1|H<1>,1|O<2>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]HO)(CH3){1|H<1>,1|O<2>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.5695	0.398	2	119.5695	0.158	2	119.2377	0.186	6	118.8806	0.313	29	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:4:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:Si-4:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]Si)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]TiO)(SiC3)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]Si)(H){1|Ti<11>,1|H<1>,1|O<2>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]TiO)(SiC3){3|C<3>}	H(C[6]C[6,6a]C[6])	118.6490	0.510	8	118.6490	0.260	8	118.5708	0.202	12	118.8806	0.313	29	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:4:4:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:C[6]-4:Si-4:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]Si)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]ZrO)(SiC3)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]Si)(H){1|Zr<13>,1|H<1>,1|O<2>,3|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]ZrO)(SiC3){3|C<3>}	H(C[6]C[6,6a]C[6])	118.4145	0.290	4	118.4145	0.084	4	118.5708	0.202	12	118.8806	0.313	29	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:5:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C-5:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(CC[6]DyOO)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(CC[6]DyOO)(C[6]C[6]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5335	0.009	2	120.5335	0.000	2	120.7534	0.203	14	120.7534	0.203	14	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:5:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C-5:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(CC[6]FeOO)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<8>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(CC[6]FeOO)(C[6]C[6]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	121.0035	0.073	4	121.0035	0.005	4	120.7534	0.203	14	120.7534	0.203	14	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:5:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C-5:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Fe)(CC[6]GdOO)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(CC[6]GdOO)(C[6]C[6]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2537	0.187	4	120.2537	0.035	4	120.7534	0.203	14	120.7534	0.203	14	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:5:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C-5:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Re)(CC[6]ReOO)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Re<7>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Re)(CC[6]ReOO)(C[6]C[6]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.9760	0.154	2	120.9760	0.024	2	120.7534	0.203	14	120.7534	0.203	14	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	3:5:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-3:C-5:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(CC[6]RuOO)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ru<10>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ru)(CC[6]RuOO)(C[6]C[6]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	121.2500	0.745	2	121.2500	0.555	2	120.7534	0.203	14	120.7534	0.203	14	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:2:3:	3:	C[6]-3:C[6]-3:H-1:	C[4]-4:O[6]-2:C[6]-3:	C[6]-3:	C[6](C[6]C[4]O[6])(C[6]C[3x6]O)(H)	C[6](C[4]C[4]2H)(O[6]C[3x6])(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[4]O[6])(C[6]C[3x6]O)(H){1|H<1>,1|O<2>,4|C<4>}	C[6](C[4]C[4]2H)(O[6]C[3x6])(C[6]C[6]H){1|O<1>,3|H<1>,5|C<4>}	H(C[6]C[6]2)	119.1610	0.000	1	119.1610	0.000	1	119.1610	0.000	1	119.1610	0.000	1	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	B[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](B[6]N[6]N)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]B[6]H)(H)	H(C[6]B[6]C[6])	C[6](B[6]N[6]N)(C[6]C[6]H)(H){2|C<4>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]B[6]H)(H){2|H<1>,2|N<3>}	H(C[6]B[6]C[6])	119.5820	0.000	1	119.5820	0.000	1	119.5820	0.000	1	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[3,5,6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5])(C[6]C[3,5,6,6]H)(H)	C[6](C[3,5,6,6]C[3,5,6,6]C[3,6,6]C[5,6])(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5])(C[6]C[3,5,6,6]H)(H){1|O<2>,2|H<1>,4|C<4>}	C[6](C[3,5,6,6]C[3,5,6,6]C[3,6,6]C[5,6])(C[6]C[5,6]H)(H){1|C<2>,2|C<3>,2|H<1>,3|C<4>}	H(C[6]C[5,6]C[6])	120.3245	0.593	2	120.3245	0.352	2	120.3245	0.352	2	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[3,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[5,6]C[5,6]N[5])(C[6]C[3,6]O)(H)	C[6](C[3,6]C[3]C[6]O[3])(C[6]C[5,6]H)(O)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]N[5])(C[6]C[3,6]O)(H){1|O<2>,2|C<4>,3|C<3>}	C[6](C[3,6]C[3]C[6]O[3])(C[6]C[5,6]H)(O){1|C<3>,1|N<3>,3|H<1>}	H(C[6]C[5,6]C[6])	120.6170	0.000	1	120.6170	0.000	1	119.9865	0.795	2	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[3,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[5,6]C[5,6]P[5])(C[6]C[3,6]O)(H)	C[6](C[3,6]C[3,6]O[3]C)(C[6]C[5,6]H)(O)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]P[5])(C[6]C[3,6]O)(H){1|O<2>,1|W<6>,2|C<3>,4|C<4>}	C[6](C[3,6]C[3,6]O[3]C)(C[6]C[5,6]H)(O){1|C<3>,1|C<4>,1|P<4>}	H(C[6]C[5,6]C[6])	119.3560	0.000	1	119.3560	0.000	1	119.9865	0.795	2	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[4,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5])(C[6]C[4,6]H)(H)	C[6](C[4,6]C[4,5]C[4,6]H)(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5])(C[6]C[4,6]H)(H){1|H<1>,1|O<1>,4|C<4>}	C[6](C[4,6]C[4,5]C[4,6]H)(C[6]C[5,6]H)(H){1|H<1>,1|O<2>,2|C<3>,2|C<4>}	H(C[6]C[5,6]C[6])	120.1170	0.000	1	120.1170	0.000	1	120.1170	0.000	1	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,5,6]C[5])(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,6]N[5,6]H)(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,5,6]C[5])(C[6]C[5,6]H)(H){1|C<3>,1|N<3>,1|O<2>,2|C<4>,2|H<1>}	C[6](C[5,6]C[5,6]N[5,6]H)(C[6]C[5,6]H)(H){1|C<3>,2|H<1>,3|C<4>}	H(C[6]C[5,6]C[6])	120.5490	0.000	1	120.5490	0.000	1	119.3682	0.542	5	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6,6]C[5])(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,6,6]C[5]Hf)(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6,6]C[5])(C[6]C[5,6]H)(H){1|Hf<12>,2|C<3>,2|C<4>,2|H<1>}	C[6](C[5,6]C[5,6,6]C[5]Hf)(C[6]C[5,6]H)(H){1|C<3>,1|H<1>,3|C<4>}	H(C[6]C[5,6]C[6])	118.6680	0.000	1	118.6680	0.000	1	119.3682	0.542	5	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]N[5])(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,6]C[5]Fe)(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]N[5])(C[6]C[5,6]H)(H){1|Fe<10>,4|C<4>}	C[6](C[5,6]C[5,6]C[5]Fe)(C[6]C[5,6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<4>}	H(C[6]C[5,6]C[6])	119.2080	0.322	3	119.2080	0.104	3	119.3682	0.542	5	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[5,6]C[5,6]O[5])(C[6]C[5,6]O)(H)	C[6](C[5,6]C[5]2C[6])(C[6]C[5,6]H)(O)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]O[5])(C[6]C[5,6]O)(H){1|C<3>,1|O<2>,3|C<4>}	C[6](C[5,6]C[5]2C[6])(C[6]C[5,6]H)(O){1|C<4>,2|O<2>,3|C<3>,3|H<1>}	H(C[6]C[5,6]C[6])	121.4720	0.000	1	121.4720	0.000	1	121.4720	0.000	1	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6,6]C[5])(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6]N[5,6]H)(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6,6]C[5])(C[6]C[6,6]H)(H){1|C<3>,1|N<3>,1|O<2>,2|C<4>,2|H<1>}	C[6](C[6,6]C[6,6]N[5,6]H)(C[6]C[5,6]H)(H){1|C<3>,2|H<1>,3|C<4>}	H(C[6]C[5,6]C[6])	120.4090	0.000	1	120.4090	0.000	1	120.4090	0.000	1	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5])(C[6]C[6,6]O)(H)	C[6](C[6,6]C[6,6]2C)(C[6]C[5,6]H)(O)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5])(C[6]C[6,6]O)(H){8|C<4>}	C[6](C[6,6]C[6,6]2C)(C[6]C[5,6]H)(O){1|C<3>,2|H<1>,4|C<4>}	H(C[6]C[5,6]C[6])	118.3810	0.000	1	118.3810	0.000	1	119.6330	3.135	2	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[5,6]C[5,6]O[5])(C[6]C[6,6]O)(H)	C[6](C[6,6]C[5,6]C[6]2)(C[6]C[5,6]H)(O)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]O[5])(C[6]C[6,6]O)(H){1|C<3>,1|O<2>,3|C<4>}	C[6](C[6,6]C[5,6]C[6]2)(C[6]C[5,6]H)(O){1|C<4>,1|N<3>,1|O<2>,2|C<3>,4|H<1>}	H(C[6]C[5,6]C[6])	120.8850	0.000	1	120.8850	0.000	1	119.6330	3.135	2	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]C[6a]H)(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<1>,3|C<3>}	C[6](C[6]C[5,6]C[6a]H)(C[6]C[5,6]H)(H){6|C<3>}	H(C[6]C[5,6]C[6])	120.5787	0.745	3	120.5787	0.555	3	120.4909	1.183	8	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]HH)(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<2>,4|H<1>}	C[6](C[6]C[5,6]HH)(C[6]C[5,6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[5,6]C[6])	122.7020	0.000	1	122.7020	0.000	1	120.4909	1.183	8	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[6]ClH)(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|Cl<1>,1|C<3>,1|O<2>,2|C<4>,2|H<1>}	C[6](C[6]C[6]ClH)(C[6]C[5,6]H)(H){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[5,6]C[6])	120.1050	0.201	3	120.1050	0.040	3	120.4909	1.183	8	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6]H)(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<4>,3|C<3>}	C[6](C[6]C[6a]C[6]H)(C[6]C[5,6]H)(H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[5,6]C[6])	119.1740	0.000	1	119.1740	0.000	1	120.4909	1.183	8	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[5,6]C[5,3x6]O[5])(C[6]C[6]O)(H)	C[6](C[6]C[3x6]CO)(C[6]C[5,6]H)(O)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,3x6]O[5])(C[6]C[6]O)(H){1|O<2>,5|C<4>}	C[6](C[6]C[3x6]CO)(C[6]C[5,6]H)(O){1|H<1>,1|O<2>,2|C<4>}	H(C[6]C[5,6]C[6])	121.4360	0.000	1	121.4360	0.000	1	121.4360	0.000	1	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[5a,6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[5a,6]C[5a,6,6]C[5a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]SiH)(C[6]C[5a,6]H)(H)	H(C[6]C[5a,6]C[6])	C[6](C[5a,6]C[5a,6,6]C[5a])(C[6]C[6]H)(H){1|Si<4>,1|C<3>,1|C<4>,1|O<2>,2|H<1>}	C[6](C[6]C[6,6]SiH)(C[6]C[5a,6]H)(H){1|C<4>,3|C<3>}	H(C[6]C[5a,6]C[6])	120.9640	0.000	1	120.9640	0.000	1	119.8342	0.744	5	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[5a,6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[5a,6]N[5,5a,6]C[5a])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]HH)(C[6]C[5a,6]H)(H)	H(C[6]C[5a,6]C[6])	C[6](C[5a,6]N[5,5a,6]C[5a])(C[6]C[6]H)(H){1|B<3>,1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]C[5,6]HH)(C[6]C[5a,6]H)(H){1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[5a,6]C[6])	120.4710	0.000	1	120.4710	0.000	1	119.8342	0.744	5	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[5a,6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[5a,6]N[5a,6]C[5a])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]C[6a]H)(C[6]C[5a,6]H)(H)	H(C[6]C[5a,6]C[6])	C[6](C[5a,6]N[5a,6]C[5a])(C[6]C[6]H)(H){1|C<4>,2|H<1>,3|C<3>}	C[6](C[6]C[5,6]C[6a]H)(C[6]C[5a,6]H)(H){1|N<3>,5|C<3>}	H(C[6]C[5a,6]C[6])	119.0515	0.170	2	119.0515	0.029	2	119.8342	0.744	5	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[5a,6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[5a,6]N[5a,6]C[5a])(C[6]C[6]H)(H)	C[6](C[6]C[5a]C[6]H)(C[6]C[5a,6]H)(H)	H(C[6]C[5a,6]C[6])	C[6](C[5a,6]N[5a,6]C[5a])(C[6]C[6]H)(H){1|C<4>,2|H<1>,3|C<3>}	C[6](C[6]C[5a]C[6]H)(C[6]C[5a,6]H)(H){1|C<4>,1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[5a,6]C[6])	119.6330	0.000	1	119.6330	0.000	1	119.8342	0.744	5	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[3,6,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[3,6,6]O)(H)	C[6](C[3,6,6]C[3,6,6]C[3]C[6])(C[6]C[6,6]H)(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[3,6,6]O)(H){2|H<1>,6|C<4>}	C[6](C[3,6,6]C[3,6,6]C[3]C[6])(C[6]C[6,6]H)(O){4|C<4>,4|H<1>}	H(C[6]C[6,6]C[6])	118.0430	0.000	1	118.0430	0.000	1	118.0430	0.000	1	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[3,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[3,6]H)(H)	C[6](C[3,6]C[3]2O[6])(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[3,6]H)(H){1|O<1>,1|O<2>,4|C<4>}	C[6](C[3,6]C[3]2O[6])(C[6]C[6,6]H)(H){3|C<3>,3|H<1>}	H(C[6]C[6,6]C[6])	119.5440	0.000	1	119.5440	0.000	1	119.5440	0.000	1	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[3,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[3,6]O)(H)	C[6](C[3,6]C[3,6]C[3]H)(C[6]C[6,6]H)(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[3,6]O)(H){1|Cl<1>,1|C<3>,1|H<1>,4|C<4>}	C[6](C[3,6]C[3,6]C[3]H)(C[6]C[6,6]H)(O){1|C<3>,1|C<4>,3|H<1>}	H(C[6]C[6,6]C[6])	118.3970	0.000	1	118.3970	0.000	1	118.1843	0.034	3	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[3,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[3,6]O)(H)	C[6](C[3,6]C[3,6]O[3]H)(C[6]C[6,6]H)(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[3,6]O)(H){1|C<3>,1|O<2>,2|H<1>,3|C<4>}	C[6](C[3,6]C[3,6]O[3]H)(C[6]C[6,6]H)(O){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6,6]C[6])	118.0780	0.000	2	118.0780	0.000	2	118.1843	0.034	3	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[3x6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6,6]C[6,6]2)(C[6]C[3x6]O)(H)	C[6](C[3x6]C[3x6]C[4x6]C)(C[6]C[6,6]H)(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2)(C[6]C[3x6]O)(H){8|C<4>}	C[6](C[3x6]C[3x6]C[4x6]C)(C[6]C[6,6]H)(O){1|H<1>,1|O<2>,5|C<4>}	H(C[6]C[6,6]C[6])	117.6290	0.000	1	117.6290	0.000	1	117.6290	0.000	1	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[5,6,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6,6]C[6,6]2)(C[6]C[5,6,6]O)(H)	C[6](C[5,6,6]C[5,6,6]C[6,6]O[5])(C[6]C[6,6]H)(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2)(C[6]C[5,6,6]O)(H){1|C<3>,1|O<2>,6|C<4>}	C[6](C[5,6,6]C[5,6,6]C[6,6]O[5])(C[6]C[6,6]H)(O){1|C<3>,1|H<1>,6|C<4>}	H(C[6]C[6,6]C[6])	117.5160	0.000	1	117.3353	0.046	3	117.2640	0.051	4	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[5,6,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6,6]C[6,6]2)(C[6]C[5,6,6]O)(H)	C[6](C[5,6,6]C[5,6,6]C[6,6]O[5])(C[6]C[6,6]H)(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2)(C[6]C[5,6,6]O)(H){1|H<1>,1|O<2>,6|C<4>}	C[6](C[5,6,6]C[5,6,6]C[6,6]O[5])(C[6]C[6,6]H)(O){1|O<2>,7|C<4>}	H(C[6]C[6,6]C[6])	117.2450	0.209	2	117.3353	0.046	3	117.2640	0.051	4	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[5,6,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6,6]C[6,6]2)(C[6]C[5,6,6]O)(H)	C[6](C[5,6,6]C[5,6]C[6,6]O[5])(C[6]C[6,6]H)(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2)(C[6]C[5,6,6]O)(H){1|H<1>,1|O<2>,6|C<4>}	C[6](C[5,6,6]C[5,6]C[6,6]O[5])(C[6]C[6,6]H)(O){1|C<3>,7|C<4>}	H(C[6]C[6,6]C[6])	117.0500	0.000	1	117.0500	0.000	1	117.2640	0.051	4	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]N[6])(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,6a]N[5,5a]C[6])(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]N[6])(C[6]C[5,6]H)(H){1|N<3>,1|O<2>,3|C<3>}	C[6](C[5,6]C[5,6a]N[5,5a]C[6])(C[6]C[6,6]H)(H){1|H<1>,1|N<2>,5|C<3>}	H(C[6]C[6,6]C[6])	118.8500	0.000	1	118.8565	0.000	2	120.0238	0.850	6	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]N[6])(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,6a]N[5,5a]C[6])(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]N[6])(C[6]C[5,6]H)(H){1|N<3>,1|S<2>,3|C<3>}	C[6](C[5,6]C[5,6a]N[5,5a]C[6])(C[6]C[6,6]H)(H){1|H<1>,1|N<2>,5|C<3>}	H(C[6]C[6,6]C[6])	118.8630	0.000	1	118.8565	0.000	2	120.0238	0.850	6	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]N[6])(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5]N[5]O[6])(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]N[6])(C[6]C[5,6]H)(H){1|N<3>,1|O<2>,2|C<3>,2|C<4>}	C[6](C[5,6]C[5]N[5]O[6])(C[6]C[6,6]H)(H){1|N<3>,3|C<3>,3|C<4>}	H(C[6]C[6,6]C[6])	120.6075	0.231	4	120.6075	0.053	4	120.0238	0.850	6	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6,6]C[3,6,6]C[6,6])(C[6]C[5,6]O)(H)	C[6](C[5,6]C[5,6]C[5]C)(C[6]C[6,6]H)(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[3,6,6]C[6,6])(C[6]C[5,6]O)(H){1|C<3>,1|O<2>,6|C<4>}	C[6](C[5,6]C[5,6]C[5]C)(C[6]C[6,6]H)(O){1|C<3>,5|C<4>}	H(C[6]C[6,6]C[6])	117.3700	0.000	1	117.3700	0.000	1	119.1947	0.743	14	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6,6]C[5,6,6]C[6,6])(C[6]C[5,6]O)(H)	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6,6]H)(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6,6]C[6,6])(C[6]C[5,6]O)(H){1|H<1>,2|C<3>,5|C<4>}	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6,6]H)(O){1|C<3>,2|H<1>,3|C<4>}	H(C[6]C[6,6]C[6])	118.9370	0.000	1	119.0888	0.023	6	119.1947	0.743	14	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6,6]C[5,6,6]C[6,6])(C[6]C[5,6]O)(H)	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6,6]H)(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6,6]C[6,6])(C[6]C[5,6]O)(H){1|H<1>,3|C<3>,4|C<4>}	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6,6]H)(O){1|C<3>,2|H<1>,3|C<4>}	H(C[6]C[6,6]C[6])	119.1205	0.230	2	119.0888	0.023	6	119.1947	0.743	14	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6,6]C[5,6,6]C[6,6])(C[6]C[5,6]O)(H)	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6,6]H)(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6,6]C[6,6])(C[6]C[5,6]O)(H){1|H<1>,7|C<4>}	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6,6]H)(O){3|H<1>,4|C<4>}	H(C[6]C[6,6]C[6])	119.1183	0.132	3	119.0888	0.023	6	119.1947	0.743	14	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6,6]C[5,6,6]C[6,6])(C[6]C[5,6]O)(H)	C[6](C[5,6]O[5,6]C[5]H)(C[6]C[6,6]H)(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6,6]C[6,6])(C[6]C[5,6]O)(H){1|H<1>,3|O<2>,4|C<4>}	C[6](C[5,6]O[5,6]C[5]H)(C[6]C[6,6]H)(O){1|O<2>,4|C<4>}	H(C[6]C[6,6]C[6])	120.1510	0.000	1	120.3127	0.025	3	119.1947	0.743	14	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6,6]C[5,6,6]C[6,6])(C[6]C[5,6]O)(H)	C[6](C[5,6]O[5,6]C[5]H)(C[6]C[6,6]H)(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6,6]C[6,6])(C[6]C[5,6]O)(H){2|H<1>,2|O<2>,4|C<4>}	C[6](C[5,6]O[5,6]C[5]H)(C[6]C[6,6]H)(O){1|O<2>,4|C<4>}	H(C[6]C[6,6]C[6])	120.3935	0.108	2	120.3127	0.025	3	119.1947	0.743	14	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6,6]C[5,6,6]C[6])(C[6]C[5,6]O)(H)	C[6](C[5,6]O[5,6]C[5]H)(C[6]C[6,6]H)(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6,6]C[6])(C[6]C[5,6]O)(H){1|C<3>,1|O<2>,2|H<1>,4|C<4>}	C[6](C[5,6]O[5,6]C[5]H)(C[6]C[6,6]H)(O){2|H<1>,3|C<4>}	H(C[6]C[6,6]C[6])	120.1050	0.000	1	120.1050	0.000	1	119.1947	0.743	14	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6,6]C[6,6]2)(C[6]C[5,6]O)(H)	C[6](C[5,6]C[5,5]C[5,6]C)(C[6]C[6,6]H)(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2)(C[6]C[5,6]O)(H){1|H<1>,7|C<4>}	C[6](C[5,6]C[5,5]C[5,6]C)(C[6]C[6,6]H)(O){2|H<1>,5|C<4>}	H(C[6]C[6,6]C[6])	118.0550	0.000	1	118.0550	0.000	1	119.1947	0.743	14	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[5,6]O)(H)	C[6](C[5,6]C[5,6]O[5]C)(C[6]C[6,6]H)(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[5,6]O)(H){1|C<4>,1|H<1>,1|O<2>,3|C<3>}	C[6](C[5,6]C[5,6]O[5]C)(C[6]C[6,6]H)(O){4|C<3>}	H(C[6]C[6,6]C[6])	118.8625	0.005	2	118.8625	0.000	2	119.1947	0.743	14	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[3x6]C[6])(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6]O[6]O)(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[3x6]C[6])(C[6]C[6,6]H)(H){1|C<3>,1|H<1>,1|N<3>,2|C<4>,2|O<2>}	C[6](C[6,6]C[6,6]O[6]O)(C[6]C[6,6]H)(H){1|C<4>,2|C<3>,2|H<1>}	H(C[6]C[6,6]C[6])	118.8960	0.000	1	118.8960	0.000	1	118.5913	0.557	20	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6,6]H)(H){2|H<1>,5|C<4>}	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6,6]H)(H){2|C<3>,2|H<1>,3|C<4>}	H(C[6]C[6,6]C[6])	118.8130	0.000	1	118.8130	0.000	1	118.5913	0.557	20	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]2)(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6]2H)(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2)(C[6]C[6,6]H)(H){1|H<1>,6|C<4>}	C[6](C[6,6]C[6,6]2H)(C[6]C[6,6]H)(H){1|C<3>,6|C<4>}	H(C[6]C[6,6]C[6])	118.2055	0.070	2	118.2055	0.005	2	118.5913	0.557	20	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]H)(H)	C[6](C[6,6]C[5,6]C[6,6]H)(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]H)(H){1|C<3>,2|H<1>,4|C<4>}	C[6](C[6,6]C[5,6]C[6,6]H)(C[6]C[6,6]H)(H){1|C<3>,1|H<1>,1|O<2>,4|C<4>}	H(C[6]C[6,6]C[6])	118.4090	0.000	1	118.4242	0.047	12	118.5913	0.557	20	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]H)(H)	C[6](C[6,6]C[5,6]C[6,6]H)(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]H)(H){1|C<3>,2|H<1>,4|C<4>}	C[6](C[6,6]C[5,6]C[6,6]H)(C[6]C[6,6]H)(H){1|C<3>,2|H<1>,4|C<4>}	H(C[6]C[6,6]C[6])	118.3004	0.246	5	118.4242	0.047	12	118.5913	0.557	20	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]H)(H)	C[6](C[6,6]C[5,6]C[6,6]H)(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]H)(H){1|C<3>,3|C<4>,3|H<1>}	C[6](C[6,6]C[5,6]C[6,6]H)(C[6]C[6,6]H)(H){1|C<3>,2|H<1>,4|C<4>}	H(C[6]C[6,6]C[6])	118.4762	0.173	4	118.4242	0.047	12	118.5913	0.557	20	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]H)(H)	C[6](C[6,6]C[5,6]C[6,6]H)(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]H)(H){2|C<3>,2|H<1>,3|C<4>}	C[6](C[6,6]C[5,6]C[6,6]H)(C[6]C[6,6]H)(H){1|C<3>,2|H<1>,4|C<4>}	H(C[6]C[6,6]C[6])	118.6740	0.000	1	118.4242	0.047	12	118.5913	0.557	20	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]H)(H)	C[6](C[6,6]C[5,6]C[6,6]H)(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]H)(H){2|C<3>,2|H<1>,3|C<4>}	C[6](C[6,6]C[5,6]C[6,6]H)(C[6]C[6,6]H)(H){1|Cl<1>,1|H<1>,2|C<3>,3|C<4>}	H(C[6]C[6,6]C[6])	118.6010	0.000	1	118.4242	0.047	12	118.5913	0.557	20	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]H)(H){1|H<1>,1|O<1>,2|C<3>,2|C<4>}	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6,6]H)(H){2|C<3>,5|C<4>}	H(C[6]C[6,6]C[6])	121.5310	0.000	1	121.5310	0.000	1	118.5913	0.557	20	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]O[6])(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6]C[6]Cr)(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]O[6])(C[6]C[6,6]H)(H){1|Cr<9>,1|C<3>,3|C<4>}	C[6](C[6,6]C[6,6]C[6]Cr)(C[6]C[6,6]H)(H){1|C<3>,1|H<1>,1|O<2>,2|C<4>}	H(C[6]C[6,6]C[6])	118.3613	0.494	3	118.3613	0.244	3	118.5913	0.557	20	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6,6]C[3x6]C[6])(C[6]C[6,6]O)(H)	C[6](C[6,6]C[6,6]C[6]O)(C[6]C[6,6]H)(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[3x6]C[6])(C[6]C[6,6]O)(H){1|C<3>,1|H<1>,1|O<2>,4|C<4>}	C[6](C[6,6]C[6,6]C[6]O)(C[6]C[6,6]H)(O){1|C<3>,3|C<4>,3|H<1>}	H(C[6]C[6,6]C[6])	119.5575	0.012	2	119.5575	0.000	2	117.9820	0.505	36	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6,6]O)(H)	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6,6]H)(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6,6]O)(H){1|O<2>,2|H<1>,5|C<4>}	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6,6]H)(O){2|H<1>,5|C<4>}	H(C[6]C[6,6]C[6])	118.9975	0.155	2	118.8433	0.083	3	117.9820	0.505	36	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6,6]O)(H)	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6,6]H)(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6,6]O)(H){2|H<1>,6|C<4>}	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6,6]H)(O){1|C<3>,6|C<4>}	H(C[6]C[6,6]C[6])	118.5350	0.000	1	118.8433	0.083	3	117.9820	0.505	36	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6,6]O)(H)	C[6](C[6,6]C[6,6]C[6]O)(C[6]C[6,6]H)(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6,6]O)(H){1|H<1>,2|O<2>,5|C<4>}	C[6](C[6,6]C[6,6]C[6]O)(C[6]C[6,6]H)(O){2|H<1>,5|C<4>}	H(C[6]C[6,6]C[6])	118.8003	0.342	3	118.8003	0.117	3	117.9820	0.505	36	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6,6]O)(H)	C[6](C[6,6]C[6]2O[6])(C[6]C[6,6]H)(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6,6]O)(H){1|H<1>,2|O<2>,5|C<4>}	C[6](C[6,6]C[6]2O[6])(C[6]C[6,6]H)(O){1|O<2>,2|H<1>,5|C<4>}	H(C[6]C[6,6]C[6])	118.3610	0.000	1	118.3610	0.000	1	117.9820	0.505	36	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6,6]C[6,6]2)(C[6]C[6,6]O)(H)	C[6](C[6,6]C[5,6]C[6,6]O)(C[6]C[6,6]H)(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2)(C[6]C[6,6]O)(H){1|H<1>,1|O<2>,6|C<4>}	C[6](C[6,6]C[5,6]C[6,6]O)(C[6]C[6,6]H)(O){1|O<2>,6|C<4>}	H(C[6]C[6,6]C[6])	117.6183	0.264	3	117.6183	0.070	3	117.9820	0.505	36	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6,6]C[6,6]2)(C[6]C[6,6]O)(H)	C[6](C[6,6]C[6,6]2H)(C[6]C[6,6]H)(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2)(C[6]C[6,6]O)(H){1|C<3>,1|H<1>,6|C<4>}	C[6](C[6,6]C[6,6]2H)(C[6]C[6,6]H)(O){1|H<1>,6|C<4>}	H(C[6]C[6,6]C[6])	118.1320	0.000	1	117.5420	0.179	19	117.9820	0.505	36	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6,6]C[6,6]2)(C[6]C[6,6]O)(H)	C[6](C[6,6]C[6,6]2H)(C[6]C[6,6]H)(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2)(C[6]C[6,6]O)(H){2|H<1>,6|C<4>}	C[6](C[6,6]C[6,6]2H)(C[6]C[6,6]H)(O){1|C<3>,6|C<4>}	H(C[6]C[6,6]C[6])	117.1077	0.996	3	117.5420	0.179	19	117.9820	0.505	36	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6,6]C[6,6]2)(C[6]C[6,6]O)(H)	C[6](C[6,6]C[6,6]2H)(C[6]C[6,6]H)(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2)(C[6]C[6,6]O)(H){2|H<1>,6|C<4>}	C[6](C[6,6]C[6,6]2H)(C[6]C[6,6]H)(O){7|C<4>}	H(C[6]C[6,6]C[6])	117.5895	0.145	15	117.5420	0.179	19	117.9820	0.505	36	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]O)(H)	C[6](C[6,6]C[5,6]C[6,6]H)(C[6]C[6,6]H)(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]O)(H){1|C<3>,3|H<1>,4|C<4>}	C[6](C[6,6]C[5,6]C[6,6]H)(C[6]C[6,6]H)(O){1|H<1>,1|O<2>,5|C<4>}	H(C[6]C[6,6]C[6])	118.1470	0.000	1	118.0763	0.063	4	117.9820	0.505	36	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]O)(H)	C[6](C[6,6]C[5,6]C[6,6]H)(C[6]C[6,6]H)(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]O)(H){3|H<1>,5|C<4>}	C[6](C[6,6]C[5,6]C[6,6]H)(C[6]C[6,6]H)(O){2|H<1>,5|C<4>}	H(C[6]C[6,6]C[6])	118.0527	0.302	3	118.0763	0.063	4	117.9820	0.505	36	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]O)(H)	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6,6]H)(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]O)(H){2|C<3>,2|C<4>,2|H<1>}	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6,6]H)(O){2|C<3>,5|C<4>}	H(C[6]C[6,6]C[6])	118.4880	0.000	1	118.4880	0.000	1	117.9820	0.505	36	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[3x6]C[6])(C[6]C[6]H)(H)	C[6](C[6]N[6,6]HH)(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[3x6]C[6])(C[6]C[6]H)(H){1|N<3>,3|C<4>,3|H<1>}	C[6](C[6]N[6,6]HH)(C[6]C[6,6]H)(H){1|C<3>,2|C<4>}	H(C[6]C[6,6]C[6])	119.1120	0.000	1	119.1120	0.000	1	120.4292	5.089	10	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[5,6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]C[6]H)(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6,6]C[6])(C[6]C[6]H)(H){1|Ca<12>,1|C<3>,2|H<1>,3|C<4>}	C[6](C[6]C[5,6]C[6]H)(C[6]C[6,6]H)(H){1|Ca<12>,1|H<1>,2|C<3>,3|C<4>}	H(C[6]C[6,6]C[6])	119.0055	0.219	4	119.0055	0.048	4	120.4292	5.089	10	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[5,6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]HO)(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6,6]C[6])(C[6]C[6]H)(H){1|O<2>,3|C<4>,3|H<1>}	C[6](C[6]C[5,6]HO)(C[6]C[6,6]H)(H){1|C<3>,1|C<4>,2|O<2>}	H(C[6]C[6,6]C[6])	120.8300	0.000	1	120.8300	0.000	1	120.4292	5.089	10	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[5,6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]MoH)(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6,6]C[6])(C[6]C[6]H)(H){1|Mo<10>,1|C<3>,2|C<4>,3|H<1>}	C[6](C[6]C[5,6]MoH)(C[6]C[6,6]H)(H){1|C<3>,2|C<4>}	H(C[6]C[6,6]C[6])	125.8530	0.000	1	125.8530	0.000	1	120.4292	5.089	10	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]2)(C[6]C[6]H)(H)	C[6](C[6]C[6a]2O[6])(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2)(C[6]C[6]H)(H){1|Cr<9>,1|O<2>,2|C<4>,3|C<3>}	C[6](C[6]C[6a]2O[6])(C[6]C[6,6]H)(H){1|C<4>,5|C<3>}	H(C[6]C[6,6]C[6])	121.4800	0.000	1	121.4800	0.000	1	120.4292	5.089	10	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]2)(C[6]C[6]H)(H)	C[6](C[6]C[6a]O[6]C)(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2)(C[6]C[6]H)(H){1|Cr<9>,1|O<2>,2|C<3>,3|C<4>}	C[6](C[6]C[6a]O[6]C)(C[6]C[6,6]H)(H){1|C<4>,3|C<3>}	H(C[6]C[6,6]C[6])	122.0980	0.000	1	122.0980	0.000	1	120.4292	5.089	10	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]NiH)(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|Ni<4>,1|C<3>,1|C<4>,1|N<3>,2|H<1>}	C[6](C[6]C[6]NiH)(C[6]C[6,6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6,6]C[6])	118.8970	0.000	1	118.8970	0.000	1	120.4292	5.089	10	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6,6]C[3x6]C[6])(C[6]C[6]O)(H)	C[6](C[6]C[6,6]HH)(C[6]C[6,6]H)(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[3x6]C[6])(C[6]C[6]O)(H){1|O<2>,3|C<4>,4|H<1>}	C[6](C[6]C[6,6]HH)(C[6]C[6,6]H)(O){1|H<1>,1|N<3>,2|C<4>}	H(C[6]C[6,6]C[6])	118.0950	0.000	1	118.0950	0.000	1	118.2055	1.564	6	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6,6]C[4,6,6]O[6])(C[6]C[6]O)(H)	C[6](C[6]C[4,6]HH)(C[6]C[6,6]H)(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[4,6,6]O[6])(C[6]C[6]O)(H){1|C<3>,2|H<1>,3|C<4>}	C[6](C[6]C[4,6]HH)(C[6]C[6,6]H)(O){1|H<1>,1|O<2>,2|C<4>}	H(C[6]C[6,6]C[6])	115.8690	0.000	1	115.8690	0.000	1	118.2055	1.564	6	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6,6]C[5,5,6,6]C[6])(C[6]C[6]O)(H)	C[6](C[6]C[5,6]CO)(C[6]C[6,6]H)(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,5,6,6]C[6])(C[6]C[6]O)(H){1|O<1>,1|O<2>,2|C<3>,3|C<4>}	C[6](C[6]C[5,6]CO)(C[6]C[6,6]H)(O){1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6,6]C[6])	118.7290	0.068	2	118.7290	0.005	2	118.2055	1.564	6	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6,6]C[5,6,6]C[6])(C[6]C[6]O)(H)	C[6](C[6]C[5,6]CH)(C[6]C[6,6]H)(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6,6]C[6])(C[6]C[6]O)(H){1|O<2>,2|H<1>,5|C<4>}	C[6](C[6]C[5,6]CH)(C[6]C[6,6]H)(O){1|H<1>,1|O<2>,2|C<4>}	H(C[6]C[6,6]C[6])	118.2660	0.000	1	118.2660	0.000	1	118.2055	1.564	6	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6,6]C[5,6,6]C[6])(C[6]C[6]O)(H)	C[6](C[6]C[6]BrH)(C[6]C[6,6]H)(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6,6]C[6])(C[6]C[6]O)(H){1|Br<1>,1|C<3>,1|O<2>,2|C<4>,2|H<1>}	C[6](C[6]C[6]BrH)(C[6]C[6,6]H)(O){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6,6]C[6])	119.5450	0.000	1	119.5450	0.000	1	118.2055	1.564	6	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[3,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[3,6]H)(H)	C[6](C[3,6]C[3,6]C[3]H)(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[3,6]H)(H){1|F<1>,1|H<1>,2|C<3>,2|C<4>}	C[6](C[3,6]C[3,6]C[3]H)(C[6]C[6,6a]H)(H){2|H<1>,3|C<3>}	H(C[6]C[6,6a]C[6])	119.8955	0.247	2	119.6877	0.682	4	119.2092	0.959	6	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[3,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[3,6]H)(H)	C[6](C[3,6]C[3,6]C[3]H)(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[3,6]H)(H){1|H<1>,1|O<2>,2|C<3>,2|C<4>}	C[6](C[3,6]C[3,6]C[3]H)(C[6]C[6,6a]H)(H){2|H<1>,3|C<3>}	H(C[6]C[6,6a]C[6])	118.5280	0.000	1	119.6877	0.682	4	119.2092	0.959	6	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[3,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[3,6]H)(H)	C[6](C[3,6]C[3,6]C[3]H)(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[3,6]H)(H){2|C<3>,2|C<4>,2|H<1>}	C[6](C[3,6]C[3,6]C[3]H)(C[6]C[6,6a]H)(H){1|C<4>,1|H<1>,3|C<3>}	H(C[6]C[6,6a]C[6])	120.4320	0.000	1	119.6877	0.682	4	119.2092	0.959	6	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[3,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]N[6a])(C[6]C[3,6]H)(H)	C[6](C[3,6]C[3,6]C[3]N)(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]N[6a])(C[6]C[3,6]H)(H){1|N<3>,2|C<3>,2|C<4>}	C[6](C[3,6]C[3,6]C[3]N)(C[6]C[6,6a]H)(H){1|N<2>,2|C<3>,2|H<1>}	H(C[6]C[6,6a]C[6])	118.2520	0.016	2	118.2520	0.000	2	119.2092	0.959	6	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[3x6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[3x6]H)(H)	C[6](C[3x6]C[3x6]O[6]2)(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[3x6]H)(H){1|C<4>,1|H<1>,2|C<3>,2|O<2>}	C[6](C[3x6]C[3x6]O[6]2)(C[6]C[6,6a]H)(H){1|C<4>,1|O<2>,4|C<3>}	H(C[6]C[6,6a]C[6])	119.1260	0.000	1	119.1260	0.000	1	119.1260	0.000	1	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[4,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6,6a]C[6a])(C[6]C[4,6]H)(H)	C[6](C[4,6]C[4,6,6]C[4]H)(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6,6a]C[6a])(C[6]C[4,6]H)(H){1|C<4>,2|H<1>,3|C<3>}	C[6](C[4,6]C[4,6,6]C[4]H)(C[6]C[6,6a]H)(H){1|C<4>,4|C<3>}	H(C[6]C[6,6a]C[6])	118.3210	0.000	1	118.4715	0.045	2	118.5064	0.395	5	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[4,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6,6a]C[6a])(C[6]C[4,6]H)(H)	C[6](C[4,6]C[4,6,6]C[4]H)(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6,6a]C[6a])(C[6]C[4,6]H)(H){1|C<4>,2|H<1>,3|C<3>}	C[6](C[4,6]C[4,6,6]C[4]H)(C[6]C[6,6a]H)(H){1|H<1>,4|C<3>}	H(C[6]C[6,6a]C[6])	118.6220	0.000	1	118.4715	0.045	2	118.5064	0.395	5	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[4,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[4,6]H)(H)	C[6](C[4,6]C[4,5,6]C[4]C)(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[4,6]H)(H){1|H<1>,2|C<4>,3|C<3>}	C[6](C[4,6]C[4,5,6]C[4]C)(C[6]C[6,6a]H)(H){1|C<4>,1|O<2>,2|C<3>,2|H<1>}	H(C[6]C[6,6a]C[6])	118.2740	0.000	1	118.2740	0.000	1	118.5064	0.395	5	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[4,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[4,6]H)(H)	C[6](C[4,6]C[4,6]C[4]O)(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[4,6]H)(H){1|H<1>,1|O<2>,2|C<3>,2|C<4>}	C[6](C[4,6]C[4,6]C[4]O)(C[6]C[6,6a]H)(H){1|C<4>,1|H<1>,4|C<3>}	H(C[6]C[6,6a]C[6])	117.8110	0.000	1	117.8110	0.000	1	118.5064	0.395	5	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[4,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[4,6]H)(H)	C[6](C[4,6]C[4,6]Si[4]H)(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[4,6]H)(H){1|Si<4>,1|C<4>,2|C<3>,2|H<1>}	C[6](C[4,6]C[4,6]Si[4]H)(C[6]C[6,6a]H)(H){1|Br<1>,1|Si<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.5040	0.000	1	119.5040	0.000	1	118.5064	0.395	5	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[5,5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,5,6]H)(H)	C[6](C[5,5,6]C[5,5,6]C[5,5]N[5])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,5,6]H)(H){1|H<1>,1|N<3>,2|C<3>,2|C<4>}	C[6](C[5,5,6]C[5,5,6]C[5,5]N[5])(C[6]C[6,6a]H)(H){1|N<3>,3|C<3>,5|C<4>}	H(C[6]C[6,6a]C[6])	118.0370	0.000	1	118.0370	0.000	1	118.0370	0.000	1	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[5,6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a,6a]C[6a])(C[6]C[5,6,6]H)(H)	C[6](C[5,6,6]C[6,6,6a]C[5,6a]C[5,6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a,6a]C[6a])(C[6]C[5,6,6]H)(H){1|C<4>,1|H<1>,4|C<3>}	C[6](C[5,6,6]C[6,6,6a]C[5,6a]C[5,6])(C[6]C[6,6a]H)(H){1|C<4>,2|H<1>,5|C<3>}	H(C[6]C[6,6a]C[6])	118.1500	0.000	1	118.1500	0.000	1	118.1500	0.000	1	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[5,6,6a]C[6a])(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,5,6]C[5]C)(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[5,6,6a]C[6a])(C[6]C[5,6]H)(H){1|H<1>,2|C<3>,3|C<4>}	C[6](C[5,6]C[5,5,6]C[5]C)(C[6]C[6,6a]H)(H){3|C<3>,4|C<4>}	H(C[6]C[6,6a]C[6])	119.6285	0.016	2	119.6285	0.000	2	119.5819	1.429	75	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,6a]2O[6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[5,6]H)(H){1|O<2>,5|C<3>}	C[6](C[5,6]C[5,6a]2O[6])(C[6]C[6,6a]H)(H){6|C<3>}	H(C[6]C[6,6a]C[6])	121.5650	0.000	1	121.5650	0.000	1	119.5819	1.429	75	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6,6a]C[6a])(C[6]C[5,6]H)(H)	C[6](C[5,6]N[5,6,6]C[5,5]H)(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6,6a]C[6a])(C[6]C[5,6]H)(H){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	C[6](C[5,6]N[5,6,6]C[5,5]H)(C[6]C[6,6a]H)(H){1|H<1>,2|C<4>,3|C<3>}	H(C[6]C[6,6a]C[6])	119.2550	0.000	1	119.2550	0.000	1	119.5819	1.429	75	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]2)(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5]N[5]O[6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]2)(C[6]C[5,6]H)(H){1|C<4>,1|N<3>,1|O<2>,3|C<3>}	C[6](C[5,6]C[5]N[5]O[6])(C[6]C[6,6a]H)(H){3|C<4>,4|C<3>}	H(C[6]C[6,6a]C[6])	119.8350	0.000	1	119.8350	0.000	1	119.5819	1.429	75	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,5,6]C[5,6]H)(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H){2|C<3>,2|C<4>,2|H<1>}	C[6](C[5,6]C[5,5,6]C[5,6]H)(C[6]C[6,6a]H)(H){1|O<2>,2|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6,6a]C[6])	118.4800	0.000	1	118.4800	0.000	1	119.5819	1.429	75	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,5]N[5,6]H)(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	C[6](C[5,6]C[5,5]N[5,6]H)(C[6]C[6,6a]H)(H){1|C<4>,1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6,6a]C[6])	119.4020	0.000	1	118.9477	0.096	4	119.5819	1.429	75	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,5]N[5,6]H)(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	C[6](C[5,6]C[5,5]N[5,6]H)(C[6]C[6,6a]H)(H){2|C<4>,4|C<3>}	H(C[6]C[6,6a]C[6])	118.7963	0.084	3	118.9477	0.096	4	119.5819	1.429	75	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,6]C[5]Co)(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H){1|Co<10>,1|H<1>,2|C<3>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Co)(C[6]C[6,6a]H)(H){1|H<1>,2|C<3>,2|C<4>}	H(C[6]C[6,6a]C[6])	119.1270	0.387	2	119.1270	0.150	2	119.5819	1.429	75	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,6]C[5]Fe)(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H){1|Fe<10>,1|H<1>,2|C<3>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Fe)(C[6]C[6,6a]H)(H){1|H<1>,2|C<3>,2|C<4>}	H(C[6]C[6,6a]C[6])	118.7930	0.338	4	118.7930	0.114	4	119.5819	1.429	75	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H){1|C<2>,1|H<1>,2|C<3>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6,6a]H)(H){1|C<4>,1|O<2>,2|H<1>,3|C<3>}	H(C[6]C[6,6a]C[6])	119.2985	0.080	2	119.2522	3.311	6	119.5819	1.429	75	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H){1|H<1>,2|C<4>,3|C<3>}	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6,6a]H)(H){1|H<1>,1|O<2>,4|C<3>}	H(C[6]C[6,6a]C[6])	118.8070	0.000	1	119.2522	3.311	6	119.5819	1.429	75	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H){2|C<3>,2|C<4>,2|H<1>}	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6,6a]H)(H){1|C<4>,1|H<1>,1|O<2>,4|C<3>}	H(C[6]C[6,6a]C[6])	122.4550	0.000	1	119.2522	3.311	6	119.5819	1.429	75	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H){2|C<3>,2|C<4>,2|H<1>}	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6,6a]H)(H){1|N<3>,3|C<3>,3|H<1>}	H(C[6]C[6,6a]C[6])	116.8200	0.000	1	119.2522	3.311	6	119.5819	1.429	75	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H){2|C<3>,2|C<4>,2|H<1>}	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6,6a]H)(H){2|Cl<1>,1|N<3>,1|S<2>,3|C<3>}	H(C[6]C[6,6a]C[6])	118.8340	0.000	1	119.2522	3.311	6	119.5819	1.429	75	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H){1|Zr<13>,1|H<1>,2|C<3>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6,6a]H)(H){1|Si<5>,2|C<3>,2|C<4>}	H(C[6]C[6,6a]C[6])	118.0700	0.000	1	118.4390	0.119	3	119.5819	1.429	75	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H){1|Zr<15>,1|H<1>,2|C<3>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6,6a]H)(H){1|Si<5>,2|C<3>,2|C<4>}	H(C[6]C[6,6a]C[6])	118.6235	0.185	2	118.4390	0.119	3	119.5819	1.429	75	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,6]N[5]H)(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	C[6](C[5,6]C[5,6]N[5]H)(C[6]C[6,6a]H)(H){1|O<2>,2|H<1>,3|C<3>}	H(C[6]C[6,6a]C[6])	118.6525	0.035	2	118.6525	0.001	2	119.5819	1.429	75	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,6a]2O[6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H){1|H<1>,1|O<2>,4|C<3>}	C[6](C[5,6]C[5,6a]2O[6])(C[6]C[6,6a]H)(H){6|C<3>}	H(C[6]C[6,6a]C[6])	120.8850	0.000	1	120.8850	0.000	1	119.5819	1.429	75	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,6a]C[5,6]C)(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H){1|H<1>,2|C<4>,3|C<3>}	C[6](C[5,6]C[5,6a]C[5,6]C)(C[6]C[6,6a]H)(H){1|C<4>,1|N<3>,4|C<3>}	H(C[6]C[6,6a]C[6])	119.2360	0.000	1	119.2360	0.000	1	119.5819	1.429	75	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,6a]C[5,6]C[6a])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H){1|H<1>,5|C<3>}	C[6](C[5,6]C[5,6a]C[5,6]C[6a])(C[6]C[6,6a]H)(H){1|N<2>,6|C<3>}	H(C[6]C[6,6a]C[6])	118.6790	0.000	1	118.6790	0.000	1	119.5819	1.429	75	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,6a]C[5,6]H)(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H){1|C<4>,2|H<1>,3|C<3>}	C[6](C[5,6]C[5,6a]C[5,6]H)(C[6]C[6,6a]H)(H){1|H<1>,1|N<3>,4|C<3>}	H(C[6]C[6,6a]C[6])	118.8320	0.000	1	118.8810	0.005	2	119.5819	1.429	75	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,6a]C[5,6]H)(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H){1|C<4>,2|H<1>,3|C<3>}	C[6](C[5,6]C[5,6a]C[5,6]H)(C[6]C[6,6a]H)(H){1|H<1>,1|O<2>,4|C<3>}	H(C[6]C[6,6a]C[6])	118.9300	0.000	1	118.8810	0.005	2	119.5819	1.429	75	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,6a]N[5,6]H)(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H){1|N<3>,2|H<1>,3|C<3>}	C[6](C[5,6]C[5,6a]N[5,6]H)(C[6]C[6,6a]H)(H){1|N<3>,4|C<3>}	H(C[6]C[6,6a]C[6])	119.1900	0.000	1	119.1900	0.000	1	119.5819	1.429	75	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,6a]O[5]O[6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H){1|H<1>,2|O<2>,3|C<3>}	C[6](C[5,6]C[5,6a]O[5]O[6])(C[6]C[6,6a]H)(H){1|C<4>,4|C<3>}	H(C[6]C[6,6a]C[6])	119.7040	0.142	3	119.7040	0.020	3	119.5819	1.429	75	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5]2C[6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H){1|C<4>,1|H<1>,4|C<3>}	C[6](C[5,6]C[5]2C[6])(C[6]C[6,6a]H)(H){1|H<1>,1|O<1>,6|C<3>}	H(C[6]C[6,6a]C[6])	118.9070	0.204	2	118.9070	0.041	2	119.5819	1.429	75	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5]N[5]O[6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H){1|C<4>,1|H<1>,1|N<3>,1|O<2>,2|C<3>}	C[6](C[5,6]C[5]N[5]O[6])(C[6]C[6,6a]H)(H){2|C<3>,5|C<4>}	H(C[6]C[6,6a]C[6])	119.1535	1.006	2	120.0465	1.957	31	119.5819	1.429	75	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5]N[5]O[6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H){1|C<4>,1|H<1>,1|N<3>,1|O<2>,2|C<3>}	C[6](C[5,6]C[5]N[5]O[6])(C[6]C[6,6a]H)(H){2|C<4>,5|C<3>}	H(C[6]C[6,6a]C[6])	121.7525	0.767	2	120.0465	1.957	31	119.5819	1.429	75	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5]N[5]O[6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H){1|C<4>,1|H<1>,1|N<3>,1|O<2>,2|C<3>}	C[6](C[5,6]C[5]N[5]O[6])(C[6]C[6,6a]H)(H){3|C<4>,4|C<3>}	H(C[6]C[6,6a]C[6])	119.9863	1.381	27	120.0465	1.957	31	119.5819	1.429	75	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H)	C[6](C[5,6]N[5,6]C[5]H)(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	C[6](C[5,6]N[5,6]C[5]H)(C[6]C[6,6a]H)(H){1|C<4>,1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6,6a]C[6])	119.3190	0.151	3	119.6227	0.384	4	119.5819	1.429	75	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H)	C[6](C[5,6]N[5,6]C[5]H)(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	C[6](C[5,6]N[5,6]C[5]H)(C[6]C[6,6a]H)(H){2|C<4>,4|C<3>}	H(C[6]C[6,6a]C[6])	120.5340	0.000	1	119.6227	0.384	4	119.5819	1.429	75	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5]N[5]O[6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[5,6]H)(H){1|C<4>,1|N<3>,1|O<2>,3|C<3>}	C[6](C[5,6]C[5]N[5]O[6])(C[6]C[6,6a]H)(H){3|C<4>,4|C<3>}	H(C[6]C[6,6a]C[6])	120.1450	0.011	2	120.1450	0.000	2	119.5819	1.429	75	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:I-1:	C[6]-3:	C[6](C[6,6a]C[5a,6,6a]C[6a])(C[6]C[5,6]I)(H)	C[6](C[5,6]C[5,6a]2C[5a,6])(C[6]C[6,6a]H)(I)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[5a,6,6a]C[6a])(C[6]C[5,6]I)(H){1|O<2>,5|C<3>}	C[6](C[5,6]C[5,6a]2C[5a,6])(C[6]C[6,6a]H)(I){7|C<3>}	H(C[6]C[6,6a]C[6])	119.3140	0.000	1	119.3140	0.000	1	119.3140	0.000	1	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:Br-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]Br)(H)	C[6](C[6,6]N[6,6]O[6]H)(C[6]C[6,6a]H)(Br)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]Br)(H){1|N<3>,1|O<2>,2|C<3>,2|H<1>}	C[6](C[6,6]N[6,6]O[6]H)(C[6]C[6,6a]H)(Br){1|C<4>,3|C<3>}	H(C[6]C[6,6a]C[6])	119.7170	0.000	1	119.7170	0.000	1	119.7170	0.000	1	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[5,6,6a]C[6a])(C[6]C[6,6]H)(H)	C[6](C[6,6]C[5,6,6]C[6]Ru)(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[5,6,6a]C[6a])(C[6]C[6,6]H)(H){1|Ru<12>,1|H<1>,2|C<3>,2|C<4>}	C[6](C[6,6]C[5,6,6]C[6]Ru)(C[6]C[6,6a]H)(H){1|H<1>,2|C<3>,2|C<4>}	H(C[6]C[6,6a]C[6])	117.9615	0.300	4	117.9615	0.090	4	119.1124	0.593	40	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6,6a]C[6a])(C[6]C[6,6]H)(H)	C[6](C[6,6]C[3x6]C[6]Ru)(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6,6a]C[6a])(C[6]C[6,6]H)(H){1|Ru<11>,1|H<1>,2|C<3>,2|C<4>}	C[6](C[6,6]C[3x6]C[6]Ru)(C[6]C[6,6a]H)(H){1|H<1>,2|C<3>,2|C<4>}	H(C[6]C[6,6a]C[6])	119.0240	0.223	2	119.0240	0.050	2	119.1124	0.593	40	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a,6a]C[6a])(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6,6a]C[6,6]C)(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a,6a]C[6a])(C[6]C[6,6]H)(H){1|H<1>,2|C<4>,3|C<3>}	C[6](C[6,6]C[6,6,6a]C[6,6]C)(C[6]C[6,6a]H)(H){1|C<4>,5|C<3>}	H(C[6]C[6,6a]C[6])	118.8530	0.284	2	118.8530	0.081	2	119.1124	0.593	40	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H)	C[6](C[6,6]C[5,6,6]C[6,6a]H)(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H){1|C<4>,2|H<1>,3|C<3>}	C[6](C[6,6]C[5,6,6]C[6,6a]H)(C[6]C[6,6a]H)(H){1|N<3>,5|C<3>}	H(C[6]C[6,6a]C[6])	118.7940	0.227	3	118.7940	0.052	3	119.1124	0.593	40	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H)	C[6](C[6,6]C[5,6]C[6,6]H)(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H){2|C<3>,2|C<4>,2|H<1>}	C[6](C[6,6]C[5,6]C[6,6]H)(C[6]C[6,6a]H)(H){1|H<1>,1|O<2>,2|C<3>,3|C<4>}	H(C[6]C[6,6a]C[6])	119.1500	0.000	1	119.1500	0.000	1	119.1124	0.593	40	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6]C[6]Cr)(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H){1|Cr<9>,1|H<1>,2|C<3>,2|C<4>}	C[6](C[6,6]C[6,6]C[6]Cr)(C[6]C[6,6a]H)(H){1|O<2>,2|C<3>,2|C<4>}	H(C[6]C[6,6a]C[6])	119.1240	0.046	3	119.1278	0.047	6	119.1124	0.593	40	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6]C[6]Cr)(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H){1|Cr<9>,1|O<2>,2|C<3>,2|C<4>}	C[6](C[6,6]C[6,6]C[6]Cr)(C[6]C[6,6a]H)(H){1|H<1>,2|C<3>,2|C<4>}	H(C[6]C[6,6a]C[6])	119.1317	0.340	3	119.1278	0.047	6	119.1124	0.593	40	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H){2|C<3>,2|C<4>,2|H<1>}	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6,6a]H)(H){2|C<3>,2|H<1>,3|C<4>}	H(C[6]C[6,6a]C[6])	119.1940	0.000	1	119.6460	0.409	2	119.1124	0.593	40	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H){2|C<3>,2|C<4>,2|H<1>}	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6,6a]H)(H){2|C<3>,5|C<4>}	H(C[6]C[6,6a]C[6])	120.0980	0.000	1	119.6460	0.409	2	119.1124	0.593	40	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6]C[6]Rh)(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H){1|Rh<10>,1|H<1>,2|C<3>,2|C<4>}	C[6](C[6,6]C[6,6]C[6]Rh)(C[6]C[6,6a]H)(H){1|H<1>,2|C<3>,2|C<4>}	H(C[6]C[6,6a]C[6])	119.2550	0.000	1	119.2550	0.000	1	119.1124	0.593	40	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6]C[6]Ru)(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H){1|Ru<10>,1|H<1>,2|C<3>,2|C<4>}	C[6](C[6,6]C[6,6]C[6]Ru)(C[6]C[6,6a]H)(H){1|H<1>,2|C<3>,2|C<4>}	H(C[6]C[6,6a]C[6])	116.6760	0.000	1	116.6760	0.000	1	119.1124	0.593	40	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6]C[6a]C[6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H){1|C<4>,1|H<1>,4|C<3>}	C[6](C[6,6]C[6,6]C[6a]C[6])(C[6]C[6,6a]H)(H){1|H<1>,1|O<2>,6|C<3>}	H(C[6]C[6,6a]C[6])	119.4685	0.206	2	119.4685	0.042	2	119.1124	0.593	40	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6a]2O[6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H){1|H<1>,1|O<2>,4|C<3>}	C[6](C[6,6]C[6,6a]2O[6])(C[6]C[6,6a]H)(H){6|C<3>}	H(C[6]C[6,6a]C[6])	119.5740	0.000	1	119.5740	0.000	1	119.1124	0.593	40	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6a]C[6,6]H)(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H){1|C<4>,2|H<1>,3|C<3>}	C[6](C[6,6]C[6,6a]C[6,6]H)(C[6]C[6,6a]H)(H){1|H<1>,1|N<3>,4|C<3>}	H(C[6]C[6,6a]C[6])	119.5370	0.000	1	119.5370	0.000	1	119.1124	0.593	40	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6]2O[6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H){1|H<1>,1|O<2>,2|C<3>,2|C<4>}	C[6](C[6,6]C[6]2O[6])(C[6]C[6,6a]H)(H){1|C<4>,3|C<3>,4|H<1>}	H(C[6]C[6,6a]C[6])	119.9250	0.000	1	119.9250	0.000	1	119.1124	0.593	40	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6]N[6]2)(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H){1|H<1>,2|N<3>,3|C<3>}	C[6](C[6,6]C[6]N[6]2)(C[6]C[6,6a]H)(H){1|N<2>,2|H<1>,4|C<3>}	H(C[6]C[6,6a]C[6])	118.5000	0.000	1	118.5415	0.003	2	119.1124	0.593	40	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6]N[6]2)(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H){1|H<1>,2|N<3>,3|C<3>}	C[6](C[6,6]C[6]N[6]2)(C[6]C[6,6a]H)(H){1|O<1>,2|H<1>,4|C<3>}	H(C[6]C[6,6a]C[6])	118.5830	0.000	1	118.5415	0.003	2	119.1124	0.593	40	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6]O[6]2)(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H){1|C<4>,1|H<1>,2|C<3>,2|O<2>}	C[6](C[6,6]C[6]O[6]2)(C[6]C[6,6a]H)(H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6,6a]C[6])	119.6500	0.000	1	120.5540	1.634	2	119.1124	0.593	40	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6]O[6]2)(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H){1|C<4>,1|H<1>,2|C<3>,2|O<2>}	C[6](C[6,6]C[6]O[6]2)(C[6]C[6,6a]H)(H){1|H<1>,2|C<4>,3|C<3>}	H(C[6]C[6,6a]C[6])	121.4580	0.000	1	120.5540	1.634	2	119.1124	0.593	40	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H)	C[6](C[6,6]N[6,6]C[6]H)(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H){1|N<3>,2|H<1>,3|C<3>}	C[6](C[6,6]N[6,6]C[6]H)(C[6]C[6,6a]H)(H){1|N<3>,4|C<3>}	H(C[6]C[6,6a]C[6])	119.3520	0.118	3	119.3520	0.014	3	119.1124	0.593	40	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H)	C[6](C[6,6]N[6,6]O[6]H)(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H){1|N<3>,1|O<2>,2|C<3>,2|H<1>}	C[6](C[6,6]N[6,6]O[6]H)(C[6]C[6,6a]H)(H){1|C<4>,3|C<3>}	H(C[6]C[6,6a]C[6])	119.2443	0.250	3	119.2443	0.063	3	119.1124	0.593	40	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]N[6a])(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]N[6a])(C[6]C[6,6]H)(H){1|C<4>,1|H<1>,3|C<3>}	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6,6a]H)(H){1|B<3>,1|H<1>,1|N<2>,3|C<3>}	H(C[6]C[6,6a]C[6])	119.6560	0.000	1	119.6560	0.000	1	119.1124	0.593	40	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6a]2O[6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6,6]H)(H){1|O<2>,5|C<3>}	C[6](C[6,6]C[6,6a]2O[6])(C[6]C[6,6a]H)(H){6|C<3>}	H(C[6]C[6,6a]C[6])	119.8820	0.167	2	119.8820	0.028	2	119.1124	0.593	40	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:Br-1:	C[6]-3:	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]Br)(H)	C[6](C[6]C[6a]2O[6])(C[6]C[6,6a]H)(Br)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]Br)(H){1|O<2>,5|C<3>}	C[6](C[6]C[6a]2O[6])(C[6]C[6,6a]H)(Br){6|C<3>}	H(C[6]C[6,6a]C[6])	120.4970	0.447	2	120.4970	0.200	2	120.4970	0.200	2	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[5,6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]MoH)(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[5,6,6a]C[6a])(C[6]C[6]H)(H){1|Mo<10>,1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]C[5,6]MoH)(C[6]C[6,6a]H)(H){1|C<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	124.2210	0.000	1	124.2210	0.000	1	119.4598	2.630	50	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[5,6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]CH)(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[5,6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]N[5,6]CH)(C[6]C[6,6a]H)(H){1|Si<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.4300	0.000	1	119.4300	0.000	1	119.4598	2.630	50	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[5a,6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]N[5a,6]HO)(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[5a,6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,1|O<2>,2|C<3>,2|H<1>}	C[6](C[6]N[5a,6]HO)(C[6]C[6,6a]H)(H){3|C<3>}	H(C[6]C[6,6a]C[6])	119.6960	0.000	1	119.6960	0.000	1	119.4598	2.630	50	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H)	C[6](C[6]C[6a]2N[6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H){1|N<2>,1|N<3>,4|C<3>}	C[6](C[6]C[6a]2N[6])(C[6]C[6,6a]H)(H){1|O<1>,6|C<3>}	H(C[6]C[6,6a]C[6])	119.4610	0.000	1	119.4610	0.000	1	119.4598	2.630	50	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H)	C[6](C[6]C[6a]2O[6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H){1|O<2>,5|C<3>}	C[6](C[6]C[6a]2O[6])(C[6]C[6,6a]H)(H){6|C<3>}	H(C[6]C[6,6a]C[6])	119.9510	0.000	1	119.9510	0.000	1	119.4598	2.630	50	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]N[6,6]CH)(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]N[6,6]CH)(C[6]C[6,6a]H)(H){1|C<4>,2|C<3>}	H(C[6]C[6,6a]C[6])	119.5730	0.000	1	119.5730	0.000	1	119.4598	2.630	50	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[5a]C[6]H)(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,2|H<1>,3|C<3>}	C[6](C[6]C[5a]C[6]H)(C[6]C[6,6a]H)(H){1|H<1>,1|O<2>,4|C<3>}	H(C[6]C[6,6a]C[6])	119.2210	0.000	1	119.2210	0.000	1	119.4598	2.630	50	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6]H)(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6]N[6]H)(C[6]C[6,6a]H)(H){1|H<1>,1|O<2>,2|C<3>,2|C<4>}	H(C[6]C[6,6a]C[6])	118.9880	0.000	1	119.1895	0.081	2	119.4598	2.630	50	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6]H)(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6]N[6]H)(C[6]C[6,6a]H)(H){1|O<2>,2|C<3>,3|C<4>}	H(C[6]C[6,6a]C[6])	119.3910	0.000	1	119.1895	0.081	2	119.4598	2.630	50	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6a]2O[6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|O<2>,4|C<3>}	C[6](C[6]C[6a]2O[6])(C[6]C[6,6a]H)(H){6|C<3>}	H(C[6]C[6,6a]C[6])	119.8235	0.043	2	120.2030	0.573	12	119.4598	2.630	50	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6a]2O[6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|O<2>,4|C<3>}	C[6](C[6]C[6a]2O[6])(C[6]C[6,6a]H)(H){6|C<3>}	H(C[6]C[6,6a]C[6])	120.3825	0.888	8	120.2030	0.573	12	119.4598	2.630	50	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6a]2O[6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|O<2>,5|C<3>}	C[6](C[6]C[6a]2O[6])(C[6]C[6,6a]H)(H){6|C<3>}	H(C[6]C[6,6a]C[6])	119.8645	0.091	2	120.2030	0.573	12	119.4598	2.630	50	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6]H)(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,2|H<1>,3|C<3>}	C[6](C[6]C[6a]C[6]H)(C[6]C[6,6a]H)(H){1|C<4>,1|H<1>,4|C<3>}	H(C[6]C[6,6a]C[6])	120.6755	5.324	2	119.5580	5.317	7	119.4598	2.630	50	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6]H)(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,2|H<1>,3|C<3>}	C[6](C[6]C[6a]C[6]H)(C[6]C[6,6a]H)(H){1|H<1>,1|N<3>,4|C<3>}	H(C[6]C[6,6a]C[6])	118.9980	0.102	2	119.5580	5.317	7	119.4598	2.630	50	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6]H)(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,2|H<1>,3|C<3>}	C[6](C[6]C[6a]C[6]H)(C[6]C[6,6a]H)(H){1|H<1>,1|O<2>,4|C<3>}	H(C[6]C[6,6a]C[6])	119.2195	0.018	2	119.5580	5.317	7	119.4598	2.630	50	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6]H)(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,2|H<1>,3|C<3>}	C[6](C[6]C[6a]C[6]H)(C[6]C[6,6a]H)(H){6|C<3>}	H(C[6]C[6,6a]C[6])	119.1200	0.000	1	119.5580	5.317	7	119.4598	2.630	50	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6a]N[6]H)(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|H<1>,3|C<3>}	C[6](C[6]C[6a]N[6]H)(C[6]C[6,6a]H)(H){1|S<4>,4|C<3>}	H(C[6]C[6,6a]C[6])	119.6840	0.000	1	119.7620	0.012	2	119.4598	2.630	50	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6a]N[6]H)(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|H<1>,3|C<3>}	C[6](C[6]C[6a]N[6]H)(C[6]C[6,6a]H)(H){5|C<3>}	H(C[6]C[6,6a]C[6])	119.8400	0.000	1	119.7620	0.012	2	119.4598	2.630	50	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6a]O[6]O)(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,2|O<2>,3|C<3>}	C[6](C[6]C[6a]O[6]O)(C[6]C[6,6a]H)(H){4|C<3>}	H(C[6]C[6,6a]C[6])	119.6333	0.099	3	119.6333	0.010	3	119.4598	2.630	50	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6a]S[6]H)(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<2>,1|S<2>,2|C<3>,2|H<1>}	C[6](C[6]C[6a]S[6]H)(C[6]C[6,6a]H)(H){4|C<3>}	H(C[6]C[6,6a]C[6])	115.8800	0.000	1	116.9972	0.539	5	119.4598	2.630	50	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[6a]S[6]H)(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|S<2>,2|H<1>,3|C<3>}	C[6](C[6]C[6a]S[6]H)(C[6]C[6,6a]H)(H){4|C<3>}	H(C[6]C[6,6a]C[6])	117.2765	0.446	4	116.9972	0.539	5	119.4598	2.630	50	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	C[6](C[6]N[5a]C[6]H)(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]N[5a]C[6]H)(C[6]C[6,6a]H)(H){1|H<1>,1|O<2>,4|C<3>}	H(C[6]C[6,6a]C[6])	119.3210	0.000	1	119.3210	0.000	1	119.4598	2.630	50	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H)	C[6](C[6]C[5a]C[6a]O[6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H){1|O<2>,5|C<3>}	C[6](C[6]C[5a]C[6a]O[6])(C[6]C[6,6a]H)(H){1|S<2>,5|C<3>}	H(C[6]C[6,6a]C[6])	120.0645	0.179	2	120.0645	0.032	2	119.4598	2.630	50	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H)	C[6](C[6]C[6a]2N[6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H){1|N<3>,5|C<3>}	C[6](C[6]C[6a]2N[6])(C[6]C[6,6a]H)(H){1|O<1>,6|C<3>}	H(C[6]C[6,6a]C[6])	118.9840	0.000	1	118.9840	0.000	1	119.4598	2.630	50	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H)	C[6](C[6]C[6a]2O[6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H){1|O<2>,5|C<3>}	C[6](C[6]C[6a]2O[6])(C[6]C[6,6a]H)(H){6|C<3>}	H(C[6]C[6,6a]C[6])	118.9841	1.894	8	118.9841	3.587	8	119.4598	2.630	50	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6,6a]-3:C[6]-3:H-1:	S[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]S[6]H)(H)	C[6](S[6]C[6a]N[6]O)(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]S[6]H)(H){1|H<1>,1|N<2>,1|O<1>,3|C<3>}	C[6](S[6]C[6a]N[6]O)(C[6]C[6,6a]H)(H){4|C<3>}	H(C[6]C[6,6a]C[6])	117.6910	0.508	2	117.6910	0.258	2	117.6910	0.258	2	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:B[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(B[6]N[6]C)(H)	C[6](C[6,6]C[6,6]C[6]Cr)(C[6]B[6]H)(H)	H(C[6]B[6]C[6])	C[6](C[6]C[6,6]H)(B[6]N[6]C)(H){1|Cr<9>,1|H<1>,2|C<4>}	C[6](C[6,6]C[6,6]C[6]Cr)(C[6]B[6]H)(H){1|H<1>,1|N<3>,3|C<4>}	H(C[6]B[6]C[6])	120.0065	0.070	2	120.0065	0.005	2	120.0065	0.005	2	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	B[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]B[6]H)(C[6]C[6]H)(H)	C[6](B[6]C[6]PtP)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]B[6]H)(C[6]C[6]H)(H){1|Pt<6>,1|C<3>,1|H<1>,1|P<4>}	C[6](B[6]C[6]PtP)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	118.4800	0.000	1	118.6728	0.026	4	118.6728	0.026	4	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	B[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]B[6]H)(C[6]C[6]H)(H)	C[6](B[6]C[6]PtP)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]B[6]H)(C[6]C[6]H)(H){1|Pt<6>,1|C<4>,1|H<1>,1|P<4>}	C[6](B[6]C[6]PtP)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	118.7370	0.117	3	118.6728	0.026	4	118.6728	0.026	4	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[3,5,6,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[3,5,6,6]O)(C[6]C[6]H)(H)	C[6](C[3,5,6,6]C[3,5,6,6]C[3,6,6]C[5,6])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[3,5,6,6]O)(C[6]C[6]H)(H){2|H<1>,3|C<4>}	C[6](C[3,5,6,6]C[3,5,6,6]C[3,6,6]C[5,6])(C[6]C[6]H)(O){2|C<3>,3|C<4>,3|H<1>}	H(C[6]C[6]2)	118.6050	0.000	1	118.6050	0.000	1	118.6050	0.000	1	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[3,5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[3,5,6]H)(C[6]C[6]H)(H)	C[6](C[3,5,6]C[3,5,6]C[3]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[3,5,6]H)(C[6]C[6]H)(H){1|H<1>,3|C<4>}	C[6](C[3,5,6]C[3,5,6]C[3]C[5])(C[6]C[6]H)(H){1|F<1>,2|C<3>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	118.9365	0.037	2	118.9365	0.001	2	118.9365	0.001	2	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[3,5,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[3,5,6]O)(C[6]C[6]C)(H)	C[6](C[3,5,6]C[3,5]C[5,6]C[3])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[3,5,6]O)(C[6]C[6]C)(H){1|H<1>,1|O<2>,3|C<4>}	C[6](C[3,5,6]C[3,5]C[5,6]C[3])(C[6]C[6]H)(O){1|O<2>,3|C<4>,4|H<1>}	H(C[6]C[6]2)	117.6740	0.000	1	118.2845	0.745	2	118.2845	0.745	2	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[3,5,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[3,5,6]O)(C[6]C[6]C)(H)	C[6](C[3,5,6]C[3,5]C[5,6]C[3])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[3,5,6]O)(C[6]C[6]C)(H){2|H<1>,3|C<4>}	C[6](C[3,5,6]C[3,5]C[5,6]C[3])(C[6]C[6]H)(O){2|C<3>,3|C<4>,3|H<1>}	H(C[6]C[6]2)	118.8950	0.000	1	118.2845	0.745	2	118.2845	0.745	2	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[3,6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[3,6,6]H)(C[6]C[6]C)(H)	C[6](C[3,6,6]C[6,6]N[3,6]C[3])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[3,6,6]H)(C[6]C[6]C)(H){1|H<1>,1|N<3>,2|C<4>}	C[6](C[3,6,6]C[6,6]N[3,6]C[3])(C[6]C[6]H)(H){1|Si<4>,1|C<3>,2|H<1>,3|C<4>}	H(C[6]C[6]2)	120.9050	0.000	1	120.9050	0.000	1	119.4193	1.826	3	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[3,6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[3,6,6]H)(C[6]C[6]O)(H)	C[6](C[3,6,6]C[3,6]2C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[3,6,6]H)(C[6]C[6]O)(H){2|H<1>,3|C<4>}	C[6](C[3,6,6]C[3,6]2C[6])(C[6]C[6]H)(H){1|C<3>,1|O<1>,3|C<4>,3|H<1>}	H(C[6]C[6]2)	118.6765	0.583	2	118.6765	0.340	2	119.4193	1.826	3	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[3,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[3,6]H)(C[6]C[6]H)(H)	C[6](C[3,6]C[3,6]C[3]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[3,6]H)(C[6]C[6]H)(H){1|H<1>,3|C<4>}	C[6](C[3,6]C[3,6]C[3]H)(C[6]C[6]H)(H){2|C<3>,3|H<1>}	H(C[6]C[6]2)	118.8210	0.000	1	119.1448	0.091	4	119.2885	0.157	11	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[3,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[3,6]H)(C[6]C[6]H)(H)	C[6](C[3,6]C[3,6]C[3]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[3,6]H)(C[6]C[6]H)(H){2|C<4>,2|H<1>}	C[6](C[3,6]C[3,6]C[3]H)(C[6]C[6]H)(H){1|C<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.4050	0.000	1	119.1448	0.091	4	119.2885	0.157	11	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[3,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[3,6]H)(C[6]C[6]H)(H)	C[6](C[3,6]C[3,6]C[3]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[3,6]H)(C[6]C[6]H)(H){2|C<4>,2|H<1>}	C[6](C[3,6]C[3,6]C[3]H)(C[6]C[6]H)(H){1|C<3>,1|P<4>,3|H<1>}	H(C[6]C[6]2)	119.1765	0.315	2	119.1448	0.091	4	119.2885	0.157	11	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[3,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[3,6]H)(C[6]C[6]H)(H)	C[6](C[3,6]Nb[3,4]C[3]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[3,6]H)(C[6]C[6]H)(H){1|Nb<6>,1|C<3>,1|C<4>,1|H<1>}	C[6](C[3,6]Nb[3,4]C[3]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<2>,2|N<3>,4|H<1>}	H(C[6]C[6]2)	119.7995	0.243	2	119.7995	0.059	2	119.2885	0.157	11	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[3,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[3,6]H)(C[6]C[6]O)(H)	C[6](C[3,6]C[3,6,6]C[3,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[3,6]H)(C[6]C[6]O)(H){2|C<4>,3|H<1>}	C[6](C[3,6]C[3,6,6]C[3,6]H)(C[6]C[6]H)(H){1|O<1>,4|C<4>}	H(C[6]C[6]2)	118.7800	0.000	1	118.7800	0.000	1	119.2885	0.157	11	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[3,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[3,6]H)(C[6]C[6]O)(H)	C[6](C[3,6]C[3]C[6]O[3])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[3,6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|H<1>,1|O<2>}	C[6](C[3,6]C[3]C[6]O[3])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>,2|C<4>}	H(C[6]C[6]2)	119.6060	0.000	1	119.6060	0.000	1	119.2885	0.157	11	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[3,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6,6]O)(C[6]C[3,6]H)(H)	C[6](C[3,6]C[5,6,6]C[3]O[3])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6,6]O)(C[6]C[3,6]H)(H){1|H<1>,1|O<2>,3|C<4>}	C[6](C[3,6]C[5,6,6]C[3]O[3])(C[6]C[6]H)(H){1|O<1>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	118.8180	0.000	1	118.8180	0.000	1	119.2885	0.157	11	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[3,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[3,6]H)(H)	C[6](C[3,6]C[6,6a]C[3]2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[3,6]H)(H){2|C<3>,2|C<4>}	C[6](C[3,6]C[6,6a]C[3]2)(C[6]C[6]H)(H){1|O<1>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.3955	0.179	2	119.3955	0.032	2	119.2885	0.157	11	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[3,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[3,6]O)(C[6]C[5,6]H)(H)	C[6](C[3,6]C[3,5,6]C[3,5]H)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[3,6]O)(C[6]C[5,6]H)(H){1|C<3>,1|H<1>,1|N<3>,2|C<4>}	C[6](C[3,6]C[3,5,6]C[3,5]H)(C[6]C[6]H)(O){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.5850	0.000	1	118.5850	0.000	1	118.6596	1.499	5	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[3,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[3,6]O)(C[6]C[6]C)(H)	C[6](C[3,6]C[3,6]C[3]C)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[3,6]O)(C[6]C[6]C)(H){1|O<1>,3|C<4>}	C[6](C[3,6]C[3,6]C[3]C)(C[6]C[6]H)(O){1|C<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	116.5920	0.000	1	116.5920	0.000	1	118.6596	1.499	5	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[3,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[3,6]O)(C[6]C[6]N)(H)	C[6](C[3,6]C[3,6]O[3]O)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[3,6]O)(C[6]C[6]N)(H){1|C<4>,1|O<1>,2|O<2>}	C[6](C[3,6]C[3,6]O[3]O)(C[6]C[6]H)(O){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	119.3695	0.431	2	119.3695	0.185	2	118.6596	1.499	5	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[3,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[3,6]O)(C[6]C[6]O)(H)	C[6](C[3,6]C[3,6]O[3]H)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[3,6]O)(C[6]C[6]O)(H){1|C<4>,2|H<1>,2|O<2>}	C[6](C[3,6]C[3,6]O[3]H)(C[6]C[6]H)(O){1|O<2>,2|C<4>}	H(C[6]C[6]2)	119.3820	0.000	1	119.3820	0.000	1	118.6596	1.499	5	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[3x6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[3x6]H)(C[6]C[5,6]C)(H)	C[6](C[3x6]C[5,3x6]Ge[3x6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[3x6]H)(C[6]C[5,6]C)(H){1|Ge<4>,1|C<3>,1|C<4>,1|H<1>}	C[6](C[3x6]C[5,3x6]Ge[3x6]H)(C[6]C[6]H)(H){1|Ge<4>,2|C<4>,4|C<3>}	H(C[6]C[6]2)	118.3530	0.000	1	118.3530	0.000	1	119.8454	1.579	9	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[3x6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[3x6]H)(C[6]C[6,6]O)(H)	C[6](C[3x6]C[3x6]C[6]O[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[3x6]H)(C[6]C[6,6]O)(H){1|H<1>,1|O<2>,3|C<4>}	C[6](C[3x6]C[3x6]C[6]O[6])(C[6]C[6]H)(H){1|H<1>,1|O<1>,1|O<2>,5|C<4>}	H(C[6]C[6]2)	119.7020	0.000	1	119.7020	0.000	1	119.8454	1.579	9	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[3x6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[3x6]H)(C[6]C[6]O)(H)	C[6](C[3x6]C[3x6]2H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[3x6]H)(C[6]C[6]O)(H){1|F<1>,1|H<1>,3|C<4>}	C[6](C[3x6]C[3x6]2H)(C[6]C[6]H)(H){1|O<1>,2|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.5550	0.000	1	120.0380	0.467	2	119.8454	1.579	9	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[3x6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[3x6]H)(C[6]C[6]O)(H)	C[6](C[3x6]C[3x6]2H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[3x6]H)(C[6]C[6]O)(H){1|H<1>,1|O<2>,3|C<4>}	C[6](C[3x6]C[3x6]2H)(C[6]C[6]H)(H){1|O<1>,2|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	120.5210	0.000	1	120.0380	0.467	2	119.8454	1.579	9	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[3x6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[3x6]H)(C[6]C[6]O)(H)	C[6](C[3x6]C[3x6]C[6,6]O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[3x6]H)(C[6]C[6]O)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[3x6]C[3x6]C[6,6]O)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>,2|C<4>,2|O<2>}	H(C[6]C[6]2)	118.9970	0.040	2	118.9970	0.002	2	119.8454	1.579	9	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[3x6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[3x6]H)(C[6]C[6]O)(H)	C[6](C[3x6]C[6,6,6a]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[3x6]H)(C[6]C[6]O)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[3x6]C[6,6,6a]C[6,6]C[6])(C[6]C[6]H)(H){1|O<1>,2|C<3>,3|C<4>,3|H<1>}	H(C[6]C[6]2)	121.4460	0.000	1	121.7680	0.207	2	119.8454	1.579	9	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[3x6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[3x6]H)(C[6]C[6]O)(H)	C[6](C[3x6]C[6,6,6a]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[3x6]H)(C[6]C[6]O)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[3x6]C[6,6,6a]C[6,6]C[6])(C[6]C[6]H)(H){1|O<1>,2|C<4>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	122.0900	0.000	1	121.7680	0.207	2	119.8454	1.579	9	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[3x6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[3x6]H)(C[6]C[6]O)(H)	C[6](C[3x6]C[6,6a]C[6,6]N[6,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[3x6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|N<3>,2|H<1>}	C[6](C[3x6]C[6,6a]C[6,6]N[6,6])(C[6]C[6]H)(H){1|H<1>,1|O<1>,1|O<2>,2|C<4>,3|C<3>}	H(C[6]C[6]2)	118.9480	0.000	1	118.9480	0.000	1	119.8454	1.579	9	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[3x6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[3x6]O)(C[6]C[6,6]C)(H)	C[6](C[3x6]C[6,6a]C[3x6]C[6])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[3x6]O)(C[6]C[6,6]C)(H){1|C<4>,1|H<1>,3|C<3>}	C[6](C[3x6]C[6,6a]C[3x6]C[6])(C[6]C[6]H)(O){1|H<1>,1|O<1>,1|O<2>,2|C<3>,3|C<4>}	H(C[6]C[6]2)	118.6190	0.000	1	118.6190	0.000	1	119.1609	0.558	15	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[3x6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[3x6]O)(C[6]C[6]H)(H)	C[6](C[3x6]C[3x6]2H)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[3x6]O)(C[6]C[6]H)(H){1|H<1>,1|O<1>,2|C<4>}	C[6](C[3x6]C[3x6]2H)(C[6]C[6]H)(O){1|C<4>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.0890	0.346	4	119.2777	0.602	12	119.1609	0.558	15	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[3x6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[3x6]O)(C[6]C[6]H)(H)	C[6](C[3x6]C[3x6]2H)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[3x6]O)(C[6]C[6]H)(H){1|H<1>,1|O<1>,2|C<4>}	C[6](C[3x6]C[3x6]2H)(C[6]C[6]H)(O){2|C<3>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	119.0295	0.414	2	119.2777	0.602	12	119.1609	0.558	15	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[3x6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[3x6]O)(C[6]C[6]H)(H)	C[6](C[3x6]C[3x6]2H)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[3x6]O)(C[6]C[6]H)(H){1|H<1>,1|O<1>,2|C<4>}	C[6](C[3x6]C[3x6]2H)(C[6]C[6]H)(O){2|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.4862	1.055	6	119.2777	0.602	12	119.1609	0.558	15	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[3x6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[3x6]O)(C[6]O[6]C)(H)	C[6](C[3x6]C[3x6]C[6,6]O[6])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[3x6]O)(C[6]O[6]C)(H){1|O<2>,2|C<4>}	C[6](C[3x6]C[3x6]C[6,6]O[6])(C[6]C[6]H)(O){1|O<2>,7|C<4>}	H(C[6]C[6]2)	118.3010	0.000	1	118.3010	0.000	1	119.1609	0.558	15	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[3x6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[4]O[6])(C[6]C[3x6]O)(H)	C[6](C[3x6]C[4,6,6]C[3x6]O)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[4]O[6])(C[6]C[3x6]O)(H){1|H<1>,1|O<2>,4|C<4>}	C[6](C[3x6]C[4,6,6]C[3x6]O)(C[6]C[6]H)(O){1|O<2>,2|H<1>,4|C<4>}	H(C[6]C[6]2)	119.1620	0.000	1	119.1620	0.000	1	119.1609	0.558	15	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[4,4,3x6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[3,4,4,6]C)(C[6]C[4,4,3x6]H)(H)	C[6](C[4,4,3x6]C[4,4,3x6]C[3x4,6]2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[3,4,4,6]C)(C[6]C[4,4,3x6]H)(H){1|C<3>,2|C<4>,2|H<3>}	C[6](C[4,4,3x6]C[4,4,3x6]C[3x4,6]2)(C[6]C[6]H)(H){1|H<1>,1|H<2>,2|C<4>,3|C<3>}	H(C[6]C[6]2)	116.7220	0.000	1	116.7220	0.000	1	116.7220	0.000	1	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[4,4,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[4,4,6]H)(C[6]C[6]H)(H)	C[6](C[4,4,6]C[3x4,6]C[3x4]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[4,4,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,2|C<4>}	C[6](C[4,4,6]C[3x4,6]C[3x4]C[6])(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|C<4>,2|H<1>,2|H<2>}	H(C[6]C[6]2)	120.0460	0.796	2	120.0460	0.634	2	120.0460	0.634	2	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[4,5,6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[4,5,6,6]H)(C[6]C[6]H)(H)	C[6](C[4,5,6,6]C[4,5,6,6]2C[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[4,5,6,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,2|C<4>}	C[6](C[4,5,6,6]C[4,5,6,6]2C[5,6])(C[6]C[6]H)(H){1|C<3>,1|O<1>,1|O<2>,2|H<1>,3|C<4>}	H(C[6]C[6]2)	118.8560	0.000	1	118.8560	0.000	1	118.8073	0.002	3	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[4,5,6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[4,5,6,6]H)(C[6]C[6]H)(H)	C[6](C[4,5,6,6]C[4,5,6,6]2O[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[4,5,6,6]H)(C[6]C[6]H)(H){1|H<1>,1|O<2>,2|C<4>}	C[6](C[4,5,6,6]C[4,5,6,6]2O[5,6])(C[6]C[6]H)(H){2|C<3>,2|H<1>,3|C<4>}	H(C[6]C[6]2)	118.7610	0.000	1	118.7610	0.000	1	118.8073	0.002	3	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[4,5,6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[4,5,6,6]H)(C[6]C[6]H)(H)	C[6](C[4,5,6,6]C[5,5,6,6]C[4,5,6]C[4,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[4,5,6,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,2|C<4>}	C[6](C[4,5,6,6]C[5,5,6,6]C[4,5,6]C[4,6a])(C[6]C[6]H)(H){1|C<4>,1|O<2>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	118.8050	0.000	1	118.8050	0.000	1	118.8073	0.002	3	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[4,5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[4,5,6]H)(C[6]C[6]H)(H)	C[6](C[4,5,6]C[4,5,6]C[4]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[4,5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,2|C<4>}	C[6](C[4,5,6]C[4,5,6]C[4]C[5])(C[6]C[6]H)(H){1|C<2>,2|C<3>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	119.6107	1.294	4	119.6107	1.674	4	119.6107	1.674	4	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[4,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[4,6]H)(C[6]C[6]H)(H)	C[6](C[4,6]C[5x3,4,5x5,20x6]C[4]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[4,6]H)(C[6]C[6]H)(H){1|C<6>,1|H<1>,2|C<4>}	C[6](C[4,6]C[5x3,4,5x5,20x6]C[4]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<5>,1|C<6>,4|B<6>,4|H<1>}	H(C[6]C[6]2)	119.9910	0.000	1	119.9425	0.005	2	118.9520	0.924	9	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[4,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[4,6]H)(C[6]C[6]H)(H)	C[6](C[4,6]C[5x3,4,5x5,20x6]C[4]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[4,6]H)(C[6]C[6]H)(H){1|C<6>,1|H<1>,2|C<4>}	C[6](C[4,6]C[5x3,4,5x5,20x6]C[4]C[6])(C[6]C[6]H)(H){1|C<3>,2|C<6>,4|B<6>,4|H<1>}	H(C[6]C[6]2)	119.8940	0.000	1	119.9425	0.005	2	118.9520	0.924	9	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[4,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[4,6]H)(C[6]C[6]O)(H)	C[6](C[4,6]C[4]C[6]N[4])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[4,6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[4,6]C[4]C[6]N[4])(C[6]C[6]H)(H){1|C<4>,1|O<1>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.1170	0.014	2	119.1170	0.000	2	118.9520	0.924	9	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[4,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[4,6]H)(C[6]N[6]O)(H)	C[6](C[4,6]C[4,6]2C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[4,6]H)(C[6]N[6]O)(H){1|H<1>,3|C<4>}	C[6](C[4,6]C[4,6]2C)(C[6]C[6]H)(H){1|C<4>,1|O<1>,2|H<1>,2|N<3>}	H(C[6]C[6]2)	118.6250	0.000	1	118.6250	0.000	1	118.9520	0.924	9	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[4,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[4,6]H)(C[6]N[6]O)(H)	C[6](C[4,6]C[4,6]2Cl)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[4,6]H)(C[6]N[6]O)(H){1|Cl<1>,1|H<1>,2|C<4>}	C[6](C[4,6]C[4,6]2Cl)(C[6]C[6]H)(H){1|C<4>,1|O<1>,2|H<1>,2|N<3>}	H(C[6]C[6]2)	117.9080	1.315	2	117.9080	1.730	2	118.9520	0.924	9	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[4,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[4,6]H)(C[6]N[6]O)(H)	C[6](C[4,6]C[4,6]C[4]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[4,6]H)(C[6]N[6]O)(H){1|H<1>,3|C<4>}	C[6](C[4,6]C[4,6]C[4]H)(C[6]C[6]H)(H){1|C<4>,1|N<3>,1|O<1>,1|S<4>,2|H<1>}	H(C[6]C[6]2)	118.1820	0.000	1	118.1820	0.000	1	118.9520	0.924	9	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[4,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6,6]O)(C[6]C[4,6]H)(H)	C[6](C[4,6]C[5,6,6]C[4]O[4])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6,6]O)(C[6]C[4,6]H)(H){1|H<1>,1|O<2>,3|C<4>}	C[6](C[4,6]C[5,6,6]C[4]O[4])(C[6]C[6]H)(H){1|O<1>,3|C<4>,3|H<1>}	H(C[6]C[6]2)	119.8260	0.000	1	119.8260	0.000	1	118.9520	0.924	9	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[4,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[4,6]O)(C[6]C[6,6]C)(H)	C[6](C[4,6]C[4,6,6]C[4]H)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[4,6]O)(C[6]C[6,6]C)(H){1|H<1>,1|O<2>,3|C<4>}	C[6](C[4,6]C[4,6,6]C[4]H)(C[6]C[6]H)(O){1|C<3>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	117.2870	0.000	1	117.2870	0.000	1	118.2826	0.627	8	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[4,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[4,6]O)(C[6]C[6,6]H)(H)	C[6](C[4,6]C[4,6,6]C[4]H)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[4,6]O)(C[6]C[6,6]H)(H){1|H<1>,1|N<3>,3|C<4>}	C[6](C[4,6]C[4,6,6]C[4]H)(C[6]C[6]H)(O){1|C<3>,1|C<4>,4|H<1>}	H(C[6]C[6]2)	118.1770	0.000	1	118.1770	0.000	1	118.2826	0.627	8	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[4,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[4,6]O)(C[6]C[6]H)(H)	C[6](C[4,6]C[4,5]C[4,6]C)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[4,6]O)(C[6]C[6]H)(H){1|C<3>,1|O<1>,2|C<4>}	C[6](C[4,6]C[4,5]C[4,6]C)(C[6]C[6]H)(O){1|C<4>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	117.9260	0.000	1	117.9260	0.000	1	118.2826	0.627	8	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[4,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[4,6]O)(C[6]C[6]H)(H)	C[6](C[4,6]C[4,5]C[4,6]H)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[4,6]O)(C[6]C[6]H)(H){1|H<1>,1|O<1>,2|C<4>}	C[6](C[4,6]C[4,5]C[4,6]H)(C[6]C[6]H)(O){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	118.7930	0.000	1	118.7930	0.000	1	118.2826	0.627	8	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[4,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[4,6]O)(C[6]C[6]H)(H)	C[6](C[4,6]C[4,6]2H)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[4,6]O)(C[6]C[6]H)(H){1|C<3>,1|H<1>,2|C<4>}	C[6](C[4,6]C[4,6]2H)(C[6]C[6]H)(O){1|C<4>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	117.7155	0.412	2	117.7155	0.170	2	118.2826	0.627	8	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[4,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[4,6]O)(C[6]C[6]O)(H)	C[6](C[4,6]C[4,5,6,6]C[4]H)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[4,6]O)(C[6]C[6]O)(H){2|C<4>,3|H<1>}	C[6](C[4,6]C[4,5,6,6]C[4]H)(C[6]C[6]H)(O){1|O<2>,2|H<1>,3|C<4>}	H(C[6]C[6]2)	119.3235	0.128	2	119.3235	0.016	2	118.2826	0.627	8	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[4x6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[4x6]H)(C[6]C[5,6]C)(H)	C[6](C[4x6]C[5,3x6]C[6,6]2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[4x6]H)(C[6]C[5,6]C)(H){2|C<3>,2|C<4>}	C[6](C[4x6]C[5,3x6]C[6,6]2)(C[6]C[6]H)(H){1|H<1>,1|O<1>,2|C<3>,2|O<2>,3|C<4>}	H(C[6]C[6]2)	118.1810	0.000	1	118.3353	0.022	3	118.3353	0.022	3	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[4x6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[4x6]H)(C[6]C[5,6]C)(H)	C[6](C[4x6]C[5,3x6]C[6,6]2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[4x6]H)(C[6]C[5,6]C)(H){2|C<3>,2|C<4>}	C[6](C[4x6]C[5,3x6]C[6,6]2)(C[6]C[6]H)(H){1|O<1>,1|O<2>,2|C<3>,2|H<1>,3|C<4>}	H(C[6]C[6]2)	118.4125	0.087	2	118.3353	0.022	3	118.3353	0.022	3	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[4x6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[4x6]O)(C[6]C[6]C)(H)	C[6](C[4x6]N[5a,6,6]C[3x6]C[6,6])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[4x6]O)(C[6]C[6]C)(H){1|C<3>,1|C<4>,1|N<3>,1|O<1>}	C[6](C[4x6]N[5a,6,6]C[3x6]C[6,6])(C[6]C[6]H)(O){1|H<1>,1|N<3>,3|C<3>,3|C<4>}	H(C[6]C[6]2)	119.0975	0.046	2	119.0975	0.002	2	119.0975	0.002	2	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,3x6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,3x6]H)(C[6]C[5,6]O)(H)	C[6](C[5,3x6]C[5,3x6]C[5,6]N[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,3x6]H)(C[6]C[5,6]O)(H){1|H<1>,1|N<3>,3|C<4>}	C[6](C[5,3x6]C[5,3x6]C[5,6]N[5,6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>,1|O<2>,5|C<4>}	H(C[6]C[6]2)	119.1090	0.000	1	119.1090	0.000	1	118.0661	0.809	7	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,3x6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,3x6]H)(C[6]C[6]H)(H)	C[6](C[5,3x6]C[6,6,6a]P[5,6,6]C[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,3x6]H)(C[6]C[6]H)(H){1|Si<4>,1|C<3>,1|C<4>,1|P<3>}	C[6](C[5,3x6]C[6,6,6a]P[5,6,6]C[5,6])(C[6]C[6]H)(H){1|Si<4>,2|H<1>,2|P<3>,3|C<3>}	H(C[6]C[6]2)	118.1140	0.000	1	117.4175	0.264	4	118.0661	0.809	7	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,3x6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,3x6]H)(C[6]C[6]H)(H)	C[6](C[5,3x6]C[6,6,6a]P[5,6,6]C[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,3x6]H)(C[6]C[6]H)(H){1|Si<4>,1|C<3>,1|C<4>,1|P<4>}	C[6](C[5,3x6]C[6,6,6a]P[5,6,6]C[5,6])(C[6]C[6]H)(H){1|Au<2>,1|Si<4>,2|H<1>,2|P<3>,3|C<3>}	H(C[6]C[6]2)	117.0460	0.000	1	117.4175	0.264	4	118.0661	0.809	7	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,3x6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,3x6]H)(C[6]C[6]H)(H)	C[6](C[5,3x6]C[6,6,6a]P[5,6,6]C[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,3x6]H)(C[6]C[6]H)(H){1|Si<4>,1|C<3>,1|C<4>,1|P<4>}	C[6](C[5,3x6]C[6,6,6a]P[5,6,6]C[5,6])(C[6]C[6]H)(H){1|Cu<3>,1|Si<4>,2|H<1>,2|P<3>,3|C<3>}	H(C[6]C[6]2)	117.2550	0.341	2	117.4175	0.264	4	118.0661	0.809	7	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,3x6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,3x6]H)(C[6]C[6]O)(H)	C[6](C[5,3x6]C[3x6]C[5,6]2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,3x6]H)(C[6]C[6]O)(H){2|H<1>,3|C<4>}	C[6](C[5,3x6]C[3x6]C[5,6]2)(C[6]C[6]H)(H){1|O<1>,4|C<4>,5|H<1>}	H(C[6]C[6]2)	119.0510	0.000	1	118.8420	0.087	2	118.0661	0.809	7	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,3x6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,3x6]H)(C[6]C[6]O)(H)	C[6](C[5,3x6]C[3x6]C[5,6]2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,3x6]H)(C[6]C[6]O)(H){5|C<4>}	C[6](C[5,3x6]C[3x6]C[5,6]2)(C[6]C[6]H)(H){1|O<1>,4|C<4>,5|H<1>}	H(C[6]C[6]2)	118.6330	0.000	1	118.8420	0.087	2	118.0661	0.809	7	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,5,6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,5,6,6]H)(C[6]C[6]H)(H)	C[6](C[5,5,6,6]C[4,5,6,6]C[5,6,6a]O[5,5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,5,6,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|O<2>}	C[6](C[5,5,6,6]C[4,5,6,6]C[5,6,6a]O[5,5])(C[6]C[6]H)(H){1|H<1>,2|C<4>,4|C<3>}	H(C[6]C[6]2)	119.1690	0.000	1	119.1690	0.000	1	119.7095	0.584	2	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,5,6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,5,6,6]H)(C[6]C[6]H)(H)	C[6](C[5,5,6,6]C[5,6,6a]C[5,6,6]C[5,5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,5,6,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,2|C<3>}	C[6](C[5,5,6,6]C[5,6,6a]C[5,6,6]C[5,5])(C[6]C[6]H)(H){1|C<4>,3|H<1>,4|C<3>}	H(C[6]C[6]2)	120.2500	0.000	1	120.2500	0.000	1	119.7095	0.584	2	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,5,6]H)(C[6]C[6]O)(H)	C[6](C[5,5,6]C[3x5,6]2C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,5,6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,2|C<4>}	C[6](C[5,5,6]C[3x5,6]2C[6])(C[6]C[6]H)(H){1|Cl<1>,1|H<1>,1|O<1>,2|C<3>,4|C<4>}	H(C[6]C[6]2)	119.0990	0.191	2	119.0990	0.036	2	118.8133	0.093	9	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,5,6]H)(C[6]C[6]O)(H)	C[6](C[5,5,6]C[5,5]C[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,5,6]H)(C[6]C[6]O)(H){1|Cl<1>,1|C<3>,2|C<4>}	C[6](C[5,5,6]C[5,5]C[5,6]C[5])(C[6]C[6]H)(H){1|O<1>,1|O<2>,2|C<3>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	118.5860	0.000	1	118.5860	0.000	1	118.8133	0.093	9	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,5,6]H)(C[6]C[6]O)(H)	C[6](C[5,5,6]C[5,6]N[5,5]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,5,6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[5,5,6]C[5,6]N[5,5]C[5])(C[6]C[6]H)(H){1|B<4>,1|H<1>,1|N<3>,1|O<2>,1|S<1>,1|S<2>,2|C<3>}	H(C[6]C[6]2)	119.0085	0.043	2	118.7560	0.095	6	118.8133	0.093	9	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,5,6]H)(C[6]C[6]O)(H)	C[6](C[5,5,6]C[5,6]N[5,5]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,5,6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|N<3>,2|H<1>}	C[6](C[5,5,6]C[5,6]N[5,5]C[5])(C[6]C[6]H)(H){1|H<1>,1|O<1>,1|S<4>,2|C<3>,3|C<4>}	H(C[6]C[6]2)	118.9700	0.000	1	118.7560	0.095	6	118.8133	0.093	9	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,5,6]H)(C[6]C[6]O)(H)	C[6](C[5,5,6]C[5,6]N[5,5]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,5,6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|N<3>,2|H<1>}	C[6](C[5,5,6]C[5,6]N[5,5]C[5])(C[6]C[6]H)(H){1|H<1>,1|O<1>,2|C<4>,4|C<3>}	H(C[6]C[6]2)	118.3720	0.013	2	118.7560	0.095	6	118.8133	0.093	9	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,5,6]H)(C[6]C[6]O)(H)	C[6](C[5,5,6]C[5,6]N[5,5]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,5,6]H)(C[6]C[6]O)(H){1|N<3>,2|C<4>,2|H<1>}	C[6](C[5,5,6]C[5,6]N[5,5]C[5])(C[6]C[6]H)(H){1|C<3>,1|O<1>,2|H<1>,5|C<4>}	H(C[6]C[6]2)	118.8050	0.000	1	118.7560	0.095	6	118.8133	0.093	9	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,5,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,5,6]O)(C[6]C[5,6]H)(H)	C[6](C[5,5,6]C[5,5]O[5,6]C[5])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,5,6]O)(C[6]C[5,6]H)(H){1|C<3>,1|H<1>,1|O<2>,2|C<4>}	C[6](C[5,5,6]C[5,5]O[5,6]C[5])(C[6]C[6]H)(O){1|C<3>,3|C<4>,3|H<1>}	H(C[6]C[6]2)	120.3850	0.000	1	120.3920	0.006	3	119.4122	1.156	6	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,5,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,5,6]O)(C[6]C[5,6]H)(H)	C[6](C[5,5,6]C[5,5]O[5,6]C[5])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,5,6]O)(C[6]C[5,6]H)(H){1|H<1>,1|O<2>,3|C<4>}	C[6](C[5,5,6]C[5,5]O[5,6]C[5])(C[6]C[6]H)(O){1|O<2>,3|C<4>,4|H<1>}	H(C[6]C[6]2)	120.4700	0.000	1	120.3920	0.006	3	119.4122	1.156	6	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,5,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,5,6]O)(C[6]C[5,6]H)(H)	C[6](C[5,5,6]C[5,5]O[5,6]C[5])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,5,6]O)(C[6]C[5,6]H)(H){1|O<2>,4|C<4>}	C[6](C[5,5,6]C[5,5]O[5,6]C[5])(C[6]C[6]H)(O){4|C<4>,4|H<1>}	H(C[6]C[6]2)	120.3210	0.000	1	120.3920	0.006	3	119.4122	1.156	6	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,5,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,5,6]O)(C[6]C[6,6a]H)(H)	C[6](C[5,5,6]C[5,6,6a]C[5,5,6]O[5])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,5,6]O)(C[6]C[6,6a]H)(H){1|C<4>,1|O<2>,2|C<3>}	C[6](C[5,5,6]C[5,6,6a]C[5,5,6]O[5])(C[6]C[6]H)(O){1|H<1>,1|O<2>,5|C<3>}	H(C[6]C[6]2)	118.4240	0.098	2	118.4240	0.010	2	119.4122	1.156	6	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,5,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,5,6]O)(C[6]C[6]H)(H)	C[6](C[5,5,6]C[5,5,6]C[5,6]C[5])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,5,6]O)(C[6]C[6]H)(H){5|C<4>}	C[6](C[5,5,6]C[5,5,6]C[5,6]C[5])(C[6]C[6]H)(O){1|C<3>,2|O<2>,3|C<4>,4|H<1>}	H(C[6]C[6]2)	118.4490	0.000	1	118.4490	0.000	1	119.4122	1.156	6	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6,6]H)(C[6]C[5,6,6]O)(H)	C[6](C[5,6,6]C[5,5,6,6]C[5,6,6]Br)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6,6]H)(C[6]C[5,6,6]O)(H){1|Br<1>,1|H<1>,3|C<4>}	C[6](C[5,6,6]C[5,5,6,6]C[5,6,6]Br)(C[6]C[6]H)(H){1|O<1>,2|C<4>,2|H<1>,2|O<2>}	H(C[6]C[6]2)	119.4250	0.000	1	119.4250	0.000	1	119.0049	0.155	14	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6,6]H)(C[6]C[6]C)(H)	C[6](C[5,6,6]N[5,6,6]C[5,6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6,6]H)(C[6]C[6]C)(H){1|C<4>,1|H<1>,2|N<3>}	C[6](C[5,6,6]N[5,6,6]C[5,6]N[6])(C[6]C[6]H)(H){2|C<4>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	118.4610	0.000	1	118.4610	0.000	1	119.0049	0.155	14	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6,6]H)(C[6]C[6]H)(H)	C[6](C[5,6,6]C[5,6,6]C[6]O[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|O<2>}	C[6](C[5,6,6]C[5,6,6]C[6]O[5])(C[6]C[6]H)(H){1|O<2>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.1810	0.088	2	119.1810	0.008	2	119.0049	0.155	14	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6,6]H)(C[6]C[6]H)(H)	C[6](C[5,6,6]C[6,6]N[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[5,6,6]C[6,6]N[5,6]C[5])(C[6]C[6]H)(H){1|C<4>,1|O<2>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.5430	0.000	1	119.5430	0.000	1	119.0049	0.155	14	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6,6]H)(C[6]C[6]O)(H)	C[6](C[5,6,6]C[3,5,6]C[5,6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6,6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,2|C<4>}	C[6](C[5,6,6]C[3,5,6]C[5,6,6]C[6])(C[6]C[6]H)(H){1|H<1>,1|O<1>,3|C<3>,4|C<4>}	H(C[6]C[6]2)	119.0500	0.404	2	119.0500	0.164	2	119.0049	0.155	14	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6,6]H)(C[6]C[6]O)(H)	C[6](C[5,6,6]C[5,5,6,6]C[5,6,6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6,6]H)(C[6]C[6]O)(H){2|Cl<1>,1|C<3>,2|C<4>}	C[6](C[5,6,6]C[5,5,6,6]C[5,6,6]C)(C[6]C[6]H)(H){1|C<3>,1|O<1>,1|O<2>,3|C<4>}	H(C[6]C[6]2)	118.2230	0.000	1	118.2230	0.000	1	119.0049	0.155	14	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6,6]H)(C[6]C[6]O)(H)	C[6](C[5,6,6]C[5,6,6]C[5]O[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6,6]H)(C[6]C[6]O)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[5,6,6]C[5,6,6]C[5]O[6])(C[6]C[6]H)(H){1|N<3>,1|O<1>,2|H<1>,4|C<4>}	H(C[6]C[6]2)	118.9510	0.000	1	118.9510	0.000	1	119.0049	0.155	14	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6,6]H)(C[6]C[6]O)(H)	C[6](C[5,6,6]C[5,6]2C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6,6]H)(C[6]C[6]O)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[5,6,6]C[5,6]2C[6])(C[6]C[6]H)(H){1|C<3>,1|O<1>,3|H<1>,4|C<4>}	H(C[6]C[6]2)	118.4800	0.000	1	118.4800	0.000	1	119.0049	0.155	14	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6,6]H)(C[6]C[6]O)(H)	C[6](C[5,6,6]C[6,6]N[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6,6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|N<3>,2|H<1>}	C[6](C[5,6,6]C[6,6]N[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|O<1>,3|C<3>,3|C<4>}	H(C[6]C[6]2)	119.1160	0.000	1	119.2310	0.026	2	119.0049	0.155	14	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6,6]H)(C[6]C[6]O)(H)	C[6](C[5,6,6]C[6,6]N[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6,6]H)(C[6]C[6]O)(H){1|H<1>,1|N<3>,2|C<3>}	C[6](C[5,6,6]C[6,6]N[5,6]C[5])(C[6]C[6]H)(H){1|C<4>,1|O<1>,5|C<3>}	H(C[6]C[6]2)	119.3460	0.000	1	119.2310	0.026	2	119.0049	0.155	14	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6,6]H)(C[6]C[6]O)(H)	C[6](C[5,6,6]C[6,6a]C[5,6]2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6,6]H)(C[6]C[6]O)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[5,6,6]C[6,6a]C[5,6]2)(C[6]C[6]H)(H){1|C<4>,1|O<1>,2|H<1>,2|N<3>,3|C<3>}	H(C[6]C[6]2)	119.0290	0.000	1	119.0290	0.000	1	119.0049	0.155	14	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6,6]H)(C[6]C[6]O)(H)	C[6](C[5,6,6]C[6,6a]C[5,6]N[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6,6]H)(C[6]C[6]O)(H){1|H<1>,1|N<3>,2|C<3>}	C[6](C[5,6,6]C[6,6a]C[5,6]N[5,6])(C[6]C[6]H)(H){1|O<1>,3|C<3>,3|C<4>}	H(C[6]C[6]2)	119.0330	0.000	1	119.0330	0.000	1	119.0049	0.155	14	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6,6]H)(C[6]C[5,6,6]O)(H)	C[6](C[5,6,6]C[5,5,6,6]C[5,6,6]H)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6,6]H)(C[6]C[5,6,6]O)(H){1|Br<1>,1|H<1>,3|C<4>}	C[6](C[5,6,6]C[5,5,6,6]C[5,6,6]H)(C[6]C[6]H)(O){1|O<2>,2|H<1>,4|C<4>}	H(C[6]C[6]2)	119.4980	0.000	1	119.4980	0.000	1	118.9589	0.692	23	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6,6]O)(C[6]C[3,6]H)(H)	C[6](C[5,6,6]C[5,5,6]C[5,6,6]H)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6,6]O)(C[6]C[3,6]H)(H){1|H<1>,1|O<2>,3|C<4>}	C[6](C[5,6,6]C[5,5,6]C[5,6,6]H)(C[6]C[6]H)(O){1|O<2>,2|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.8020	0.000	1	118.8020	0.000	1	118.9589	0.692	23	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6,6]O)(C[6]C[4,6]H)(H)	C[6](C[5,6,6]C[5,5,6]C[5,6,6]H)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6,6]O)(C[6]C[4,6]H)(H){1|H<1>,1|O<2>,3|C<4>}	C[6](C[5,6,6]C[5,5,6]C[5,6,6]H)(C[6]C[6]H)(O){1|O<2>,2|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.8290	0.000	1	119.8290	0.000	1	118.9589	0.692	23	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6,6]O)(C[6]C[5,6]H)(H)	C[6](C[5,6,6]C[5,5,6,6]C[5,5,6]H)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6,6]O)(C[6]C[5,6]H)(H){1|H<1>,1|N<3>,3|C<4>}	C[6](C[5,6,6]C[5,5,6,6]C[5,5,6]H)(C[6]C[6]H)(O){1|C<3>,1|O<2>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	118.8900	0.000	1	118.8900	0.000	1	118.9589	0.692	23	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6,6]O)(C[6]C[5,6]H)(H)	C[6](C[5,6,6]C[6,6a]C[5,6]O[5,6])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6,6]O)(C[6]C[5,6]H)(H){1|C<3>,1|H<1>,1|O<2>,2|C<4>}	C[6](C[5,6,6]C[6,6a]C[5,6]O[5,6])(C[6]C[6]H)(O){2|C<3>,2|H<1>,3|C<4>}	H(C[6]C[6]2)	120.0370	0.000	1	120.0370	0.000	1	118.9589	0.692	23	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6,6]O)(C[6]C[5,6]O)(H)	C[6](C[5,6,6]C[5,6,6]2O)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6,6]O)(C[6]C[5,6]O)(H){1|H<1>,1|O<2>,3|C<4>}	C[6](C[5,6,6]C[5,6,6]2O)(C[6]C[6]H)(O){1|C<3>,1|O<2>,5|C<4>}	H(C[6]C[6]2)	121.1870	0.000	1	121.1870	0.000	1	118.9589	0.692	23	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6,6]O)(C[6]C[5,6]Si)(H)	C[6](C[5,6,6]C[5,6]2C[6])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6,6]O)(C[6]C[5,6]Si)(H){1|C<4>,1|H<1>,3|C<3>}	C[6](C[5,6,6]C[5,6]2C[6])(C[6]C[6]H)(O){1|Si<4>,1|C<3>,1|O<1>,2|H<1>,3|C<4>}	H(C[6]C[6]2)	118.2690	0.000	1	118.2690	0.000	1	118.9589	0.692	23	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6,6]O)(C[6]C[6,6]Br)(H)	C[6](C[5,6,6]C[5,6,6]C[5,6]O)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6,6]O)(C[6]C[6,6]Br)(H){1|C<3>,1|H<1>,1|O<2>,2|C<4>}	C[6](C[5,6,6]C[5,6,6]C[5,6]O)(C[6]C[6]H)(O){1|Br<1>,2|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	120.0320	0.202	2	120.0320	0.041	2	118.9589	0.692	23	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6,6]O)(C[6]C[6]C)(H)	C[6](C[5,6,6]C[5,5,6]C[5,6,6]C)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6,6]O)(C[6]C[6]C)(H){1|O<1>,3|C<4>}	C[6](C[5,6,6]C[5,5,6]C[5,6,6]C)(C[6]C[6]H)(O){1|H<1>,2|C<3>,4|C<4>}	H(C[6]C[6]2)	117.2340	0.000	1	117.2340	0.000	1	118.9589	0.692	23	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6,6]O)(C[6]C[6]C)(H)	C[6](C[5,6,6]C[6,6]N[5,6]C[5])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6,6]O)(C[6]C[6]C)(H){1|C<3>,1|C<4>,1|N<3>,2|H<1>}	C[6](C[5,6,6]C[6,6]N[5,6]C[5])(C[6]C[6]H)(O){1|H<1>,3|C<3>,4|C<4>}	H(C[6]C[6]2)	118.8000	0.000	1	118.5755	0.101	2	118.9589	0.692	23	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6,6]O)(C[6]C[6]C)(H)	C[6](C[5,6,6]C[6,6]N[5,6]C[5])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6,6]O)(C[6]C[6]C)(H){1|C<3>,1|C<4>,1|N<3>,2|H<1>}	C[6](C[5,6,6]C[6,6]N[5,6]C[5])(C[6]C[6]H)(O){2|H<1>,3|C<3>,3|C<4>}	H(C[6]C[6]2)	118.3510	0.000	1	118.5755	0.101	2	118.9589	0.692	23	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6,6]O)(C[6]C[6]H)(H)	C[6](C[5,6,6]C[5,4x6]C[5,6]C[6])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6,6]O)(C[6]C[6]H)(H){5|C<4>}	C[6](C[5,6,6]C[5,4x6]C[5,6]C[6])(C[6]C[6]H)(O){1|C<3>,2|O<2>,3|C<4>,4|H<1>}	H(C[6]C[6]2)	118.0460	0.000	1	118.0460	0.000	1	118.9589	0.692	23	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6,6]O)(C[6]C[6]H)(H)	C[6](C[5,6,6]C[5,5,6]C[5,6,6]H)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6,6]O)(C[6]C[6]H)(H){1|H<1>,1|O<1>,2|C<4>}	C[6](C[5,6,6]C[5,5,6]C[5,6,6]H)(C[6]C[6]H)(O){2|C<3>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	118.6985	0.167	8	118.6985	0.028	8	118.9589	0.692	23	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6,6]O)(C[6]C[6]O)(H)	C[6](C[5,6,6]C[5,5,6]C[5,6,6]C)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6,6]O)(C[6]C[6]O)(H){1|O<1>,3|C<4>}	C[6](C[5,6,6]C[5,5,6]C[5,6,6]C)(C[6]C[6]H)(O){1|H<1>,1|O<2>,1|S<3>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	119.0080	0.000	1	118.7300	0.155	2	118.9589	0.692	23	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6,6]O)(C[6]C[6]O)(H)	C[6](C[5,6,6]C[5,5,6]C[5,6,6]C)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6,6]O)(C[6]C[6]O)(H){1|O<1>,3|C<4>}	C[6](C[5,6,6]C[5,5,6]C[5,6,6]C)(C[6]C[6]H)(O){1|H<1>,1|O<2>,2|C<3>,3|C<4>}	H(C[6]C[6]2)	118.4520	0.000	1	118.7300	0.155	2	118.9589	0.692	23	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[5,6]Br)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,5]N[5,6]H)(C[6]C[6]H)(Br)	H(C[6]C[6]2)	C[6](C[6]C[5,6]Br)(C[6]C[6]H)(H){1|C<4>,1|N<3>,2|H<1>}	C[6](C[5,6]C[5,5]N[5,6]H)(C[6]C[6]H)(Br){1|H<1>,2|C<4>,3|C<3>}	H(C[6]C[6]2)	119.7225	0.244	2	119.7225	0.060	2	119.9998	0.123	5	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[5,6]Br)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Fe)(C[6]C[6]H)(Br)	H(C[6]C[6]2)	C[6](C[6]C[5,6]Br)(C[6]C[6]H)(H){1|Fe<10>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Fe)(C[6]C[6]H)(Br){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	120.2360	0.000	1	120.2360	0.000	1	119.9998	0.123	5	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[5,6]Br)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Hf)(C[6]C[6]H)(Br)	H(C[6]C[6]2)	C[6](C[6]C[5,6]Br)(C[6]C[6]H)(H){1|Hf<12>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Hf)(C[6]C[6]H)(Br){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	120.1590	0.416	2	120.1590	0.173	2	119.9998	0.123	5	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[5,6]Cl)(C[6]C[6]O)(H)	C[6](C[5,6]C[5]C[6]N[5])(C[6]C[6]H)(Cl)	H(C[6]C[6]2)	C[6](C[6]C[5,6]Cl)(C[6]C[6]O)(H){1|H<1>,1|N<3>,2|C<3>}	C[6](C[5,6]C[5]C[6]N[5])(C[6]C[6]H)(Cl){1|C<4>,1|H<1>,1|O<1>,4|C<3>}	H(C[6]C[6]2)	119.1160	0.000	1	119.1160	0.000	1	119.1160	0.000	1	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[3,6]O)(C[6]C[5,6]H)(H)	C[6](C[5,6]C[3,5,6]C[6a]N[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[3,6]O)(C[6]C[5,6]H)(H){1|C<3>,1|H<1>,1|N<3>,2|C<4>}	C[6](C[5,6]C[3,5,6]C[6a]N[5])(C[6]C[6]H)(H){1|H<1>,1|O<1>,1|S<4>,2|C<3>,3|C<4>}	H(C[6]C[6]2)	118.6190	0.000	1	118.6190	0.000	1	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[3x6]C[6])(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,6]C[5]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[3x6]C[6])(C[6]C[5,6]H)(H){1|H<1>,6|C<4>}	C[6](C[5,6]C[5,6]C[5]C)(C[6]C[6]H)(H){1|C<3>,2|H<1>,4|C<4>}	H(C[6]C[6]2)	119.0410	0.000	1	119.0410	0.000	1	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[4,6]N)(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5]O[5]O[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[4,6]N)(C[6]C[5,6]H)(H){2|O<2>,3|C<4>}	C[6](C[5,6]C[5]O[5]O[6])(C[6]C[6]H)(H){1|N<2>,2|H<1>,3|C<4>}	H(C[6]C[6]2)	119.6980	0.328	2	119.6980	0.108	2	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,5,6]O)(C[6]C[5,6]H)(H)	C[6](C[5,6]O[5,6]C[5]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,5,6]O)(C[6]C[5,6]H)(H){1|O<2>,4|C<4>}	C[6](C[5,6]O[5,6]C[5]C)(C[6]C[6]H)(H){1|O<1>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	120.3330	0.000	1	120.3330	0.000	1	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,5,6]O)(C[6]C[5,6]H)(H)	C[6](C[5,6]O[5,6]C[5]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,5,6]O)(C[6]C[5,6]H)(H){1|C<3>,1|H<1>,1|O<2>,2|C<4>}	C[6](C[5,6]O[5,6]C[5]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<1>,2|H<1>}	H(C[6]C[6]2)	120.3880	0.000	1	120.4275	0.003	2	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,5,6]O)(C[6]C[5,6]H)(H)	C[6](C[5,6]O[5,6]C[5]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,5,6]O)(C[6]C[5,6]H)(H){1|H<1>,1|O<2>,3|C<4>}	C[6](C[5,6]O[5,6]C[5]H)(C[6]C[6]H)(H){1|O<1>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	120.4670	0.000	1	120.4275	0.003	2	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6,6]O)(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,5,6,6]N[5]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6,6]O)(C[6]C[5,6]H)(H){1|H<1>,1|N<3>,3|C<4>}	C[6](C[5,6]C[5,5,6,6]N[5]C)(C[6]C[6]H)(H){1|H<1>,1|O<1>,1|S<4>,3|C<4>}	H(C[6]C[6]2)	118.8670	0.000	1	118.8670	0.000	1	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6,6]O)(C[6]C[5,6]H)(H)	C[6](C[5,6]O[5,6]C[5]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6,6]O)(C[6]C[5,6]H)(H){1|C<3>,1|H<1>,1|O<2>,2|C<4>}	C[6](C[5,6]O[5,6]C[5]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>,2|C<4>}	H(C[6]C[6]2)	120.0290	0.000	1	120.0290	0.000	1	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[5,6]O)(H)	C[6](C[5,6]C[5,5,6]C[5]N)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[5,6]O)(H){1|H<1>,1|N<3>,1|O<2>,2|C<4>}	C[6](C[5,6]C[5,5,6]C[5]N)(C[6]C[6]H)(H){1|C<3>,1|O<1>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	118.6690	0.000	1	118.6690	0.000	1	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[5,6]O)(H)	C[6](C[5,6]C[5,5,6]N[5]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[5,6]O)(H){1|H<1>,1|N<3>,3|C<4>}	C[6](C[5,6]C[5,5,6]N[5]C)(C[6]C[6]H)(H){1|H<1>,1|O<1>,1|S<4>,3|C<4>}	H(C[6]C[6]2)	118.6280	0.000	1	118.6280	0.000	1	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[5,6]O)(H)	C[6](C[5,6]C[5,5,6]O[5]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[5,6]O)(H){1|H<1>,1|O<2>,3|C<4>}	C[6](C[5,6]C[5,5,6]O[5]C)(C[6]C[6]H)(H){1|H<1>,1|O<1>,3|C<4>}	H(C[6]C[6]2)	118.5990	0.000	1	118.5990	0.000	1	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[5,6]O)(H)	C[6](C[5,6]C[5,5]C[5,6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[5,6]O)(H){5|C<4>}	C[6](C[5,6]C[5,5]C[5,6]C)(C[6]C[6]H)(H){1|C<3>,1|O<1>,2|H<1>,3|C<4>}	H(C[6]C[6]2)	119.9560	0.106	2	119.9560	0.011	2	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[5,6]O)(H)	C[6](C[5,6]C[5,6]C[5]O[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[5,6]O)(H){1|C<3>,1|H<1>,1|O<2>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]O[5])(C[6]C[6]H)(H){1|H<1>,1|O<1>,2|C<4>,3|C<3>}	H(C[6]C[6]2)	119.1660	0.000	1	119.1660	0.000	1	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[5,6]O)(H)	C[6](C[5,6]O[5,6]C[5]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[5,6]O)(H){1|C<2>,1|N<3>,1|O<2>,2|C<4>}	C[6](C[5,6]O[5,6]C[5]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>,2|C<4>}	H(C[6]C[6]2)	120.1050	0.218	2	120.7777	1.381	3	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[5,6]O)(H)	C[6](C[5,6]O[5,6]C[5]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[5,6]O)(H){1|C<4>,1|H<1>,1|O<2>,2|C<3>}	C[6](C[5,6]O[5,6]C[5]C)(C[6]C[6]H)(H){1|C<4>,1|O<1>,2|C<3>}	H(C[6]C[6]2)	122.1230	0.000	1	120.7777	1.381	3	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6,6]C)(H)	C[6](C[5,6]C[5,6,6]Si[5]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6,6]C)(H){1|Si<4>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[5,6]C[5,6,6]Si[5]H)(C[6]C[6]H)(H){1|Si<4>,1|C<3>,1|O<2>,4|C<4>}	H(C[6]C[6]2)	119.0370	0.000	1	119.0370	0.000	1	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6,6]H)(H)	C[6](C[5,6]C[5,6,6]C[5]Ca)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6,6]H)(H){1|Ca<12>,1|C<3>,2|C<4>}	C[6](C[5,6]C[5,6,6]C[5]Ca)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.4717	0.175	3	118.4717	0.031	3	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6,6]H)(H)	C[6](C[5,6]C[5,6,6]C[5]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6,6]H)(H){1|C<3>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6,6]C[5]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>,1|O<2>,2|C<4>}	H(C[6]C[6]2)	119.1950	0.000	1	119.1950	0.000	1	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6,6]H)(H)	C[6](C[5,6]C[5,6,6]C[5]O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6,6]H)(H){1|C<3>,1|O<2>,2|C<4>}	C[6](C[5,6]C[5,6,6]C[5]O)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>,1|O<2>,2|C<4>}	H(C[6]C[6]2)	118.8280	0.000	1	118.8280	0.000	1	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6,6]H)(H)	C[6](C[5,6]C[5,6,6]N[5]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6,6]H)(H){1|H<1>,1|N<3>,2|C<4>}	C[6](C[5,6]C[5,6,6]N[5]H)(C[6]C[6]H)(H){1|S<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	118.8380	0.000	1	118.8380	0.000	1	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6,6]H)(H)	C[6](C[5,6]C[5,6,6]O[5]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6,6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|O<2>}	C[6](C[5,6]C[5,6,6]O[5]H)(C[6]C[6]H)(H){1|N<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9430	0.000	1	119.9430	0.000	1	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6,6]O)(H)	C[6](C[5,6]C[5,6,6]C[5]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6,6]O)(H){5|C<4>}	C[6](C[5,6]C[5,6,6]C[5]C)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<1>,1|O<2>,3|H<1>}	H(C[6]C[6]2)	116.6385	0.194	2	116.6385	0.038	2	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6,6]O)(H)	C[6](C[5,6]C[5,6,6]O[5]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6,6]O)(H){1|C<3>,1|O<2>,2|C<4>}	C[6](C[5,6]C[5,6,6]O[5]C)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<2>,2|C<3>}	H(C[6]C[6]2)	118.7690	0.000	1	119.0165	0.123	2	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6,6]O)(H)	C[6](C[5,6]C[5,6,6]O[5]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6,6]O)(H){1|C<3>,2|C<4>,2|O<2>}	C[6](C[5,6]C[5,6,6]O[5]C)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|N<3>,1|O<1>}	H(C[6]C[6]2)	119.2640	0.000	1	119.0165	0.123	2	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6,6]O)(H)	C[6](C[5,6]C[5,6,6]O[5]O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6,6]O)(H){1|C<3>,2|C<4>,2|O<2>}	C[6](C[5,6]C[5,6,6]O[5]O)(C[6]C[6]H)(H){1|H<1>,1|O<1>,3|C<4>}	H(C[6]C[6]2)	116.1840	0.000	1	116.1840	0.000	1	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6,6]O)(H)	C[6](C[5,6]C[6,6]O[5]2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6,6]O)(H){1|C<3>,2|C<4>,2|O<2>}	C[6](C[5,6]C[6,6]O[5]2)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>,3|C<4>}	H(C[6]C[6]2)	118.7137	0.182	3	118.7137	0.033	3	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]C)(H)	C[6](C[5,6]C[5,5,6]C[5]O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]C)(H){1|H<1>,1|O<2>,2|C<4>}	C[6](C[5,6]C[5,5,6]C[5]O)(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<4>,3|C<3>}	H(C[6]C[6]2)	119.0220	0.000	1	119.0220	0.000	1	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]C)(H)	C[6](C[5,6]C[5,5]N[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]C)(H){1|C<4>,1|N<3>,2|H<1>}	C[6](C[5,6]C[5,5]N[5,6]H)(C[6]C[6]H)(H){1|C<2>,2|C<4>,3|C<3>}	H(C[6]C[6]2)	119.6910	0.000	1	119.6910	0.000	1	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]C)(H)	C[6](C[5,6]C[5,6]2Zr)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]C)(H){1|Zr<13>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]2Zr)(C[6]C[6]H)(H){2|C<3>,3|C<4>}	H(C[6]C[6]2)	118.7931	0.250	12	118.7931	0.063	12	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]C)(H)	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]C)(H){1|C<3>,1|C<4>,2|H<1>}	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	118.7130	0.000	1	118.7130	0.000	1	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]C)(H)	C[6](C[5,6]C[5,6]C[5]Hf)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]C)(H){1|Hf<13>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Hf)(C[6]C[6]H)(H){1|C<3>,1|C<5>,3|C<4>}	H(C[6]C[6]2)	118.2430	0.143	10	118.2430	0.020	10	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]C)(H)	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]C)(H){1|Ru<7>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]H)(H){1|C<3>,1|C<5>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	118.8660	0.000	1	118.8660	0.000	1	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]C)(H)	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]C)(H){1|Zr<13>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(H){1|C<3>,1|C<5>,3|C<4>}	H(C[6]C[6]2)	118.2692	0.183	13	118.2920	0.032	15	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]C)(H)	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]C)(H){1|Zr<13>,1|N<3>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(H){1|Si<5>,1|C<3>,3|C<4>}	H(C[6]C[6]2)	118.4405	0.032	2	118.2920	0.032	15	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]C)(H)	C[6](C[5,6]C[5]C[6]O[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]C)(H){1|O<2>,3|C<4>}	C[6](C[5,6]C[5]C[6]O[5])(C[6]C[6]H)(H){1|H<1>,1|O<2>,2|C<3>,4|C<4>}	H(C[6]C[6]2)	120.5500	0.000	1	120.5500	0.000	1	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]Cl)(H)	C[6](C[5,6]C[5]2C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]Cl)(H){1|H<1>,3|C<3>}	C[6](C[5,6]C[5]2C[6])(C[6]C[6]H)(H){1|Cl<1>,1|C<4>,1|O<1>,4|C<3>}	H(C[6]C[6]2)	122.7170	0.000	1	122.7170	0.000	1	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,5]C[5,6]Li)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Li<7>,1|C<4>,1|C<5>,1|H<1>}	C[6](C[5,6]C[5,5]C[5,6]Li)(C[6]C[6]H)(H){1|Li<7>,1|C<3>,1|C<5>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	120.9350	0.000	1	120.9350	0.000	1	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6,6]C[5,6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ru<10>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6,6]C[5,6]Ru)(C[6]C[6]H)(H){1|C<3>,1|H<1>,3|C<4>}	H(C[6]C[6]2)	119.3155	0.350	2	119.3155	0.123	2	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]2Fe)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Fe<10>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]2Fe)(C[6]C[6]H)(H){1|C<3>,1|H<1>,3|C<4>}	H(C[6]C[6]2)	122.1180	0.000	1	120.7170	3.926	2	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]2Fe)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Fe<10>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]2Fe)(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	119.3160	0.000	1	120.7170	3.926	2	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]2Hf)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Hf<12>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]2Hf)(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	119.3870	0.101	5	119.6226	0.282	9	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]2Hf)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Hf<13>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]2Hf)(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	119.9170	0.729	4	119.6226	0.282	9	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]2Mn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Mn<8>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]2Mn)(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	120.2645	1.149	4	120.2645	1.320	4	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]2Nd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Nd<19>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]2Nd)(C[6]C[6]H)(H){1|C<3>,1|H<1>,3|C<4>}	H(C[6]C[6]2)	119.8630	0.000	1	119.8365	0.001	2	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]2Nd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Nd<19>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]2Nd)(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	119.8100	0.000	1	119.8365	0.001	2	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]2Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ru<11>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]2Ru)(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	119.1797	0.191	8	119.1212	0.045	10	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]2Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ru<7>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]2Ru)(C[6]C[6]H)(H){1|C<3>,1|C<5>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	118.8870	0.092	2	119.1212	0.045	10	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]2Zr)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Zr<12>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]2Zr)(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	119.2973	0.277	6	119.5070	0.122	12	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]2Zr)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Zr<13>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]2Zr)(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	119.7167	0.294	6	119.5070	0.122	12	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]B[5]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ru<9>,1|B<4>,1|C<4>,1|H<1>}	C[6](C[5,6]C[5,6]B[5]Ru)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|N<3>,1|N<4>}	H(C[6]C[6]2)	119.4410	0.014	2	119.4410	0.000	2	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){4|C<4>}	C[6](C[5,6]C[5,6]C[5]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<2>,1|O<2>,3|C<3>}	H(C[6]C[6]2)	119.0880	0.000	1	119.0880	0.000	1	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Co<10>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Co)(C[6]C[6]H)(H){1|C<3>,1|H<1>,3|C<4>}	H(C[6]C[6]2)	119.4323	0.101	6	119.2310	0.050	42	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Co<10>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Co)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.1787	0.314	3	119.2310	0.050	42	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Co<10>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Co)(C[6]C[6]H)(H){1|Si<4>,1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.4688	0.257	4	119.2310	0.050	42	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Co<11>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Co)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.0528	0.120	19	119.2310	0.050	42	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Co<11>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Co)(C[6]C[6]H)(H){1|Si<4>,1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.4790	0.059	2	119.2310	0.050	42	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Co<9>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Co)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.3292	0.071	5	119.2310	0.050	42	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Co<9>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Co)(C[6]C[6]H)(H){1|Si<4>,1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.3630	0.080	3	119.2310	0.050	42	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Cr)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Cr<10>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Cr)(C[6]C[6]H)(H){1|C<3>,1|H<1>,3|C<4>}	H(C[6]C[6]2)	119.3675	0.173	12	119.3652	0.029	26	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Cr)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Cr<10>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Cr)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.3971	0.182	8	119.3652	0.029	26	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Cr)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Cr<8>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Cr)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|P<3>,1|P<4>}	H(C[6]C[6]2)	119.4270	0.000	1	119.3652	0.029	26	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Cr)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Cr<8>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Cr)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|P<3>,2|H<1>}	H(C[6]C[6]2)	119.4960	0.000	1	119.3652	0.029	26	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Cr)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Cr<9>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Cr)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.2325	0.111	2	119.3652	0.029	26	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Cr)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Cr<9>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Cr)(C[6]C[6]H)(H){1|Si<5>,1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.2595	0.247	2	119.3652	0.029	26	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Eu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Eu<12>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Eu)(C[6]C[6]H)(H){1|C<3>,1|H<1>,3|C<4>}	H(C[6]C[6]2)	120.0542	0.618	4	119.5378	0.507	12	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Eu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Eu<12>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Eu)(C[6]C[6]H)(H){1|Si<4>,1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	118.8023	0.499	4	119.5378	0.507	12	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Eu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Eu<13>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Eu)(C[6]C[6]H)(H){1|C<3>,1|H<1>,3|C<4>}	H(C[6]C[6]2)	119.7765	0.347	2	119.5378	0.507	12	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Eu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Eu<13>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Eu)(C[6]C[6]H)(H){1|Si<5>,1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.7370	0.372	2	119.5378	0.507	12	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Fe)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Fe<10>,1|Br<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Fe)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.6960	0.000	1	119.2061	0.071	45	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Fe)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Fe<10>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Fe)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<3>,2|C<4>}	H(C[6]C[6]2)	119.3910	0.000	1	119.2061	0.071	45	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Fe)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Fe<10>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Fe)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<4>,2|C<4>}	H(C[6]C[6]2)	118.9620	0.085	2	119.2061	0.071	45	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Fe)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Fe<10>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Fe)(C[6]C[6]H)(H){1|C<3>,1|H<1>,3|C<4>}	H(C[6]C[6]2)	119.2672	0.203	18	119.2061	0.071	45	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Fe)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Fe<10>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Fe)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.4457	0.320	3	119.2061	0.071	45	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Fe)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Fe<11>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Fe)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.9950	0.279	2	119.2061	0.071	45	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Fe)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Fe<8>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Fe)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>,2|C<4>}	H(C[6]C[6]2)	119.3110	0.000	1	119.2061	0.071	45	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Fe)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Fe<8>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Fe)(C[6]C[6]H)(H){1|C<3>,1|H<1>,3|C<4>}	H(C[6]C[6]2)	119.2125	0.006	2	119.2061	0.071	45	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Fe)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Fe<8>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Fe)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.1107	0.329	12	119.2061	0.071	45	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Fe)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Fe<8>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Fe)(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	119.2790	0.000	1	119.2061	0.071	45	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Fe)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Fe<9>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Fe)(C[6]C[6]H)(H){1|C<3>,1|H<1>,3|C<4>}	H(C[6]C[6]2)	119.3915	0.029	2	119.2061	0.071	45	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Gd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Gd<16>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Gd)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.3978	0.181	4	119.3978	0.033	4	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,2|H<1>}	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	120.2660	0.000	1	119.9010	3.129	3	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){2|C<4>,2|H<1>}	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H){1|N<3>,1|P<4>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	121.4590	0.000	1	119.9010	3.129	3	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){2|C<4>,3|H<1>}	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H){1|C<4>,1|N<3>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	117.9780	0.000	1	119.9010	3.129	3	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Hf)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Hf<11>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Hf)(C[6]C[6]H)(H){1|Si<4>,1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.2300	0.276	7	119.1074	0.209	22	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Hf)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Hf<12>,1|Br<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Hf)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.1810	0.535	2	119.1074	0.209	22	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Hf)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Hf<12>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Hf)(C[6]C[6]H)(H){1|C<3>,1|H<1>,3|C<4>}	H(C[6]C[6]2)	119.0733	0.105	6	119.1074	0.209	22	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Hf)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Hf<12>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Hf)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.1077	0.216	3	119.1074	0.209	22	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Hf)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Hf<13>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Hf)(C[6]C[6]H)(H){1|C<3>,1|C<5>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.5880	1.147	2	119.1074	0.209	22	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Hf)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Hf<13>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Hf)(C[6]C[6]H)(H){1|Si<5>,1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	118.2255	0.207	2	119.1074	0.209	22	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Ho)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ho<14>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Ho)(C[6]C[6]H)(H){1|C<3>,1|H<1>,3|C<4>}	H(C[6]C[6]2)	119.1870	0.000	1	119.2120	0.001	2	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Ho)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ho<14>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Ho)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.2370	0.000	1	119.2120	0.001	2	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Ir)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ir<9>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Ir)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.1890	0.174	4	119.1890	0.030	4	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Li)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Li<7>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Li)(C[6]C[6]H)(H){1|C<3>,1|H<1>,3|C<4>}	H(C[6]C[6]2)	119.4720	0.000	1	119.4040	0.025	5	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Li)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Li<7>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Li)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.2960	0.000	1	119.4040	0.025	5	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Li)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Li<7>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Li)(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|C<5>}	H(C[6]C[6]2)	119.5460	0.000	1	119.4040	0.025	5	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Li)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Li<8>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Li)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.3530	0.243	2	119.4040	0.025	5	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Lu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Lu<16>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Lu)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	120.9800	0.000	1	119.1795	6.484	2	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Lu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Lu<16>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Lu)(C[6]C[6]H)(H){1|Si<5>,1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	117.3790	0.000	1	119.1795	6.484	2	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Mn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Mn<10>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Mn)(C[6]C[6]H)(H){1|C<3>,1|H<1>,3|C<4>}	H(C[6]C[6]2)	119.3512	0.202	12	118.9459	2.131	33	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Mn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Mn<10>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Mn)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.3155	0.006	2	118.9459	2.131	33	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Mn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Mn<10>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Mn)(C[6]C[6]H)(H){1|Si<4>,1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.3831	0.270	8	118.9459	2.131	33	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Mn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Mn<8>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Mn)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<4>,2|C<4>}	H(C[6]C[6]2)	119.0100	0.000	2	118.9459	2.131	33	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Mn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Mn<8>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Mn)(C[6]C[6]H)(H){1|C<3>,1|H<1>,3|C<4>}	H(C[6]C[6]2)	115.0190	0.000	1	118.9459	2.131	33	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Mn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Mn<8>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Mn)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.2831	2.522	8	118.9459	2.131	33	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Mo)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Mo<10>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Mo)(C[6]C[6]H)(H){1|C<3>,1|H<1>,3|C<4>}	H(C[6]C[6]2)	119.1655	0.237	2	118.8035	0.950	57	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Mo)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Mo<10>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Mo)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.3743	1.682	13	118.8035	0.950	57	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Mo)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Mo<10>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Mo)(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	119.0413	0.053	3	118.8035	0.950	57	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Mo)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Mo<11>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Mo)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.9440	0.000	1	118.8035	0.950	57	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Mo)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Mo<11>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Mo)(C[6]C[6]H)(H){1|Mo<9>,1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	118.9740	0.000	1	118.8035	0.950	57	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Mo)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Mo<12>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Mo)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.9004	0.545	25	118.8035	0.950	57	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Mo)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Mo<12>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Mo)(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	119.3298	0.285	4	118.8035	0.950	57	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Mo)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Mo<8>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Mo)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.3130	0.075	2	118.8035	0.950	57	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Mo)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Mo<9>,1|C<3>,1|C<4>,1|H<1>}	C[6](C[5,6]C[5,6]C[5]Mo)(C[6]C[6]H)(H){1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	118.5700	0.000	1	118.8035	0.950	57	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Mo)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Mo<9>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Mo)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.1857	1.231	4	118.8035	0.950	57	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Mo)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Mo<9>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Mo)(C[6]C[6]H)(H){1|C<4>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7890	0.000	1	118.8035	0.950	57	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Nd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Nd<19>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Nd)(C[6]C[6]H)(H){1|C<3>,1|C<5>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.0860	0.000	1	119.0860	0.000	1	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Ni)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ni<7>,1|C<3>,1|C<4>,1|H<1>}	C[6](C[5,6]C[5,6]C[5]Ni)(C[6]C[6]H)(H){1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.3020	0.000	1	119.2954	0.081	25	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Ni)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ni<7>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Ni)(C[6]C[6]H)(H){1|C<3>,1|H<1>,3|C<4>}	H(C[6]C[6]2)	119.3064	0.085	5	119.2954	0.081	25	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Ni)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ni<7>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Ni)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.3132	0.366	14	119.2954	0.081	25	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Ni)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ni<7>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Ni)(C[6]C[6]H)(H){1|C<4>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.1550	0.000	1	119.2954	0.081	25	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Ni)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ni<8>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Ni)(C[6]C[6]H)(H){1|C<3>,1|H<1>,3|C<4>}	H(C[6]C[6]2)	119.3450	0.141	2	119.2954	0.081	25	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Ni)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ni<8>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Ni)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.1610	0.272	2	119.2954	0.081	25	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Os)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Os<8>,1|C<3>,1|C<4>,1|H<1>}	C[6](C[5,6]C[5,6]C[5]Os)(C[6]C[6]H)(H){1|C<3>,1|H<1>,3|C<4>}	H(C[6]C[6]2)	119.5260	0.000	1	119.5260	0.000	1	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Pd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Pd<7>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Pd)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.4051	0.162	8	119.4051	0.026	8	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Re)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Re<8>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Re)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.1397	0.376	10	119.1295	0.117	12	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Re)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Re<8>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Re)(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	119.0785	0.118	2	119.1295	0.117	12	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Rh)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Rh<10>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Rh)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>,2|C<4>}	H(C[6]C[6]2)	119.2370	0.000	1	119.1390	0.237	41	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Rh)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Rh<10>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Rh)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>,2|C<4>}	H(C[6]C[6]2)	119.3395	0.281	2	119.1390	0.237	41	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Rh)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Rh<10>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Rh)(C[6]C[6]H)(H){1|C<3>,1|H<1>,3|C<4>}	H(C[6]C[6]2)	119.4550	0.000	1	119.1390	0.237	41	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Rh)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Rh<10>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Rh)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	117.5990	1.160	2	119.1390	0.237	41	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Rh)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Rh<10>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Rh)(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	118.7605	0.067	2	119.1390	0.237	41	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Rh)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Rh<7>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Rh)(C[6]C[6]H)(H){1|C<3>,1|H<1>,3|C<4>}	H(C[6]C[6]2)	119.1500	0.109	2	119.1390	0.237	41	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Rh)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Rh<7>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Rh)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.3715	0.216	13	119.1390	0.237	41	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Rh)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Rh<8>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Rh)(C[6]C[6]H)(H){1|C<3>,1|H<1>,3|C<4>}	H(C[6]C[6]2)	119.0345	0.467	2	119.1390	0.237	41	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Rh)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Rh<8>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Rh)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.8260	0.092	6	119.1390	0.237	41	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Rh)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Rh<8>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Rh)(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	119.3457	0.185	6	119.1390	0.237	41	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Rh)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Rh<9>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Rh)(C[6]C[6]H)(H){1|C<3>,1|H<1>,3|C<4>}	H(C[6]C[6]2)	119.4780	0.000	1	119.1390	0.237	41	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Rh)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Rh<9>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Rh)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.3013	0.161	3	119.1390	0.237	41	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ru<10>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<3>,2|C<4>}	H(C[6]C[6]2)	119.2340	0.000	1	119.1425	0.171	114	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ru<10>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<4>,2|C<4>}	H(C[6]C[6]2)	119.1430	0.107	2	119.1425	0.171	114	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ru<10>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.2650	0.164	5	119.1425	0.171	114	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ru<11>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>,2|C<4>}	H(C[6]C[6]2)	118.9980	0.096	8	119.1425	0.171	114	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ru<11>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<5>,2|C<4>}	H(C[6]C[6]2)	119.0025	0.631	2	119.1425	0.171	114	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ru<11>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|P<5>,2|C<3>}	H(C[6]C[6]2)	118.6540	0.000	1	119.1425	0.171	114	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ru<7>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|C<5>,2|H<1>}	H(C[6]C[6]2)	119.2685	0.281	12	119.1425	0.171	114	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ru<7>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.2014	0.335	9	119.1425	0.171	114	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ru<7>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]H)(H){1|C<4>,1|C<5>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	118.9906	0.617	14	119.1425	0.171	114	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ru<7>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	118.8766	0.432	5	119.1425	0.171	114	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ru<8>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.2583	0.266	46	119.1425	0.171	114	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ru<8>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	118.6980	0.107	2	119.1425	0.171	114	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ru<8>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]H)(H){1|C<2>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.6100	0.000	1	119.1425	0.171	114	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ru<9>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|N<4>,2|H<1>}	H(C[6]C[6]2)	119.5465	0.100	2	119.1425	0.171	114	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ru<9>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.3793	1.272	3	119.1425	0.171	114	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ru<9>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	119.3490	0.000	1	119.1425	0.171	114	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Sc)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Sc<13>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Sc)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.1125	0.351	2	119.2572	0.044	6	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Sc)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Sc<15>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Sc)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.3295	0.105	4	119.2572	0.044	6	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Sm)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Sm<14>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Sm)(C[6]C[6]H)(H){1|C<3>,1|H<1>,3|C<4>}	H(C[6]C[6]2)	119.9210	0.000	1	118.9715	1.334	10	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Sm)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Sm<14>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Sm)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.7340	0.000	1	118.9715	1.334	10	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Sm)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Sm<16>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Sm)(C[6]C[6]H)(H){1|C<3>,1|H<1>,3|C<4>}	H(C[6]C[6]2)	118.7347	1.508	4	118.9715	1.334	10	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Sm)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Sm<16>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Sm)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.0302	1.154	4	118.9715	1.334	10	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Ti)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ti<11>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Ti)(C[6]C[6]H)(H){1|C<3>,1|H<1>,3|C<4>}	H(C[6]C[6]2)	118.9670	0.000	2	119.1360	0.739	37	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Ti)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ti<11>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Ti)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.9090	0.000	2	119.1360	0.739	37	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Ti)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ti<11>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Ti)(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	119.3795	0.073	4	119.1360	0.739	37	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Ti)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ti<12>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Ti)(C[6]C[6]H)(H){1|C<3>,1|H<1>,3|C<4>}	H(C[6]C[6]2)	119.3227	0.189	6	119.1360	0.739	37	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Ti)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ti<12>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Ti)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.3430	0.233	8	119.1360	0.739	37	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Ti)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ti<13>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Ti)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.3453	0.317	4	119.1360	0.739	37	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Ti)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ti<8>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Ti)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.1156	0.119	5	119.1360	0.739	37	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Ti)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ti<9>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Ti)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>,2|C<4>}	H(C[6]C[6]2)	118.6810	0.000	1	119.1360	0.739	37	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Ti)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ti<9>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Ti)(C[6]C[6]H)(H){1|C<3>,1|H<1>,3|C<4>}	H(C[6]C[6]2)	119.3420	0.765	2	119.1360	0.739	37	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Ti)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ti<9>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Ti)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	116.9345	3.662	2	119.1360	0.739	37	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Ti)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ti<9>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Ti)(C[6]C[6]H)(H){1|Si<5>,1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.8900	0.000	1	119.1360	0.739	37	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Y)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Y<12>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Y)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<3>,2|C<4>}	H(C[6]C[6]2)	118.5170	0.308	2	119.6103	2.614	6	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Y)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Y<12>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Y)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	120.5775	0.179	2	119.6103	2.614	6	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Y)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Y<16>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Y)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	121.8160	0.000	1	119.6103	2.614	6	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Y)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Y<16>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Y)(C[6]C[6]H)(H){1|Si<5>,1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	117.6570	0.000	1	119.6103	2.614	6	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Yb)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Yb<12>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Yb)(C[6]C[6]H)(H){1|B<3>,1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.4638	0.305	4	119.3648	1.082	12	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Yb)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Yb<12>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Yb)(C[6]C[6]H)(H){1|C<3>,1|H<1>,3|C<4>}	H(C[6]C[6]2)	120.0630	2.094	2	119.3648	1.082	12	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Yb)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Yb<12>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Yb)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.0660	1.066	6	119.3648	1.082	12	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Zr<10>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(H){1|C<3>,1|H<1>,3|C<4>}	H(C[6]C[6]2)	119.5680	0.000	1	119.2183	0.531	166	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Zr<10>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.1820	0.088	2	119.2183	0.531	166	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Zr<12>,1|C<3>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.0620	0.000	1	119.2183	0.531	166	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Zr<12>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(H){1|C<3>,1|H<1>,3|C<4>}	H(C[6]C[6]2)	119.1510	0.670	21	119.2183	0.531	166	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Zr<12>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.3282	0.380	41	119.2183	0.531	166	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Zr<12>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	119.6095	0.418	2	119.2183	0.531	166	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Zr<12>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(H){1|Si<4>,1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	118.4866	1.389	12	119.2183	0.531	166	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Zr<13>,1|C<3>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(H){1|Si<5>,1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.2525	0.094	2	119.2183	0.531	166	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Zr<13>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(H){1|C<3>,1|C<5>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	118.9221	0.139	8	119.2183	0.531	166	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Zr<13>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(H){1|C<3>,1|H<1>,3|C<4>}	H(C[6]C[6]2)	120.0507	1.130	10	119.2183	0.531	166	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Zr<13>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.2486	0.207	28	119.2183	0.531	166	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Zr<13>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	119.2115	0.151	4	119.2183	0.531	166	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Zr<13>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(H){1|Si<4>,1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	118.4930	0.426	2	119.2183	0.531	166	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Zr<13>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(H){1|Si<5>,1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.1585	0.111	4	119.2183	0.531	166	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Zr<13>,1|N<3>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(H){1|Si<5>,1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.1050	0.000	1	119.2183	0.531	166	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Zr<13>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(H){1|Si<4>,1|C<2>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	116.1850	0.000	1	119.2183	0.531	166	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Zr<14>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(H){1|C<3>,1|H<1>,3|C<4>}	H(C[6]C[6]2)	119.5888	0.784	4	119.2183	0.531	166	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Zr<14>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.3734	0.551	8	119.2183	0.531	166	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Zr<14>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(H){1|Si<5>,1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.9005	0.009	2	119.2183	0.531	166	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Zr<15>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(H){1|C<3>,1|H<1>,3|C<4>}	H(C[6]C[6]2)	118.7827	1.276	4	119.2183	0.531	166	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Zr<9>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.2720	0.487	8	119.2183	0.531	166	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]N[5]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<4>}	C[6](C[5,6]C[5,6]N[5]C)(C[6]C[6]H)(H){1|S<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.5570	0.000	1	120.5570	0.000	1	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]N[5]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[5,6]C[5,6]N[5]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,4|C<3>}	H(C[6]C[6]2)	119.5800	0.000	1	119.5800	0.000	1	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]O[5]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|O<2>}	C[6](C[5,6]C[5,6]O[5]C)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<2>,2|H<1>}	H(C[6]C[6]2)	119.0370	0.000	1	119.0370	0.000	1	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]O[5]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<4>,1|O<2>,2|H<1>}	C[6](C[5,6]C[5,6]O[5]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<2>,2|C<3>}	H(C[6]C[6]2)	119.1830	0.000	1	119.1830	0.000	1	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]P[5]Fe)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Fe<10>,1|C<4>,1|H<1>,1|P<3>}	C[6](C[5,6]C[5,6]P[5]Fe)(C[6]C[6]H)(H){1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.4050	0.000	1	119.4050	0.000	1	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]P[5]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<4>,1|P<4>,2|H<1>}	C[6](C[5,6]C[5,6]P[5]H)(C[6]C[6]H)(H){1|C<4>,1|N<3>,1|O<1>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	121.3490	0.000	1	121.3490	0.000	1	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]P[5]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ru<11>,1|C<4>,1|H<1>,1|P<5>}	C[6](C[5,6]C[5,6]P[5]Ru)(C[6]C[6]H)(H){1|H<1>,2|C<4>,3|C<3>}	H(C[6]C[6]2)	119.3200	0.434	3	119.3200	0.189	3	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6a]C[5]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,2|C<3>}	C[6](C[5,6]C[5,6a]C[5]C[6])(C[6]C[6]H)(H){1|C<4>,3|H<1>,4|C<3>}	H(C[6]C[6]2)	118.9100	0.000	1	118.9100	0.000	1	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5]2C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<4>,3|C<3>}	C[6](C[5,6]C[5]2C[6])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|O<1>,4|C<3>}	H(C[6]C[6]2)	119.2100	0.000	1	120.0110	0.462	4	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5]2C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|H<1>,3|C<3>}	C[6](C[5,6]C[5]2C[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<1>,4|C<3>}	H(C[6]C[6]2)	120.8710	0.000	1	120.0110	0.462	4	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5]2C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|H<1>,3|C<3>}	C[6](C[5,6]C[5]2C[6])(C[6]C[6]H)(H){1|H<1>,1|N<2>,5|C<3>}	H(C[6]C[6]2)	119.9815	0.060	2	120.0110	0.462	4	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5]C[6]N[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[5,6]C[5]C[6]N[5])(C[6]C[6]H)(H){1|C<4>,1|O<2>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.0960	0.000	1	119.2257	0.071	10	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5]C[6]N[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>}	C[6](C[5,6]C[5]C[6]N[5])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<1>,4|C<3>}	H(C[6]C[6]2)	118.8290	0.102	2	119.2257	0.071	10	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5]C[6]N[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>}	C[6](C[5,6]C[5]C[6]N[5])(C[6]C[6]H)(H){1|C<4>,1|O<1>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.4970	0.041	3	119.2257	0.071	10	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]C[5]C[6]N[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>}	C[6](C[5,6]C[5]C[6]N[5])(C[6]C[6]H)(H){1|H<1>,1|O<1>,2|C<4>,3|C<3>}	H(C[6]C[6]2)	119.2530	0.149	4	119.2257	0.071	10	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]N[5,6]C[6a]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>}	C[6](C[5,6]N[5,6]C[6a]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|O<1>,4|C<3>}	H(C[6]C[6]2)	119.3910	0.000	1	119.3910	0.000	1	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]Si[5,5]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Si<4>,1|C<3>,2|H<1>}	C[6](C[5,6]Si[5,5]C[5,6]H)(C[6]C[6]H)(H){1|H<1>,1|O<2>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	119.1830	0.000	1	119.1830	0.000	1	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[5,6]Si[5,6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Si<4>,1|C<3>,2|H<1>}	C[6](C[5,6]Si[5,6]C[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>,3|N<3>}	H(C[6]C[6]2)	119.1690	0.000	1	119.1690	0.000	1	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]N)(H)	C[6](C[5,6]C[5,6a]C[5]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]N)(H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[5,6]C[5,6a]C[5]C[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<2>,1|N<3>,1|O<1>,1|S<2>,2|C<3>}	H(C[6]C[6]2)	118.5650	0.000	1	118.5650	0.000	1	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	C[6](C[5,6]C[5,5a]C[6]N[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|H<1>,1|N<3>,2|C<3>}	C[6](C[5,6]C[5,5a]C[6]N[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>,1|O<2>,3|C<3>}	H(C[6]C[6]2)	119.1160	0.041	2	119.1160	0.002	2	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	C[6](C[5,6]C[5,6]C[5]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,3|C<4>}	C[6](C[5,6]C[5,6]C[5]C)(C[6]C[6]H)(H){1|O<1>,1|O<2>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	118.4230	0.000	1	118.4230	0.000	1	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	C[6](C[5,6]C[5,6]C[5]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]C[6])(C[6]C[6]H)(H){1|N<3>,1|O<1>,3|H<1>,4|C<3>}	H(C[6]C[6]2)	119.2173	0.246	3	119.2173	0.061	3	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	C[6](C[5,6]C[5,6]C[5]O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[5,6]C[5,6]C[5]O)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<1>,1|O<2>,3|H<1>}	H(C[6]C[6]2)	118.9290	0.000	1	118.9940	0.022	3	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	C[6](C[5,6]C[5,6]C[5]O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[5,6]C[5,6]C[5]O)(C[6]C[6]H)(H){1|C<4>,1|O<1>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	119.1640	0.000	1	118.9940	0.022	3	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	C[6](C[5,6]C[5,6]C[5]O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[5,6]C[5,6]C[5]O)(C[6]C[6]H)(H){1|N<3>,1|O<1>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	118.8890	0.000	1	118.9940	0.022	3	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	C[6](C[5,6]C[5,6]C[6]N[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[5,6]C[5,6]C[6]N[5])(C[6]C[6]H)(H){1|O<1>,1|O<2>,2|C<4>,4|C<3>}	H(C[6]C[6]2)	119.3880	0.185	2	119.3880	0.034	2	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	C[6](C[5,6]C[5,6]C[6a]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[5,6]C[5,6]C[6a]C[5])(C[6]C[6]H)(H){1|N<3>,1|O<1>,2|C<3>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	120.8350	0.000	1	120.8350	0.000	1	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	C[6](C[5,6]C[5,6]C[6a]N[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|N<3>,2|H<1>}	C[6](C[5,6]C[5,6]C[6a]N[5])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<1>,1|S<4>,4|C<3>}	H(C[6]C[6]2)	118.8092	0.179	4	118.8218	0.025	5	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	C[6](C[5,6]C[5,6]C[6a]N[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|N<3>,2|H<1>}	C[6](C[5,6]C[5,6]C[6a]N[5])(C[6]C[6]H)(H){1|H<1>,1|O<1>,1|S<4>,2|C<4>,3|C<3>}	H(C[6]C[6]2)	118.8720	0.000	1	118.8218	0.025	5	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	C[6](C[5,6]C[5,6]N[5]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|N<3>,2|C<4>,2|H<1>}	C[6](C[5,6]C[5,6]N[5]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>,1|S<4>,2|C<4>}	H(C[6]C[6]2)	118.4980	0.000	1	118.9431	0.099	7	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	C[6](C[5,6]C[5,6]N[5]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|N<3>,2|C<4>,2|H<1>}	C[6](C[5,6]C[5,6]N[5]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<1>,1|S<4>,2|C<3>}	H(C[6]C[6]2)	119.4610	0.000	1	118.9431	0.099	7	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	C[6](C[5,6]C[5,6]N[5]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|N<3>,2|C<4>,2|H<1>}	C[6](C[5,6]C[5,6]N[5]C)(C[6]C[6]H)(H){1|H<1>,1|O<1>,1|S<4>,3|C<4>}	H(C[6]C[6]2)	118.9286	0.177	5	118.9431	0.099	7	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	C[6](C[5,6]C[5,6]O[5]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|Br<1>,1|H<1>,1|O<2>,2|C<4>}	C[6](C[5,6]C[5,6]O[5]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>,2|C<4>}	H(C[6]C[6]2)	118.8025	0.391	2	119.0092	0.584	25	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	C[6](C[5,6]C[5,6]O[5]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|Cl<1>,1|H<1>,1|O<2>,2|C<4>}	C[6](C[5,6]C[5,6]O[5]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>,2|C<4>}	H(C[6]C[6]2)	118.9440	0.283	5	119.0092	0.584	25	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	C[6](C[5,6]C[5,6]O[5]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|H<1>,1|O<2>,2|C<4>}	C[6](C[5,6]C[5,6]O[5]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<1>,2|C<3>}	H(C[6]C[6]2)	118.9090	0.000	1	119.0092	0.584	25	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	C[6](C[5,6]C[5,6]O[5]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[5,6]C[5,6]O[5]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>,2|C<4>}	H(C[6]C[6]2)	118.7792	0.302	10	119.0092	0.584	25	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	C[6](C[5,6]C[5,6]O[5]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[5,6]C[5,6]O[5]C)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>,2|C<4>}	H(C[6]C[6]2)	118.6430	0.000	1	119.0092	0.584	25	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	C[6](C[5,6]C[5,6]O[5]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[5,6]C[5,6]O[5]C)(C[6]C[6]H)(H){1|H<1>,1|O<1>,1|O<2>,2|C<4>}	H(C[6]C[6]2)	120.6030	2.602	2	119.0092	0.584	25	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	C[6](C[5,6]C[5,6]O[5]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[5,6]C[5,6]O[5]C)(C[6]C[6]H)(H){1|H<1>,1|O<1>,3|C<4>}	H(C[6]C[6]2)	119.0885	0.145	4	119.0092	0.584	25	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	C[6](C[5,6]C[5,6a]C[5,6]O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|O<2>,2|H<1>}	C[6](C[5,6]C[5,6a]C[5,6]O)(C[6]C[6]H)(H){1|H<1>,1|O<1>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	119.1090	0.000	1	119.1090	0.000	1	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	C[6](C[5,6]C[5,6a]C[5]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|H<1>,3|C<3>}	C[6](C[5,6]C[5,6a]C[5]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>,4|C<3>}	H(C[6]C[6]2)	119.1762	0.338	10	119.1525	0.099	12	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	C[6](C[5,6]C[5,6a]C[5]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|H<1>,3|C<3>}	C[6](C[5,6]C[5,6a]C[5]C[6])(C[6]C[6]H)(H){1|H<1>,1|O<1>,5|C<3>}	H(C[6]C[6]2)	119.0340	0.177	2	119.1525	0.099	12	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	C[6](C[5,6]C[5,6a]C[6]O[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|H<1>,1|O<2>,2|C<3>}	C[6](C[5,6]C[5,6a]C[6]O[5])(C[6]C[6]H)(H){1|H<1>,1|O<1>,4|C<3>}	H(C[6]C[6]2)	119.0722	0.254	4	119.0722	0.064	4	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	C[6](C[5,6]C[5]2C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[5,6]C[5]2C[6])(C[6]C[6]H)(H){1|O<1>,1|O<2>,2|C<3>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	119.0920	0.000	1	119.7531	1.041	13	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	C[6](C[5,6]C[5]2C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|C<4>,1|H<1>,2|C<3>}	C[6](C[5,6]C[5]2C[6])(C[6]C[6]H)(H){1|C<4>,1|O<1>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.2573	0.241	6	119.7531	1.041	13	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	C[6](C[5,6]C[5]2C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|C<4>,1|H<1>,2|C<3>}	C[6](C[5,6]C[5]2C[6])(C[6]C[6]H)(H){1|N<3>,1|O<1>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.4560	0.082	2	119.7531	1.041	13	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	C[6](C[5,6]C[5]2C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|C<4>,1|H<1>,2|C<3>}	C[6](C[5,6]C[5]2C[6])(C[6]C[6]H)(H){1|O<1>,3|H<1>,4|C<3>}	H(C[6]C[6]2)	121.9915	0.054	2	119.7531	1.041	13	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	C[6](C[5,6]C[5]2C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|H<1>,3|C<3>}	C[6](C[5,6]C[5]2C[6])(C[6]C[6]H)(H){1|C<4>,1|O<1>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.4740	0.000	1	119.7531	1.041	13	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	C[6](C[5,6]C[5]2C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|H<1>,3|C<3>}	C[6](C[5,6]C[5]2C[6])(C[6]C[6]H)(H){1|N<3>,1|O<1>,1|O<2>,4|C<3>}	H(C[6]C[6]2)	119.7850	0.000	1	119.7531	1.041	13	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	C[6](C[5,6]C[5]C[6]N[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[5,6]C[5]C[6]N[5])(C[6]C[6]H)(H){1|C<4>,2|C<3>,2|O<1>,3|H<1>}	H(C[6]C[6]2)	119.2215	0.115	2	119.1219	0.039	22	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	C[6](C[5,6]C[5]C[6]N[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[5,6]C[5]C[6]N[5])(C[6]C[6]H)(H){1|O<1>,2|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.1252	0.243	4	119.1219	0.039	22	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	C[6](C[5,6]C[5]C[6]N[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|H<1>,1|N<2>,2|C<3>}	C[6](C[5,6]C[5]C[6]N[5])(C[6]C[6]H)(H){1|C<4>,1|N<3>,2|C<3>,2|O<1>}	H(C[6]C[6]2)	119.3150	0.000	1	119.1219	0.039	22	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	C[6](C[5,6]C[5]C[6]N[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|H<1>,1|N<2>,2|C<3>}	C[6](C[5,6]C[5]C[6]N[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>,2|O<1>}	H(C[6]C[6]2)	119.1445	0.139	2	119.1219	0.039	22	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	C[6](C[5,6]C[5]C[6]N[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|H<1>,1|N<2>,2|C<3>}	C[6](C[5,6]C[5]C[6]N[5])(C[6]C[6]H)(H){1|H<1>,1|O<1>,4|C<3>}	H(C[6]C[6]2)	119.1360	0.228	2	119.1219	0.039	22	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	C[6](C[5,6]C[5]C[6]N[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|H<1>,1|N<3>,2|C<3>}	C[6](C[5,6]C[5]C[6]N[5])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<1>,4|C<3>}	H(C[6]C[6]2)	119.1133	0.193	10	119.1219	0.039	22	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	C[6](C[5,6]C[5]C[6]N[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|H<1>,1|N<3>,2|C<3>}	C[6](C[5,6]C[5]C[6]N[5])(C[6]C[6]H)(H){1|Cl<1>,1|C<4>,1|O<1>,4|C<3>}	H(C[6]C[6]2)	118.7280	0.000	1	119.1219	0.039	22	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	C[6](C[5,6]C[5]C[6]O[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|H<1>,1|O<2>}	C[6](C[5,6]C[5]C[6]O[5])(C[6]C[6]H)(H){1|C<3>,1|O<1>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	119.5618	0.375	4	119.4930	0.489	17	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	C[6](C[5,6]C[5]C[6]O[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|H<1>,1|O<2>}	C[6](C[5,6]C[5]C[6]O[5])(C[6]C[6]H)(H){1|C<3>,1|O<1>,2|H<1>,3|C<4>}	H(C[6]C[6]2)	121.0300	0.762	2	119.4930	0.489	17	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	C[6](C[5,6]C[5]C[6]O[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|H<1>,1|O<2>}	C[6](C[5,6]C[5]C[6]O[5])(C[6]C[6]H)(H){1|H<1>,1|O<1>,2|C<4>,3|C<3>}	H(C[6]C[6]2)	119.3540	0.813	2	119.4930	0.489	17	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	C[6](C[5,6]C[5]C[6]O[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|H<1>,1|O<2>}	C[6](C[5,6]C[5]C[6]O[5])(C[6]C[6]H)(H){1|O<1>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.1605	0.260	2	119.4930	0.489	17	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	C[6](C[5,6]C[5]C[6]O[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|H<1>,1|O<2>,2|C<3>}	C[6](C[5,6]C[5]C[6]O[5])(C[6]C[6]H)(H){1|H<1>,1|O<1>,4|C<3>}	H(C[6]C[6]2)	119.2207	0.091	6	119.4930	0.489	17	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	C[6](C[5,6]C[5]C[6]O[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[5,6]C[5]C[6]O[5])(C[6]C[6]H)(H){1|C<3>,1|O<1>,3|C<4>,3|H<1>}	H(C[6]C[6]2)	118.7210	0.000	1	119.4930	0.489	17	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	C[6](C[5,6]C[6]N[5]2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[5,6]C[6]N[5]2)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<1>,3|C<3>}	H(C[6]C[6]2)	119.1638	0.085	6	119.1638	0.007	6	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	C[6](C[5,6]C[6]N[5]O[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>,1|O<2>}	C[6](C[5,6]C[6]N[5]O[5])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>,1|S<4>,2|C<4>}	H(C[6]C[6]2)	118.9885	0.269	2	119.0530	0.033	4	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	C[6](C[5,6]C[6]N[5]O[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>,1|O<2>}	C[6](C[5,6]C[6]N[5]O[5])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<1>,3|C<3>}	H(C[6]C[6]2)	119.1175	0.100	2	119.0530	0.033	4	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	C[6](C[5,6]N[5,6]C[5]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|H<1>,1|N<3>,2|C<3>}	C[6](C[5,6]N[5,6]C[5]C[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<1>,4|C<3>}	H(C[6]C[6]2)	119.3572	0.129	4	119.3572	0.017	4	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Ru<10>,1|Pt<4>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]H)(H){1|N<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.0035	0.400	4	119.4712	0.334	8	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Ru<10>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]H)(H){1|N<2>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.9390	0.190	4	119.4712	0.334	8	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	C[6](C[5,6]C[5,6]N[5]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[5,6]C[5,6]N[5]H)(C[6]C[6]H)(H){1|C<3>,1|N<2>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.6960	0.000	1	119.6960	0.000	1	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]N[6]S)(H)	C[6](C[5,6]C[5,6]N[5]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]N[6]S)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[5,6]C[5,6]N[5]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>,1|S<2>,2|C<4>}	H(C[6]C[6]2)	120.1735	0.411	2	120.1735	0.169	2	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]O[6]O)(H)	C[6](C[5,6]C[5,6]C[5]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]O[6]O)(H){1|C<3>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]C)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<1>,2|H<1>,2|O<2>}	H(C[6]C[6]2)	118.6525	0.032	2	119.1597	0.772	3	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]O[6]O)(H)	C[6](C[5,6]C[5,6]C[5]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]O[6]O)(H){3|C<4>}	C[6](C[5,6]C[5,6]C[5]C)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<1>,1|O<2>,3|H<1>}	H(C[6]C[6]2)	120.1740	0.000	1	119.1597	0.772	3	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]O[6]O)(H)	C[6](C[5,6]C[5,6]O[5]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]O[6]O)(H){1|C<4>,1|H<1>,1|O<2>}	C[6](C[5,6]C[5,6]O[5]H)(C[6]C[6]H)(H){1|H<1>,1|O<1>,1|O<2>,2|C<4>}	H(C[6]C[6]2)	119.1835	0.021	2	119.1835	0.000	2	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]C[6])(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,6]C[6,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]C[6])(C[6]C[5,6]H)(H){1|C<4>,1|H<1>,5|C<3>}	C[6](C[5,6]C[5,6]C[6,6]C[5])(C[6]C[6]H)(H){1|C<2>,1|C<4>,1|N<3>,1|O<1>,4|C<3>}	H(C[6]C[6]2)	128.3040	0.000	1	128.3040	0.000	1	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,6a]2C[6,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]C[5,6]H)(H){4|C<3>}	C[6](C[5,6]C[5,6a]2C[6,6a])(C[6]C[6]H)(H){7|C<3>}	H(C[6]C[6]2)	118.4620	0.000	1	118.4620	0.000	1	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,6a]2C[6,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[5,6]H)(H){4|C<3>}	C[6](C[5,6]C[5,6a]2C[6,6a])(C[6]C[6]H)(H){1|O<1>,6|C<3>}	H(C[6]C[6]2)	119.5390	0.000	1	119.5390	0.000	1	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,6a]C[6,6a]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[5,6]H)(H){1|C<4>,3|C<3>}	C[6](C[5,6]C[5,6a]C[6,6a]C[5])(C[6]C[6]H)(H){1|H<1>,1|O<1>,6|C<3>}	H(C[6]C[6]2)	118.6090	0.013	2	118.6757	0.013	3	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,6a]C[6,6a]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[5,6]H)(H){4|C<3>}	C[6](C[5,6]C[5,6a]C[6,6a]C[5])(C[6]C[6]H)(H){1|O<1>,6|C<3>}	H(C[6]C[6]2)	118.8090	0.000	1	118.6757	0.013	3	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,6a]C[6,6a]N[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[5,6]H)(H){1|N<2>,3|C<3>}	C[6](C[5,6]C[5,6a]C[6,6a]N[5])(C[6]C[6]H)(H){1|O<1>,5|C<3>}	H(C[6]C[6]2)	118.9570	0.087	4	118.9570	0.007	4	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[5,6]H)(H)	C[6](C[5,6]C[6,6a]C[5]N[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[5,6]H)(H){1|C<4>,1|N<3>,2|C<3>}	C[6](C[5,6]C[6,6a]C[5]N[5])(C[6]C[6]H)(H){1|N<3>,1|O<1>,2|C<4>,4|C<3>}	H(C[6]C[6]2)	118.7505	0.397	2	118.7505	0.157	2	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[5,6]H)(H){1|Ru<10>,1|Co<4>,2|C<3>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>,2|C<4>}	H(C[6]C[6]2)	118.6805	0.428	4	119.0481	0.162	14	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[5,6]H)(H){1|Ru<10>,1|Cu<2>,2|C<3>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>,2|C<4>}	H(C[6]C[6]2)	119.2935	0.255	2	119.0481	0.162	14	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[5,6]H)(H){1|Ru<10>,1|Fe<4>,2|C<3>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>,2|C<4>}	H(C[6]C[6]2)	118.6765	0.135	2	119.0481	0.162	14	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[5,6]H)(H){1|Ru<10>,2|C<3>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>,2|C<4>}	H(C[6]C[6]2)	119.3352	0.086	6	119.0481	0.162	14	119.1847	0.608	1020	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,3x6]H)(C[6]C[5,6]O)(H)	C[6](C[5,6]C[5,3x6]C[5]H)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,3x6]H)(C[6]C[5,6]O)(H){1|H<1>,1|N<3>,3|C<4>}	C[6](C[5,6]C[5,3x6]C[5]H)(C[6]C[6]H)(O){3|H<1>,4|C<4>}	H(C[6]C[6]2)	119.1220	0.000	1	119.1220	0.000	1	118.9095	1.151	68	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[5,6]O)(H)	C[6](C[5,6]C[5,5,6]C[5]O)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[5,6]O)(H){1|H<1>,1|O<2>,3|C<4>}	C[6](C[5,6]C[5,5,6]C[5]O)(C[6]C[6]H)(O){2|H<1>,2|O<2>,3|C<4>}	H(C[6]C[6]2)	119.3680	0.000	1	119.3680	0.000	1	118.9095	1.151	68	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[5,6]O)(H)	C[6](C[5,6]C[5,5]O[5,6]H)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[5,6]O)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[5,6]C[5,5]O[5,6]H)(C[6]C[6]H)(O){1|H<1>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	120.1960	0.000	1	120.1960	0.000	1	118.9095	1.151	68	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[5,6]O)(H)	C[6](C[5,6]C[5,6]C[5]C[6])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[5,6]O)(H){1|C<3>,1|H<1>,3|C<4>}	C[6](C[5,6]C[5,6]C[5]C[6])(C[6]C[6]H)(O){2|C<3>,3|C<4>,4|H<1>}	H(C[6]C[6]2)	119.4290	0.000	1	119.4290	0.000	1	118.9095	1.151	68	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6]C[6])(C[6]C[5,6]O)(H)	C[6](C[5,6]O[5,6]C[5]H)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C[6])(C[6]C[5,6]O)(H){1|O<2>,3|H<1>,4|C<4>}	C[6](C[5,6]O[5,6]C[5]H)(C[6]C[6]H)(O){2|H<1>,3|C<4>}	H(C[6]C[6]2)	120.0370	0.000	1	120.0370	0.000	1	118.9095	1.151	68	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6]C[6a])(C[6]C[5,6]O)(H)	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C[6a])(C[6]C[5,6]O)(H){2|C<4>,2|H<1>,3|C<3>}	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(O){1|C<3>,1|O<1>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	117.9290	0.000	1	117.9290	0.000	1	118.9095	1.151	68	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[5,6]O)(H)	C[6](C[5,6]C[5,5,6]C[5,6]H)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[5,6]O)(H){1|H<1>,1|O<2>,3|C<4>}	C[6](C[5,6]C[5,5,6]C[5,6]H)(C[6]C[6]H)(O){1|C<3>,1|O<2>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	118.6010	0.000	1	118.6010	0.000	1	118.9095	1.151	68	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[5,6]O)(H)	C[6](C[5,6]C[5,5,6]C[5]H)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[5,6]O)(H){1|H<1>,1|N<3>,3|C<4>}	C[6](C[5,6]C[5,5,6]C[5]H)(C[6]C[6]H)(O){1|C<3>,2|C<4>,4|H<1>}	H(C[6]C[6]2)	118.5010	0.000	1	118.5010	0.000	1	118.9095	1.151	68	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[5,6]O)(H)	C[6](C[5,6]C[5,5,6]O[5]H)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[5,6]O)(H){1|H<1>,1|N<3>,1|O<2>,2|C<4>}	C[6](C[5,6]C[5,5,6]O[5]H)(C[6]C[6]H)(O){1|C<3>,1|C<4>,1|N<2>,2|H<1>}	H(C[6]C[6]2)	118.6410	0.000	1	118.6410	0.000	1	118.9095	1.151	68	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[5,6]O)(H)	C[6](C[5,6]C[5,5]C[5,6]C)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[5,6]O)(H){5|C<4>}	C[6](C[5,6]C[5,5]C[5,6]C)(C[6]C[6]H)(O){1|C<3>,1|O<2>,2|H<1>,3|C<4>}	H(C[6]C[6]2)	119.9090	0.098	2	119.9090	0.010	2	118.9095	1.151	68	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[5,6]O)(H)	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[5,6]O)(H){1|C<3>,1|H<1>,1|O<2>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(O){1|C<3>,1|N<3>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	119.1140	0.000	1	119.1140	0.000	1	118.9095	1.151	68	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[5,6]O)(H)	C[6](C[5,6]O[5,6]C[5]H)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[5,6]O)(H){1|C<4>,1|H<1>,1|O<2>,2|C<3>}	C[6](C[5,6]O[5,6]C[5]H)(C[6]C[6]H)(O){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	122.2950	0.000	1	122.2950	0.000	1	118.9095	1.151	68	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[5,6]O)(H)	C[6](C[5,6]O[5,6]C[5]N)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[5,6]O)(H){1|C<2>,1|N<3>,1|O<2>,2|C<4>}	C[6](C[5,6]O[5,6]C[5]N)(C[6]C[6]H)(O){2|C<4>,3|H<1>}	H(C[6]C[6]2)	120.0825	0.142	2	120.0825	0.020	2	118.9095	1.151	68	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6]O)(C[6]C[6,6]H)(H)	C[6](C[5,6]C[5,6,6]C[5,6a]C)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]O)(C[6]C[6,6]H)(H){1|C<3>,2|C<4>,2|O<2>}	C[6](C[5,6]C[5,6,6]C[5,6a]C)(C[6]C[6]H)(O){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	118.3500	0.000	1	118.3500	0.000	1	118.9095	1.151	68	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6]O)(C[6]C[6,6]H)(H)	C[6](C[5,6]C[5,6,6]O[5]O)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]O)(C[6]C[6,6]H)(H){1|C<3>,1|C<4>,2|O<2>}	C[6](C[5,6]C[5,6,6]O[5]O)(C[6]C[6]H)(O){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.0810	0.000	1	119.0810	0.000	1	118.9095	1.151	68	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6]O)(C[6]C[6]C)(H)	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]O)(C[6]C[6]C)(H){1|C<3>,1|C<4>,1|H<1>,2|O<2>}	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(O){1|C<3>,1|H<1>,1|N<2>,1|O<2>,2|C<4>}	H(C[6]C[6]2)	117.8800	0.000	1	118.1155	0.111	2	118.9095	1.151	68	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6]O)(C[6]C[6]C)(H)	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]O)(C[6]C[6]C)(H){2|C<4>,3|H<1>}	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(O){1|C<3>,1|H<1>,2|O<2>,3|C<4>}	H(C[6]C[6]2)	118.3510	0.000	1	118.1155	0.111	2	118.9095	1.151	68	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6]O)(C[6]C[6]C)(H)	C[6](C[5,6]C[5,6]C[5]O[5])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]O)(C[6]C[6]C)(H){1|O<1>,1|O<2>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]O[5])(C[6]C[6]H)(O){1|O<2>,2|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	118.1740	0.000	1	118.1740	0.000	1	118.9095	1.151	68	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6]O)(C[6]C[6]C)(H)	C[6](C[5,6]C[5,6]C[6a]C[5])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]O)(C[6]C[6]C)(H){1|C<4>,3|C<3>}	C[6](C[5,6]C[5,6]C[6a]C[5])(C[6]C[6]H)(O){1|O<2>,2|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	118.6710	0.088	2	118.6710	0.008	2	118.9095	1.151	68	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6]O)(C[6]C[6]C)(H)	C[6](C[5,6]C[5,6]O[5]C)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]O)(C[6]C[6]C)(H){1|Cl<1>,1|H<1>,1|O<2>,2|C<4>}	C[6](C[5,6]C[5,6]O[5]C)(C[6]C[6]H)(O){1|C<3>,1|N<2>,3|C<4>}	H(C[6]C[6]2)	118.4700	0.000	1	118.4700	0.000	1	118.9095	1.151	68	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6]O)(C[6]C[6]C)(H)	C[6](C[5,6]C[5,6]O[5]H)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]O)(C[6]C[6]C)(H){1|C<4>,1|H<1>,3|O<2>}	C[6](C[5,6]C[5,6]O[5]H)(C[6]C[6]H)(O){1|C<3>,1|H<1>,1|N<2>,2|C<4>}	H(C[6]C[6]2)	119.4680	0.000	1	119.4680	0.000	1	118.9095	1.151	68	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6]O)(C[6]C[6]C)(H)	C[6](C[5,6]C[5,6a]C[5]C[6])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]O)(C[6]C[6]C)(H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[5,6]C[5,6a]C[5]C[6])(C[6]C[6]H)(O){1|H<1>,1|N<3>,1|O<1>,2|C<4>,3|C<3>}	H(C[6]C[6]2)	117.9980	0.000	1	117.9980	0.000	1	118.9095	1.151	68	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6]O)(C[6]C[6]C)(H)	C[6](C[5,6]C[5]C[6]O[5])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]O)(C[6]C[6]C)(H){1|O<1>,1|O<2>,2|C<4>}	C[6](C[5,6]C[5]C[6]O[5])(C[6]C[6]H)(O){2|C<3>,3|C<4>,3|H<1>}	H(C[6]C[6]2)	115.6695	1.757	2	115.6695	3.088	2	118.9095	1.151	68	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6]O)(C[6]C[6]Cl)(H)	C[6](C[5,6]C[5,6a]C[5]C[6])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]O)(C[6]C[6]Cl)(H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[5,6]C[5,6a]C[5]C[6])(C[6]C[6]H)(O){1|Cl<1>,1|C<4>,1|H<1>,1|N<3>,1|O<1>,3|C<3>}	H(C[6]C[6]2)	119.1170	0.000	1	119.1170	0.000	1	118.9095	1.151	68	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6]O)(C[6]C[6]Cl)(H)	C[6](C[5,6]C[5]2C[6])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]O)(C[6]C[6]Cl)(H){1|H<1>,3|C<3>}	C[6](C[5,6]C[5]2C[6])(C[6]C[6]H)(O){1|Cl<1>,1|C<4>,1|H<1>,4|C<3>}	H(C[6]C[6]2)	116.9340	0.000	1	116.9340	0.000	1	118.9095	1.151	68	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6]O)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,5,6]C[5]C)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]O)(C[6]C[6]H)(H){1|H<1>,4|C<4>}	C[6](C[5,6]C[5,5,6]C[5]C)(C[6]C[6]H)(O){3|H<1>,4|C<4>}	H(C[6]C[6]2)	118.9270	0.066	2	118.9270	0.004	2	118.9095	1.151	68	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6]O)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]O)(C[6]C[6]H)(H){1|C<3>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(O){1|C<3>,3|C<4>,3|H<1>}	H(C[6]C[6]2)	118.8955	0.040	2	119.0210	0.056	4	118.9095	1.151	68	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6]O)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]O)(C[6]C[6]H)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(O){1|N<3>,2|C<4>,4|H<1>}	H(C[6]C[6]2)	119.1465	0.322	2	119.0210	0.056	4	118.9095	1.151	68	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6]O)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6a]N[5,6a]C[6])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]O)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>,1|O<1>}	C[6](C[5,6]C[5,6a]N[5,6a]C[6])(C[6]C[6]H)(O){3|H<1>,5|C<3>}	H(C[6]C[6]2)	118.1920	0.000	1	118.1920	0.000	1	118.9095	1.151	68	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6]O)(C[6]C[6]H)(H)	C[6](C[5,6]C[5]2C[6])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]O)(C[6]C[6]H)(H){1|H<1>,3|C<3>}	C[6](C[5,6]C[5]2C[6])(C[6]C[6]H)(O){1|C<4>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	115.8700	0.000	1	115.8700	0.000	1	118.9095	1.151	68	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6]O)(C[6]C[6]H)(H)	C[6](C[5,6]C[5]C[6]N[5])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]O)(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>}	C[6](C[5,6]C[5]C[6]N[5])(C[6]C[6]H)(O){1|C<4>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.9395	0.398	2	119.4616	0.136	9	118.9095	1.151	68	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6]O)(C[6]C[6]H)(H)	C[6](C[5,6]C[5]C[6]N[5])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]O)(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>}	C[6](C[5,6]C[5]C[6]N[5])(C[6]C[6]H)(O){1|C<4>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.5690	0.058	3	119.4616	0.136	9	118.9095	1.151	68	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6]O)(C[6]C[6]H)(H)	C[6](C[5,6]C[5]C[6]N[5])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]O)(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>}	C[6](C[5,6]C[5]C[6]N[5])(C[6]C[6]H)(O){2|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.1420	0.081	4	119.4616	0.136	9	118.9095	1.151	68	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6]O)(C[6]C[6]O)(H)	C[6](C[5,6]C[5,6]C[5]C)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]O)(C[6]C[6]O)(H){2|H<1>,3|C<4>}	C[6](C[5,6]C[5,6]C[5]C)(C[6]C[6]H)(O){2|H<1>,2|O<2>,3|C<4>}	H(C[6]C[6]2)	119.4610	0.000	1	119.4610	0.000	1	118.9095	1.151	68	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6]O)(C[6]C[6]O)(H)	C[6](C[5,6]C[5,6a]C[5]C[6])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]O)(C[6]C[6]O)(H){1|H<1>,2|C<3>,2|C<4>}	C[6](C[5,6]C[5,6a]C[5]C[6])(C[6]C[6]H)(O){1|C<4>,1|H<1>,1|N<3>,1|O<1>,1|O<2>,3|C<3>}	H(C[6]C[6]2)	118.8330	0.000	1	118.8330	0.000	1	118.9095	1.151	68	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6]O)(C[6]C[6]O)(H)	C[6](C[5,6]C[5]2C[6])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]O)(C[6]C[6]O)(H){1|H<1>,3|C<3>}	C[6](C[5,6]C[5]2C[6])(C[6]C[6]H)(O){1|H<1>,1|N<3>,1|O<2>,4|C<3>}	H(C[6]C[6]2)	119.5030	0.000	1	119.5030	0.000	1	118.9095	1.151	68	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6]O)(C[6]N[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Fe)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]O)(C[6]N[6]H)(H){1|Fe<10>,1|S<4>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Fe)(C[6]C[6]H)(O){1|N<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	117.8370	0.519	2	117.8370	0.269	2	118.9095	1.151	68	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6]O)2(H)	C[6](C[5,6]C[5,6]C[5]C)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]O)2(H){1|H<1>,2|C<3>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]C)(C[6]C[6]H)(O){1|C<3>,1|O<2>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.8550	0.000	1	119.8550	0.000	1	118.9095	1.151	68	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[5,6]O)(H)	C[6](C[5,6]C[5,6a]2C[6,6a])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[5,6]O)(H){4|C<3>}	C[6](C[5,6]C[5,6a]2C[6,6a])(C[6]C[6]H)(O){1|H<1>,6|C<3>}	H(C[6]C[6]2)	119.1210	0.000	1	119.1210	0.000	1	118.9095	1.151	68	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[5,6]O)(H)	C[6](C[5,6]C[5,6a]C[6,6a]C[5])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[5,6]O)(H){1|C<4>,3|C<3>}	C[6](C[5,6]C[5,6a]C[6,6a]C[5])(C[6]C[6]H)(O){1|C<4>,2|H<1>,5|C<3>}	H(C[6]C[6]2)	119.1800	0.000	1	119.0865	0.017	6	118.9095	1.151	68	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[5,6]O)(H)	C[6](C[5,6]C[5,6a]C[6,6a]C[5])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[5,6]O)(H){1|C<4>,3|C<3>}	C[6](C[5,6]C[5,6a]C[6,6a]C[5])(C[6]C[6]H)(O){1|C<4>,3|H<1>,4|C<3>}	H(C[6]C[6]2)	119.1080	0.000	1	119.0865	0.017	6	118.9095	1.151	68	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[5,6]O)(H)	C[6](C[5,6]C[5,6a]C[6,6a]C[5])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[5,6]O)(H){4|C<3>}	C[6](C[5,6]C[5,6a]C[6,6a]C[5])(C[6]C[6]H)(O){1|H<1>,6|C<3>}	H(C[6]C[6]2)	119.1190	0.118	3	119.0865	0.017	6	118.9095	1.151	68	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[5,6]O)(H)	C[6](C[5,6]C[5,6a]C[6,6a]C[5])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[5,6]O)(H){4|C<3>}	C[6](C[5,6]C[5,6a]C[6,6a]C[5])(C[6]C[6]H)(O){1|Si<4>,1|H<1>,5|C<3>}	H(C[6]C[6]2)	118.8740	0.000	1	119.0865	0.017	6	118.9095	1.151	68	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[5,6]O)(H)	C[6](C[5,6]C[5,6a]C[6,6a]O[5])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[5,6]O)(H){1|O<2>,3|C<3>}	C[6](C[5,6]C[5,6a]C[6,6a]O[5])(C[6]C[6]H)(O){1|H<1>,5|C<3>}	H(C[6]C[6]2)	119.4560	0.000	1	119.4560	0.000	1	118.9095	1.151	68	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[5,6]O)(H)	C[6](C[5,6]C[6,6a]C[5]2)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[5,6]O)(H){1|C<4>,3|C<3>}	C[6](C[5,6]C[6,6a]C[5]2)(C[6]C[6]H)(O){2|H<1>,6|C<3>}	H(C[6]C[6]2)	119.4565	0.182	2	119.3335	0.124	4	118.9095	1.151	68	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[5,6]O)(H)	C[6](C[5,6]C[6,6a]C[5]2)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[5,6]O)(H){4|C<3>}	C[6](C[5,6]C[6,6a]C[5]2)(C[6]C[6]H)(O){1|H<1>,6|C<3>}	H(C[6]C[6]2)	119.2105	0.527	2	119.3335	0.124	4	118.9095	1.151	68	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[5,6]O)(H)	C[6](C[5,6]C[6,6a]C[5]N[5])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[5,6]O)(H){1|C<4>,1|N<3>,2|C<3>}	C[6](C[5,6]C[6,6a]C[5]N[5])(C[6]C[6]H)(O){2|C<3>,2|C<4>,4|H<1>}	H(C[6]C[6]2)	119.7770	0.000	1	119.7770	0.000	1	118.9095	1.151	68	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[5,6]O)(H)	C[6](C[5,6]C[5,6]S[5]H)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[5,6]O)(H){1|C<4>,1|S<4>,2|C<3>,3|H<1>}	C[6](C[5,6]C[5,6]S[5]H)(C[6]C[6]H)(O){1|C<3>,1|H<1>,2|O<1>,3|C<4>}	H(C[6]C[6]2)	118.1110	0.000	1	118.1110	0.000	1	118.9095	1.151	68	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[5,6]O)(H)	C[6](C[5,6]C[5,6a]C[5]C[6])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[5,6]O)(H){1|C<4>,2|H<1>,4|C<3>}	C[6](C[5,6]C[5,6a]C[5]C[6])(C[6]C[6]H)(O){1|C<4>,1|H<1>,1|N<3>,1|O<1>,4|C<3>}	H(C[6]C[6]2)	117.9770	0.000	1	117.6645	0.195	2	118.9095	1.151	68	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[5,6]O)(H)	C[6](C[5,6]C[5,6a]C[5]C[6])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[5,6]O)(H){1|C<4>,2|H<1>,4|C<3>}	C[6](C[5,6]C[5,6a]C[5]C[6])(C[6]C[6]H)(O){1|H<1>,1|N<3>,1|O<1>,2|C<4>,3|C<3>}	H(C[6]C[6]2)	117.3520	0.000	1	117.6645	0.195	2	118.9095	1.151	68	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[5,6,6]O)(C[6]C[6,6]Br)(H)	C[6](C[6,6]C[5,6,6]C[6]H)(C[6]C[6]H)(Br)	H(C[6]C[6]2)	C[6](C[6]C[5,6,6]O)(C[6]C[6,6]Br)(H){1|C<3>,1|H<1>,1|O<2>,2|C<4>}	C[6](C[6,6]C[5,6,6]C[6]H)(C[6]C[6]H)(Br){1|C<4>,1|O<1>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0700	0.148	2	120.0700	0.022	2	120.0700	0.022	2	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[3x6]H)(C[6]C[6,6]H)(H)	C[6](C[6,6]C[5,6]C[5x6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[3x6]H)(C[6]C[6,6]H)(H){1|Si<4>,1|H<1>,2|C<4>}	C[6](C[6,6]C[5,6]C[5x6]H)(C[6]C[6]H)(H){2|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.8300	0.000	1	119.8300	0.000	1	119.4609	1.300	261	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[4,6]O)(C[6]C[6,6]H)(H)	C[6](C[6,6]C[4,6,6]N[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[4,6]O)(C[6]C[6,6]H)(H){1|H<1>,1|N<3>,3|C<4>}	C[6](C[6,6]C[4,6,6]N[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>,1|S<4>,2|C<4>}	H(C[6]C[6]2)	118.1960	0.000	1	118.1960	0.000	1	119.4609	1.300	261	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6,6]H)(H)	C[6](C[6,6]C[5,6,6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6,6]H)(H){4|C<4>}	C[6](C[6,6]C[5,6,6]C[6]C)(C[6]C[6]H)(H){1|C<4>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	119.8890	0.000	1	119.8890	0.000	1	119.4609	1.300	261	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6,6]H)(H)	C[6](C[6,6]C[5,6,6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6,6]H)(H){1|Ru<11>,1|C<3>,2|C<4>}	C[6](C[6,6]C[5,6,6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.1690	0.000	1	118.1690	0.000	1	119.4609	1.300	261	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]O)(C[6]C[6,6]H)(H)	C[6](C[6,6]C[5,6,6]O[6]O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]O)(C[6]C[6,6]H)(H){1|C<3>,2|C<4>,2|O<2>}	C[6](C[6,6]C[5,6,6]O[6]O)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>,2|C<4>}	H(C[6]C[6]2)	118.3730	0.000	1	118.3730	0.000	1	119.4609	1.300	261	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6,6]O)(H)	C[6](C[6,6]C[5,6]C[6,6]O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6,6]O)(H){1|H<1>,1|O<2>,3|C<4>}	C[6](C[6,6]C[5,6]C[6,6]O)(C[6]C[6]H)(H){1|O<1>,2|C<4>,2|H<1>,2|O<2>}	H(C[6]C[6]2)	119.6030	0.000	1	119.6030	0.000	1	119.4609	1.300	261	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6,6]O)(H)	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6,6]O)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H){1|C<4>,1|O<1>,1|O<2>,3|H<1>}	H(C[6]C[6]2)	122.7860	0.000	1	120.3030	4.626	3	119.4609	1.300	261	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6,6]O)(H)	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6,6]O)(H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,2|H<1>,2|O<1>}	H(C[6]C[6]2)	119.0615	0.067	2	120.3030	4.626	3	119.4609	1.300	261	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6,6]O)(H)	C[6](C[6,6]C[6,6]C[6]N)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6,6]O)(H){2|N<3>,3|C<4>}	C[6](C[6,6]C[6,6]C[6]N)(C[6]C[6]H)(H){1|N<3>,1|O<1>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	118.8785	0.511	2	118.8785	0.261	2	119.4609	1.300	261	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]C)(H)	C[6](C[6,6]C[6,6]C[6]Cr)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]C)(H){1|Cr<9>,1|H<1>,2|C<4>}	C[6](C[6,6]C[6,6]C[6]Cr)(C[6]C[6]H)(H){1|O<2>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	119.0017	0.171	3	119.0017	0.029	3	119.4609	1.300	261	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]C)(H)	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]C)(H){2|C<4>,2|H<1>}	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H){1|C<3>,2|H<1>,4|C<4>}	H(C[6]C[6]2)	120.4830	0.000	1	120.4830	0.000	1	119.4609	1.300	261	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6,6]C[5,6,6]O[6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<4>,1|O<2>,2|H<1>}	C[6](C[6,6]C[5,6,6]O[6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.1770	0.000	1	119.1770	0.000	1	119.4609	1.300	261	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6,6]C[5,6]N[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<4>,1|N<3>,2|H<1>}	C[6](C[6,6]C[5,6]N[6,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,4|C<3>}	H(C[6]C[6]2)	119.6090	0.000	1	119.6090	0.000	1	119.4609	1.300	261	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6,6]C[6,6]2Rh)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Rh<9>,1|C<3>,1|C<4>,1|H<1>}	C[6](C[6,6]C[6,6]2Rh)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.1330	0.000	1	119.1330	0.000	1	119.4609	1.300	261	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6,6]C[6,6]As[6]Mo)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|As<3>,1|Mo<9>,1|C<4>,1|H<1>}	C[6](C[6,6]C[6,6]As[6]Mo)(C[6]C[6]H)(H){1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.5340	0.000	1	119.5340	0.000	1	119.4609	1.300	261	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<3>,3|C<4>}	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(H){1|C<4>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	120.1780	0.000	1	120.1780	0.000	1	119.4609	1.300	261	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6,6]C[6,6]C[6]Ce)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Ce<16>,1|H<1>,2|C<4>}	C[6](C[6,6]C[6,6]C[6]Ce)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	120.2125	0.220	2	120.2125	0.048	2	119.4609	1.300	261	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6,6]C[6,6]C[6]Cr)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Cr<9>,1|H<1>,2|C<4>}	C[6](C[6,6]C[6,6]C[6]Cr)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>,2|C<4>}	H(C[6]C[6]2)	119.4905	0.011	2	119.4905	0.000	2	119.4609	1.300	261	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6,6]C[6,6]C[6]Dy)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Dy<16>,1|H<1>,2|C<4>}	C[6](C[6,6]C[6,6]C[6]Dy)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	120.1145	0.349	2	120.1145	0.122	2	119.4609	1.300	261	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6,6]C[6,6]C[6]Fe)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Fe<11>,1|H<1>,2|C<4>}	C[6](C[6,6]C[6,6]C[6]Fe)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.7085	0.110	2	119.7085	0.012	2	119.4609	1.300	261	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6,6]C[6,6]C[6]Mo)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Mo<9>,1|H<1>,2|C<4>}	C[6](C[6,6]C[6,6]C[6]Mo)(C[6]C[6]H)(H){1|As<3>,1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	121.4170	0.000	1	122.9760	27.253	6	119.4609	1.300	261	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6,6]C[6,6]C[6]Mo)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Mo<9>,1|H<1>,2|C<4>}	C[6](C[6,6]C[6,6]C[6]Mo)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.2210	0.000	1	122.9760	27.253	6	119.4609	1.300	261	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6,6]C[6,6]C[6]Mo)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Mo<9>,1|H<1>,2|C<4>}	C[6](C[6,6]C[6,6]C[6]Mo)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	126.2230	8.771	2	122.9760	27.253	6	119.4609	1.300	261	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6,6]C[6,6]C[6]Mo)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Mo<9>,1|H<1>,2|C<4>}	C[6](C[6,6]C[6,6]C[6]Mo)(C[6]C[6]H)(H){1|C<3>,1|H<1>,3|C<4>}	H(C[6]C[6]2)	119.1440	0.000	1	122.9760	27.253	6	119.4609	1.300	261	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6,6]C[6,6]C[6]Mo)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Mo<9>,1|H<1>,2|C<4>}	C[6](C[6,6]C[6,6]C[6]Mo)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	125.6280	0.000	1	122.9760	27.253	6	119.4609	1.300	261	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6,6]C[6,6]C[6]Re)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Re<12>,1|H<1>,2|C<4>}	C[6](C[6,6]C[6,6]C[6]Re)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.4860	0.113	4	119.5342	0.018	6	119.4609	1.300	261	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6,6]C[6,6]C[6]Re)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Re<9>,1|H<1>,2|C<4>}	C[6](C[6,6]C[6,6]C[6]Re)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.6305	0.158	2	119.5342	0.018	6	119.4609	1.300	261	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6,6]C[6,6]C[6]Rh)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Rh<7>,1|C<3>,1|C<4>,1|H<1>}	C[6](C[6,6]C[6,6]C[6]Rh)(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	119.6390	0.000	1	119.3713	0.048	4	119.4609	1.300	261	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6,6]C[6,6]C[6]Rh)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Rh<8>,1|H<1>,2|C<4>}	C[6](C[6,6]C[6,6]C[6]Rh)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>,2|C<4>}	H(C[6]C[6]2)	119.3490	0.144	2	119.3713	0.048	4	119.4609	1.300	261	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6,6]C[6,6]C[6]Rh)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Rh<9>,1|H<1>,2|C<4>}	C[6](C[6,6]C[6,6]C[6]Rh)(C[6]C[6]H)(H){1|C<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.1480	0.000	1	119.3713	0.048	4	119.4609	1.300	261	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6,6]C[6,6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Ru<10>,1|H<1>,2|C<4>}	C[6](C[6,6]C[6,6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.6761	0.314	8	119.5977	0.114	33	119.4609	1.300	261	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6,6]C[6,6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Ru<11>,1|C<2>,2|C<4>}	C[6](C[6,6]C[6,6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.8610	0.711	2	119.5977	0.114	33	119.4609	1.300	261	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6,6]C[6,6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Ru<11>,1|C<3>,2|C<4>}	C[6](C[6,6]C[6,6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.7660	0.000	1	119.5977	0.114	33	119.4609	1.300	261	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6,6]C[6,6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Ru<11>,1|H<1>,2|C<4>}	C[6](C[6,6]C[6,6]C[6]Ru)(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.4775	0.469	2	119.5977	0.114	33	119.4609	1.300	261	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6,6]C[6,6]C[6]Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Ru<11>,1|H<1>,2|C<4>}	C[6](C[6,6]C[6,6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.5436	0.318	20	119.5977	0.114	33	119.4609	1.300	261	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6,6]C[6,6]C[6]Y)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Y<16>,1|H<1>,2|C<4>}	C[6](C[6,6]C[6,6]C[6]Y)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	120.0920	0.434	2	120.0920	0.188	2	119.4609	1.300	261	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6,6]C[6,6]N[6]Mo)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Mo<9>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6,6]C[6,6]N[6]Mo)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8050	0.505	4	119.7584	0.202	5	119.4609	1.300	261	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6,6]C[6,6]N[6]Mo)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Mo<9>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6,6]C[6,6]N[6]Mo)(C[6]C[6]H)(H){1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.5720	0.000	1	119.7584	0.202	5	119.4609	1.300	261	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6,6]C[6,6]N[6]Zr)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Zr<14>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6,6]C[6,6]N[6]Zr)(C[6]C[6]H)(H){1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.5490	0.000	1	119.5490	0.000	1	119.4609	1.300	261	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6,6]C[6,6a]C[6]P[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|H<1>,1|P<4>,2|C<3>}	C[6](C[6,6]C[6,6a]C[6]P[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>,1|O<2>,4|C<3>}	H(C[6]C[6]2)	120.7910	0.000	1	120.7910	0.000	1	119.4609	1.300	261	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6,6]N[5,6]N[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){2|H<1>,2|N<3>}	C[6](C[6,6]N[5,6]N[6,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|S<4>,2|C<3>}	H(C[6]C[6]2)	119.4880	0.000	1	119.6180	0.034	2	119.4609	1.300	261	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6,6]N[5,6]N[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){2|H<1>,2|N<3>}	C[6](C[6,6]N[5,6]N[6,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.7480	0.000	1	119.6180	0.034	2	119.4609	1.300	261	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6,6]N[6,6]C[6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<4>,1|N<3>,2|H<1>}	C[6](C[6,6]N[6,6]C[6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,4|C<3>}	H(C[6]C[6]2)	119.5090	0.000	1	119.5090	0.000	1	119.4609	1.300	261	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]N)(H)	C[6](C[6,6]C[6,6]2C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]N)(H){2|H<1>,3|C<4>}	C[6](C[6,6]C[6,6]2C)(C[6]C[6]H)(H){1|N<2>,2|H<1>,4|C<4>}	H(C[6]C[6]2)	118.8350	0.000	1	118.8350	0.000	1	119.4609	1.300	261	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]N)(H)	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]N)(H){1|C<3>,3|C<4>}	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|N<2>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.3025	0.263	4	119.3025	0.069	4	119.4609	1.300	261	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]N)(H)	C[6](C[6,6]C[6,6]C[6]Cr)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]N)(H){1|Cr<9>,1|H<1>,2|C<4>}	C[6](C[6,6]C[6,6]C[6]Cr)(C[6]C[6]H)(H){1|C<3>,1|N<2>,1|O<2>,2|C<4>}	H(C[6]C[6]2)	120.0750	0.000	1	120.0750	0.000	1	119.4609	1.300	261	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	C[6](C[6,6]C[3,6,6]C[6,6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,2|C<4>}	C[6](C[6,6]C[3,6,6]C[6,6]C)(C[6]C[6]H)(H){1|C<3>,1|O<1>,1|O<2>,3|C<4>}	H(C[6]C[6]2)	119.4120	0.011	2	119.4120	0.000	2	119.4609	1.300	261	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	C[6](C[6,6]C[5,6,6]C[6,6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){5|C<4>}	C[6](C[6,6]C[5,6,6]C[6,6]C)(C[6]C[6]H)(H){1|H<1>,1|O<1>,1|O<2>,4|C<4>}	H(C[6]C[6]2)	118.6815	0.449	2	118.6815	0.202	2	119.4609	1.300	261	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	C[6](C[6,6]C[5,6]C[6,6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){5|C<4>}	C[6](C[6,6]C[5,6]C[6,6]C)(C[6]C[6]H)(H){1|O<1>,2|H<1>,4|C<4>}	H(C[6]C[6]2)	118.5830	0.122	3	118.5830	0.015	3	119.4609	1.300	261	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	C[6](C[6,6]C[6,6]2C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,2|C<4>}	C[6](C[6,6]C[6,6]2C)(C[6]C[6]H)(H){1|Br<1>,1|C<3>,1|O<1>,3|C<4>}	H(C[6]C[6]2)	119.5515	0.046	2	119.2317	0.326	69	119.4609	1.300	261	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	C[6](C[6,6]C[6,6]2C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,2|C<4>}	C[6](C[6,6]C[6,6]2C)(C[6]C[6]H)(H){1|C<3>,1|F<1>,1|O<1>,3|C<4>}	H(C[6]C[6]2)	119.1683	0.568	8	119.2317	0.326	69	119.4609	1.300	261	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	C[6](C[6,6]C[6,6]2C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,2|C<4>}	C[6](C[6,6]C[6,6]2C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>,3|C<4>}	H(C[6]C[6]2)	119.4589	0.303	23	119.2317	0.326	69	119.4609	1.300	261	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	C[6](C[6,6]C[6,6]2C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,2|C<4>}	C[6](C[6,6]C[6,6]2C)(C[6]C[6]H)(H){1|Cl<1>,1|C<3>,1|O<1>,3|C<4>}	H(C[6]C[6]2)	119.4197	0.097	4	119.2317	0.326	69	119.4609	1.300	261	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	C[6](C[6,6]C[6,6]2C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,2|C<4>}	C[6](C[6,6]C[6,6]2C)(C[6]C[6]H)(H){1|Cl<1>,1|C<4>,1|O<1>,3|C<3>}	H(C[6]C[6]2)	119.3020	0.000	1	119.2317	0.326	69	119.4609	1.300	261	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	C[6](C[6,6]C[6,6]2C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,2|C<4>}	C[6](C[6,6]C[6,6]2C)(C[6]C[6]H)(H){1|F<1>,1|O<1>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	118.6500	0.523	2	119.2317	0.326	69	119.4609	1.300	261	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	C[6](C[6,6]C[6,6]2C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,2|C<4>}	C[6](C[6,6]C[6,6]2C)(C[6]C[6]H)(H){1|H<1>,1|O<1>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	119.1986	0.270	5	119.2317	0.326	69	119.4609	1.300	261	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	C[6](C[6,6]C[6,6]2C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|C<3>,4|C<4>}	C[6](C[6,6]C[6,6]2C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>,3|C<4>}	H(C[6]C[6]2)	120.3837	0.242	3	119.2317	0.326	69	119.4609	1.300	261	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	C[6](C[6,6]C[6,6]2C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|C<3>,4|C<4>}	C[6](C[6,6]C[6,6]2C)(C[6]C[6]H)(H){1|H<1>,1|O<1>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	117.7540	0.000	1	119.2317	0.326	69	119.4609	1.300	261	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	C[6](C[6,6]C[6,6]2C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|C<4>,1|H<1>,2|C<3>}	C[6](C[6,6]C[6,6]2C)(C[6]C[6]H)(H){1|O<1>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	119.3460	0.000	1	119.2317	0.326	69	119.4609	1.300	261	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	C[6](C[6,6]C[6,6]2C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){2|H<1>,3|C<4>}	C[6](C[6,6]C[6,6]2C)(C[6]C[6]H)(H){1|O<1>,2|H<1>,4|C<4>}	H(C[6]C[6]2)	118.3540	0.000	1	119.2317	0.326	69	119.4609	1.300	261	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	C[6](C[6,6]C[6,6]2C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){5|C<4>}	C[6](C[6,6]C[6,6]2C)(C[6]C[6]H)(H){1|C<3>,1|O<1>,2|H<1>,3|C<4>}	H(C[6]C[6]2)	118.6163	0.616	3	119.2317	0.326	69	119.4609	1.300	261	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	C[6](C[6,6]C[6,6]2C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){5|C<4>}	C[6](C[6,6]C[6,6]2C)(C[6]C[6]H)(H){1|O<1>,2|H<1>,4|C<4>}	H(C[6]C[6]2)	118.9505	0.593	15	119.2317	0.326	69	119.4609	1.300	261	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	C[6](C[6,6]C[6,6]2H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,2|C<4>}	C[6](C[6,6]C[6,6]2H)(C[6]C[6]H)(H){1|C<3>,1|O<1>,5|C<4>}	H(C[6]C[6]2)	118.8885	0.192	4	119.0030	0.054	6	119.4609	1.300	261	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	C[6](C[6,6]C[6,6]2H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){2|C<4>,3|H<1>}	C[6](C[6,6]C[6,6]2H)(C[6]C[6]H)(H){1|O<1>,2|H<1>,4|C<4>}	H(C[6]C[6]2)	119.2320	0.044	2	119.0030	0.054	6	119.4609	1.300	261	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	C[6](C[6,6]C[6,6]2O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|H<1>,1|O<2>}	C[6](C[6,6]C[6,6]2O)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>,3|C<4>}	H(C[6]C[6]2)	119.3580	0.000	1	119.3580	0.000	1	119.4609	1.300	261	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|C<3>,3|C<4>}	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|O<1>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.3790	0.127	5	119.2898	0.523	13	119.4609	1.300	261	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|C<3>,3|C<4>}	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|O<1>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	119.0820	0.000	1	119.2898	0.523	13	119.4609	1.300	261	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|C<3>,3|C<4>}	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|O<1>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.1557	0.486	4	119.2898	0.523	13	119.4609	1.300	261	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|C<3>,4|C<4>}	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(H){1|H<1>,2|O<1>,3|C<4>}	H(C[6]C[6]2)	118.4475	0.013	2	119.2898	0.523	13	119.4609	1.300	261	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){2|O<2>,3|C<4>}	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(H){1|O<1>,2|H<1>,4|C<4>}	H(C[6]C[6]2)	121.2720	0.000	1	119.2898	0.523	13	119.4609	1.300	261	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	C[6](C[6,6]C[6,6]C[6]F)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|F<1>,1|H<1>}	C[6](C[6,6]C[6,6]C[6]F)(C[6]C[6]H)(H){1|C<3>,1|O<1>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.6464	0.089	5	119.6464	0.008	5	119.4609	1.300	261	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|H<1>,4|C<4>}	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H){1|C<3>,1|O<1>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	122.5240	0.000	1	119.6136	2.664	5	119.4609	1.300	261	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){2|C<4>,3|H<1>}	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H){1|C<3>,1|O<1>,2|H<1>,3|C<4>}	H(C[6]C[6]2)	118.9113	0.171	3	119.6136	2.664	5	119.4609	1.300	261	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){2|C<4>,3|H<1>}	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H){1|N<3>,1|O<1>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	118.8100	0.000	1	119.6136	2.664	5	119.4609	1.300	261	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	C[6](C[6,6]C[6,6]C[6]O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|H<1>,1|O<2>}	C[6](C[6,6]C[6,6]C[6]O)(C[6]C[6]H)(H){1|C<4>,1|O<1>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	118.9270	0.000	1	119.1200	0.082	6	119.4609	1.300	261	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	C[6](C[6,6]C[6,6]C[6]O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[6,6]C[6,6]C[6]O)(C[6]C[6]H)(H){1|C<3>,1|O<1>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	119.2205	0.158	2	119.1200	0.082	6	119.4609	1.300	261	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	C[6](C[6,6]C[6,6]C[6]O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[6,6]C[6,6]C[6]O)(C[6]C[6]H)(H){1|N<3>,1|O<1>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	119.1173	0.405	3	119.1200	0.082	6	119.4609	1.300	261	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	C[6](C[6,6]C[6,6]C[6a]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|N<3>,2|H<1>}	C[6](C[6,6]C[6,6]C[6a]N[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,1|O<1>,1|S<4>,3|C<3>}	H(C[6]C[6]2)	118.3890	0.000	1	118.3890	0.000	1	119.4609	1.300	261	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	C[6](C[6,6]C[6,6]C[6a]O[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|O<2>,2|H<1>}	C[6](C[6,6]C[6,6]C[6a]O[6])(C[6]C[6]H)(H){1|H<1>,1|O<1>,1|O<2>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	119.2710	0.000	1	119.2710	0.000	1	119.4609	1.300	261	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	C[6](C[6,6]C[6,6]N[6]O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|C<4>,1|N<3>,1|O<1>,2|H<1>}	C[6](C[6,6]C[6,6]N[6]O)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<1>,1|O<2>,2|C<3>}	H(C[6]C[6]2)	118.9070	0.000	1	118.9070	0.000	1	119.4609	1.300	261	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	C[6](C[6,6]C[6,6]O[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|H<1>,2|C<4>,2|O<2>}	C[6](C[6,6]C[6,6]O[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>,2|C<4>}	H(C[6]C[6]2)	119.5625	0.148	2	119.1658	0.085	10	119.4609	1.300	261	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	C[6](C[6,6]C[6,6]O[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[6,6]C[6,6]O[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>,2|C<4>}	H(C[6]C[6]2)	119.1817	0.251	4	119.1658	0.085	10	119.4609	1.300	261	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	C[6](C[6,6]C[6,6]O[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[6,6]C[6,6]O[6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<1>,2|O<2>}	H(C[6]C[6]2)	118.9800	0.000	1	119.1658	0.085	10	119.4609	1.300	261	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	C[6](C[6,6]C[6,6]O[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[6,6]C[6,6]O[6]C)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>,2|C<4>}	H(C[6]C[6]2)	119.0390	0.045	2	119.1658	0.085	10	119.4609	1.300	261	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	C[6](C[6,6]C[6,6]O[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|Se<2>,1|H<1>,1|O<2>,2|C<4>}	C[6](C[6,6]C[6,6]O[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>,2|C<4>}	H(C[6]C[6]2)	118.7480	0.000	1	119.1658	0.085	10	119.4609	1.300	261	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	C[6](C[6,6]C[6,6a]C[6,6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|C<3>,4|C<4>}	C[6](C[6,6]C[6,6a]C[6,6]C)(C[6]C[6]H)(H){1|H<1>,1|O<1>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	118.7680	0.000	1	118.7680	0.000	1	119.4609	1.300	261	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	C[6](C[6,6]C[6,6a]C[6,6]O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|O<2>,2|H<1>}	C[6](C[6,6]C[6,6a]C[6,6]O)(C[6]C[6]H)(H){1|H<1>,1|O<1>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	118.9140	0.027	3	118.9140	0.001	3	119.4609	1.300	261	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	C[6](C[6,6]C[6,6a]C[6]2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|C<4>,1|O<2>,2|C<3>}	C[6](C[6,6]C[6,6a]C[6]2)(C[6]C[6]H)(H){1|C<4>,1|O<1>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	118.8980	0.000	1	118.8980	0.000	1	119.4609	1.300	261	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	C[6](C[6,6]C[6,6a]C[6]N[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|H<1>,1|N<2>,2|C<3>}	C[6](C[6,6]C[6,6a]C[6]N[6])(C[6]C[6]H)(H){1|H<1>,1|O<1>,4|C<3>}	H(C[6]C[6]2)	121.0455	0.281	2	121.0455	0.079	2	119.4609	1.300	261	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	C[6](C[6,6]C[6,6a]N[5a,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|H<1>,1|N<3>,2|C<3>}	C[6](C[6,6]C[6,6a]N[5a,6]C[6])(C[6]C[6]H)(H){1|H<1>,1|O<1>,5|C<3>}	H(C[6]C[6]2)	118.9970	0.104	4	118.9970	0.011	4	119.4609	1.300	261	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	C[6](C[6,6]C[6]2O[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|H<1>,1|O<2>,2|C<3>}	C[6](C[6,6]C[6]2O[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>,2|O<1>}	H(C[6]C[6]2)	119.1195	0.201	4	119.1195	0.040	4	119.4609	1.300	261	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	C[6](C[6,6]C[6]3)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,2|C<4>}	C[6](C[6,6]C[6]3)(C[6]C[6]H)(H){1|C<3>,1|O<1>,2|C<4>,5|H<1>}	H(C[6]C[6]2)	118.9785	0.371	2	119.1715	0.661	10	119.4609	1.300	261	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	C[6](C[6,6]C[6]3)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,2|C<4>}	C[6](C[6,6]C[6]3)(C[6]C[6]H)(H){1|C<4>,1|N<3>,1|O<1>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	119.0810	0.199	4	119.1715	0.661	10	119.4609	1.300	261	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	C[6](C[6,6]C[6]3)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6,6]C[6]3)(C[6]C[6]H)(H){1|C<3>,1|O<1>,2|H<1>,5|C<4>}	H(C[6]C[6]2)	118.5050	0.298	2	119.1715	0.661	10	119.4609	1.300	261	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	C[6](C[6,6]C[6]3)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){2|H<1>,3|C<4>}	C[6](C[6,6]C[6]3)(C[6]C[6]H)(H){1|C<3>,1|O<1>,1|O<2>,3|C<4>,4|H<1>}	H(C[6]C[6]2)	120.2120	1.564	2	119.1715	0.661	10	119.4609	1.300	261	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6,6]O)(H)	C[6](C[6,6]C[6,6a]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6,6]O)(H){1|C<3>,1|H<1>,2|C<4>}	C[6](C[6,6]C[6,6a]C[6,6]H)(C[6]C[6]H)(H){1|N<3>,1|O<1>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.8240	0.000	1	120.8240	0.000	1	119.4609	1.300	261	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	C[6](C[6,6]C[6,6]C[6]Mo)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Mo<9>,2|C<4>}	C[6](C[6,6]C[6,6]C[6]Mo)(C[6]C[6]H)(H){1|N<2>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	120.4005	0.753	2	120.4005	0.567	2	119.4609	1.300	261	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]O)(H)	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]O)(H){1|C<3>,1|S<4>,2|C<4>}	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(H){1|N<3>,1|O<1>,1|O<2>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	121.0600	0.000	1	121.0600	0.000	1	119.4609	1.300	261	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]O[6]O)(H)	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]O[6]O)(H){3|C<4>}	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|O<1>,1|O<2>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.1480	0.170	2	119.1480	0.029	2	119.4609	1.300	261	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]O[6]O)(H)	C[6](C[6,6]C[6,6]O[6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]O[6]O)(H){1|C<4>,1|H<1>,1|O<2>}	C[6](C[6,6]C[6,6]O[6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|O<1>,1|O<2>}	H(C[6]C[6]2)	119.3167	0.128	3	119.3167	0.016	3	119.4609	1.300	261	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]O[6]O)(H)	C[6](C[6,6]C[6]3)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]O[6]O)(H){1|C<3>,2|C<4>}	C[6](C[6,6]C[6]3)(C[6]C[6]H)(H){1|C<3>,1|O<1>,1|O<2>,2|H<1>,4|C<4>}	H(C[6]C[6]2)	120.4515	2.107	4	120.4515	4.438	4	119.4609	1.300	261	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6,6a]O[6]O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6,6]H)(H){2|C<3>,2|O<2>}	C[6](C[6,6]C[6,6,6a]O[6]O)(C[6]C[6]H)(H){1|O<1>,3|C<3>}	H(C[6]C[6]2)	118.2350	0.216	2	118.2350	0.047	2	119.4609	1.300	261	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6a]2N[5a,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6,6]H)(H){1|N<3>,3|C<3>}	C[6](C[6,6]C[6,6a]2N[5a,6])(C[6]C[6]H)(H){1|O<1>,6|C<3>}	H(C[6]C[6]2)	118.7580	0.000	1	118.7580	0.000	1	119.4609	1.300	261	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[3x6]H)(C[6]C[6,6]O)(H)	C[6](C[6,6]C[3x6]C[6]H)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[3x6]H)(C[6]C[6,6]O)(H){1|H<1>,1|O<2>,3|C<4>}	C[6](C[6,6]C[3x6]C[6]H)(C[6]C[6]H)(O){2|H<1>,5|C<4>}	H(C[6]C[6]2)	119.7140	0.000	1	119.7140	0.000	1	118.4616	2.765	71	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6,6]O)(H)	C[6](C[6,6]C[3,6,6]C[5,6,6]C)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6,6]O)(H){5|C<4>}	C[6](C[6,6]C[3,6,6]C[5,6,6]C)(C[6]C[6]H)(O){1|C<3>,1|O<2>,2|H<1>,3|C<4>}	H(C[6]C[6]2)	116.6515	0.166	2	116.6515	0.028	2	118.4616	2.765	71	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6,6]O)(H)	C[6](C[6,6]C[5,6,6]C[6]C)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6,6]O)(H){1|C<3>,2|C<4>,2|O<2>}	C[6](C[6,6]C[5,6,6]C[6]C)(C[6]C[6]H)(O){1|C<3>,2|C<4>,4|H<1>}	H(C[6]C[6]2)	120.4040	0.000	1	120.4040	0.000	1	118.4616	2.765	71	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6,6]O)(H)	C[6](C[6,6]C[5,6,6]C[6]O)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6,6]O)(H){1|C<3>,2|C<4>,2|O<2>}	C[6](C[6,6]C[5,6,6]C[6]O)(C[6]C[6]H)(O){1|C<3>,1|C<4>,1|N<3>,1|O<1>,2|H<1>}	H(C[6]C[6]2)	119.2090	0.000	1	119.2090	0.000	1	118.4616	2.765	71	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6,6]O)(H)	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6,6]O)(H){1|C<3>,2|C<4>,2|O<2>}	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(O){1|C<3>,3|C<4>,3|H<1>}	H(C[6]C[6]2)	118.7473	0.196	3	118.7473	0.038	3	118.4616	2.765	71	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]C)(C[6]C[6,6]O)(H)	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]C)(C[6]C[6,6]O)(H){1|H<1>,4|C<4>}	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(O){1|C<3>,1|O<2>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	118.6090	0.000	1	118.6090	0.000	1	118.4616	2.765	71	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]C[6a])(C[6]C[6,6]O)(H)	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]C[6a])(C[6]C[6,6]O)(H){2|C<4>,2|H<1>,3|C<3>}	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(O){1|C<3>,1|O<1>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.3030	0.223	2	118.3030	0.050	2	118.4616	2.765	71	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6,6]O)(H)	C[6](C[6,6]C[3x6]C[6]C)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6,6]O)(H){1|C<3>,3|C<4>}	C[6](C[6,6]C[3x6]C[6]C)(C[6]C[6]H)(O){1|C<3>,1|O<2>,2|H<1>,3|C<4>}	H(C[6]C[6]2)	118.9140	0.395	2	118.9140	0.156	2	118.4616	2.765	71	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6,6]O)(H)	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6,6]O)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(O){1|C<3>,1|C<4>,1|O<2>,3|H<1>}	H(C[6]C[6]2)	122.7610	0.000	1	120.1295	3.140	4	118.4616	2.765	71	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6,6]O)(H)	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6,6]O)(H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(O){1|C<3>,1|C<4>,4|H<1>}	H(C[6]C[6]2)	119.0760	0.033	2	120.1295	3.140	4	118.4616	2.765	71	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6,6]O)(H)	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6,6]O)(H){1|H<1>,1|O<2>,3|C<4>}	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(O){2|C<4>,2|O<2>,3|H<1>}	H(C[6]C[6]2)	119.6050	0.000	1	120.1295	3.140	4	118.4616	2.765	71	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6,6]O)(H)	C[6](C[6,6]C[6,6]C[6]N)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6,6]O)(H){2|N<3>,3|C<4>}	C[6](C[6,6]C[6,6]C[6]N)(C[6]C[6]H)(O){1|N<3>,2|C<4>,4|H<1>}	H(C[6]C[6]2)	118.8770	0.537	2	118.8770	0.289	2	118.4616	2.765	71	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]Br)(H)	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]Br)(H){1|H<1>,1|O<1>,2|C<4>}	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(O){1|Br<1>,1|C<3>,2|H<1>,3|C<4>}	H(C[6]C[6]2)	115.0060	0.000	1	115.0060	0.000	1	118.4616	2.765	71	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]C)(H)	C[6](C[6,6]C[6,6]2H)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]C)(H){1|H<1>,1|O<1>,2|C<4>}	C[6](C[6,6]C[6,6]2H)(C[6]C[6]H)(O){1|H<1>,2|C<3>,4|C<4>}	H(C[6]C[6]2)	117.7820	0.000	1	116.5588	5.540	5	118.4616	2.765	71	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]C)(H)	C[6](C[6,6]C[6,6]2H)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]C)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[6,6]C[6,6]2H)(C[6]C[6]H)(O){1|C<3>,1|H<1>,5|C<4>}	H(C[6]C[6]2)	115.3937	2.390	3	116.5588	5.540	5	118.4616	2.765	71	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]C)(H)	C[6](C[6,6]C[6,6]2H)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]C)(H){2|C<4>,3|H<1>}	C[6](C[6,6]C[6,6]2H)(C[6]C[6]H)(O){2|C<3>,2|H<1>,3|C<4>}	H(C[6]C[6]2)	118.8310	0.000	1	116.5588	5.540	5	118.4616	2.765	71	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]C)(H)	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]C)(H){1|O<1>,3|C<4>}	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(O){2|C<3>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	118.2420	0.000	1	118.2420	0.000	1	118.4616	2.765	71	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]C)(H)	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]C)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(O){7|C<4>}	H(C[6]C[6]2)	118.0580	0.000	1	118.7458	0.282	4	118.4616	2.765	71	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]C)(H)	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]C)(H){2|C<4>,3|H<1>}	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(O){1|C<3>,2|H<1>,4|C<4>}	H(C[6]C[6]2)	118.9750	0.329	3	118.7458	0.282	4	118.4616	2.765	71	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]C)(H)	C[6](C[6,6]C[6,6]C[6]O[6])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]C)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[6,6]C[6,6]C[6]O[6])(C[6]C[6]H)(O){1|C<3>,2|H<1>,5|C<4>}	H(C[6]C[6]2)	117.8820	0.000	1	117.8820	0.000	1	118.4616	2.765	71	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]C)(H)	C[6](C[6,6]C[6,6a]C[6,6]H)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]C)(H){1|C<3>,1|C<4>,3|H<1>}	C[6](C[6,6]C[6,6a]C[6,6]H)(C[6]C[6]H)(O){1|O<2>,2|C<3>,3|C<4>}	H(C[6]C[6]2)	118.7520	0.000	1	118.7520	0.000	1	118.4616	2.765	71	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]C)(H)	C[6](C[6,6]C[6]2O[6])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]C)(H){1|H<1>,2|C<4>,2|O<2>}	C[6](C[6,6]C[6]2O[6])(C[6]C[6]H)(O){1|C<3>,1|O<2>,3|C<4>,3|H<1>}	H(C[6]C[6]2)	118.5010	0.324	2	118.5010	0.105	2	118.4616	2.765	71	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H)	C[6](C[6,6]C[3,6,6]C[6,6]C)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H){1|H<1>,1|O<2>,3|C<4>}	C[6](C[6,6]C[3,6,6]C[6,6]C)(C[6]C[6]H)(O){1|O<2>,2|H<1>,4|C<4>}	H(C[6]C[6]2)	118.8680	0.000	1	115.8957	8.096	3	118.4616	2.765	71	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H)	C[6](C[6,6]C[3,6,6]C[6,6]C)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H){2|H<1>,3|C<4>}	C[6](C[6,6]C[3,6,6]C[6,6]C)(C[6]C[6]H)(O){1|O<2>,2|H<1>,4|C<4>}	H(C[6]C[6]2)	114.4095	1.715	2	115.8957	8.096	3	118.4616	2.765	71	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H)	C[6](C[6,6]C[3x6]C[6,6]C)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H){5|C<4>}	C[6](C[6,6]C[3x6]C[6,6]C)(C[6]C[6]H)(O){1|C<3>,3|C<4>,3|H<1>}	H(C[6]C[6]2)	118.1980	0.000	1	118.1980	0.000	1	118.4616	2.765	71	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H)	C[6](C[6,6]C[4x6]C[6]2)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H){5|C<4>}	C[6](C[6,6]C[4x6]C[6]2)(C[6]C[6]H)(O){1|O<2>,2|C<3>,2|C<4>,5|H<1>}	H(C[6]C[6]2)	118.2310	0.000	1	118.2310	0.000	1	118.4616	2.765	71	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H)	C[6](C[6,6]C[6,6]2C)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H){5|C<4>}	C[6](C[6,6]C[6,6]2C)(C[6]C[6]H)(O){3|H<1>,4|C<4>}	H(C[6]C[6]2)	117.8600	0.000	1	117.8600	0.000	1	118.4616	2.765	71	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H)	C[6](C[6,6]C[6,6]2H)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H){2|C<4>,3|H<1>}	C[6](C[6,6]C[6,6]2H)(C[6]C[6]H)(O){2|C<3>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	119.5253	0.103	3	119.5253	0.011	3	118.4616	2.765	71	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H)	C[6](C[6,6]C[6,6]C[6]2)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H){1|C<3>,1|O<2>,2|C<4>}	C[6](C[6,6]C[6,6]C[6]2)(C[6]C[6]H)(O){1|C<2>,2|C<3>,2|C<4>,4|H<1>}	H(C[6]C[6]2)	119.5050	0.000	1	118.8363	0.398	3	118.4616	2.765	71	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H)	C[6](C[6,6]C[6,6]C[6]2)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H){5|C<4>}	C[6](C[6,6]C[6,6]C[6]2)(C[6]C[6]H)(O){1|C<3>,1|O<2>,3|C<4>,5|H<1>}	H(C[6]C[6]2)	118.2510	0.000	1	118.8363	0.398	3	118.4616	2.765	71	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H)	C[6](C[6,6]C[6,6]C[6]2)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H){5|C<4>}	C[6](C[6,6]C[6,6]C[6]2)(C[6]C[6]H)(O){1|O<2>,4|C<4>,5|H<1>}	H(C[6]C[6]2)	118.7530	0.000	1	118.8363	0.398	3	118.4616	2.765	71	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H)	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H){1|O<2>,4|C<4>}	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(O){3|C<4>,4|H<1>}	H(C[6]C[6]2)	118.5440	0.000	1	119.1515	0.738	2	118.4616	2.765	71	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H)	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H){2|H<1>,3|C<4>}	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(O){1|C<3>,2|C<4>,4|H<1>}	H(C[6]C[6]2)	119.7590	0.000	1	119.1515	0.738	2	118.4616	2.765	71	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H)	C[6](C[6,6]C[6,6]C[6]Cr)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H){1|Cr<9>,1|O<1>,2|C<4>}	C[6](C[6,6]C[6,6]C[6]Cr)(C[6]C[6]H)(O){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	114.6290	1.014	2	114.6290	1.028	2	118.4616	2.765	71	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H)	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H){1|H<1>,1|O<1>,2|C<4>}	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(O){1|C<4>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.0385	0.192	2	119.0838	0.140	4	118.4616	2.765	71	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H)	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H){1|H<1>,4|C<4>}	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(O){1|O<2>,2|C<4>,4|H<1>}	H(C[6]C[6]2)	119.5620	0.000	1	119.0838	0.140	4	118.4616	2.765	71	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H)	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H){2|C<4>,3|H<1>}	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(O){1|O<2>,3|C<4>,3|H<1>}	H(C[6]C[6]2)	118.6960	0.000	1	119.0838	0.140	4	118.4616	2.765	71	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]O)(H)	C[6](C[6,6]C[6,6]2C)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]O)(H){1|C<3>,4|C<4>}	C[6](C[6,6]C[6,6]2C)(C[6]C[6]H)(O){1|C<3>,1|O<2>,2|H<1>,3|C<4>}	H(C[6]C[6]2)	117.8830	0.793	2	117.8830	0.629	2	118.4616	2.765	71	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]O)(H)	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]O)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(O){1|O<2>,3|C<4>,3|H<1>}	H(C[6]C[6]2)	119.0730	0.000	1	119.0730	0.000	1	118.4616	2.765	71	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]O)(H)	C[6](C[6,6]C[6]O[6]2)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]O)(H){1|C<3>,1|H<1>,2|O<2>}	C[6](C[6,6]C[6]O[6]2)(C[6]C[6]H)(O){1|O<2>,4|C<3>}	H(C[6]C[6]2)	118.0950	0.000	1	118.0950	0.000	1	118.4616	2.765	71	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]N[6]H)(H)	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]N[6]H)(H){1|H<1>,3|C<4>}	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(O){1|C<3>,1|N<3>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	119.8390	0.000	1	119.8390	0.000	1	118.4616	2.765	71	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]O[6]C)(H)	C[6](C[6,6]C[6]3)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]O[6]C)(H){1|C<3>,2|C<4>}	C[6](C[6,6]C[6]3)(C[6]C[6]H)(O){1|O<1>,1|O<2>,2|C<3>,2|H<1>,3|C<4>}	H(C[6]C[6]2)	118.9720	0.000	1	118.9720	0.000	1	118.4616	2.765	71	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]O)2(H)	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)2(H){1|C<3>,1|H<1>,3|C<4>}	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(O){1|O<1>,1|O<2>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.5600	0.000	1	119.5428	0.107	6	118.4616	2.765	71	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]O)2(H)	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)2(H){1|C<3>,1|H<1>,3|C<4>}	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(O){1|O<2>,2|C<4>,4|H<1>}	H(C[6]C[6]2)	119.7710	0.546	2	119.5428	0.107	6	118.4616	2.765	71	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]O)2(H)	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)2(H){5|C<4>}	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(O){1|H<1>,2|O<2>,4|C<4>}	H(C[6]C[6]2)	119.3850	0.170	3	119.5428	0.107	6	118.4616	2.765	71	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]O)2(H)	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)2(H){1|C<3>,1|H<1>,3|C<4>}	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(O){1|O<1>,1|O<2>,4|C<4>}	H(C[6]C[6]2)	119.4680	0.000	1	119.6075	0.039	2	118.4616	2.765	71	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]O)2(H)	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)2(H){2|H<1>,3|C<4>}	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(O){2|C<4>,2|H<1>,3|O<2>}	H(C[6]C[6]2)	119.7470	0.000	1	119.6075	0.039	2	118.4616	2.765	71	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6,6]O)(H)	C[6](C[6,6]C[6,6,6a]C[6,6a]O)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6,6]O)(H){1|O<2>,3|C<3>}	C[6](C[6,6]C[6,6,6a]C[6,6a]O)(C[6]C[6]H)(O){1|H<1>,4|C<3>}	H(C[6]C[6]2)	120.4950	0.311	2	120.4950	0.097	2	118.4616	2.765	71	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6,6]O)(H)	C[6](C[6,6]C[6,6a]2C[6])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6,6]O)(H){1|C<4>,3|C<3>}	C[6](C[6,6]C[6,6a]2C[6])(C[6]C[6]H)(O){1|C<4>,2|H<1>,5|C<3>}	H(C[6]C[6]2)	115.7620	0.000	1	115.7620	0.000	1	118.4616	2.765	71	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6,6]Br)(C[6]C[6]Br)(H)	C[6](C[6]C[6,6]DyO)(C[6]C[6]H)(Br)	H(C[6]C[6]2)	C[6](C[6]C[6,6]Br)(C[6]C[6]Br)(H){1|Dy<13>,1|C<3>,1|C<4>,1|O<2>}	C[6](C[6]C[6,6]DyO)(C[6]C[6]H)(Br){1|Br<1>,1|C<3>,1|N<3>}	H(C[6]C[6]2)	119.9527	0.126	3	119.9527	0.016	3	120.2793	1.823	8	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]O)(H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(Br)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]O)(H){2|C<4>,3|H<1>}	C[6](C[6]C[6]CH)(C[6]C[6]H)(Br){1|C<4>,1|O<1>,2|H<1>}	H(C[6]C[6]2)	119.1100	0.000	2	119.1100	0.000	2	120.2793	1.823	8	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]O)(H)	C[6](C[6]C[6]CN)(C[6]C[6]H)(Br)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|H<1>,1|N<2>}	C[6](C[6]C[6]CN)(C[6]C[6]H)(Br){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	123.3630	0.000	1	121.7475	5.220	2	120.2793	1.823	8	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]O)(H)	C[6](C[6]C[6]CN)(C[6]C[6]H)(Br)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]CN)(C[6]C[6]H)(Br){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	120.1320	0.000	1	121.7475	5.220	2	120.2793	1.823	8	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]Br)2(H)	C[6](C[6]C[6]ZrO)(C[6]C[6]H)(Br)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)2(H){1|Zr<7>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]ZrO)(C[6]C[6]H)(Br){1|Br<1>,2|C<3>}	H(C[6]C[6]2)	120.6610	0.000	1	120.6610	0.000	1	120.2793	1.823	8	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[5,6]O)(C[6]C[6]Cl)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(Cl)	H(C[6]C[6]2)	C[6](C[6]C[5,6]O)(C[6]C[6]Cl)(H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(Cl){1|C<3>,1|C<4>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	119.0280	0.000	1	119.0280	0.000	1	119.5344	0.467	5	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]O)(H)	C[6](C[6]C[6]HO)(C[6]C[6]H)(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]O)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[6]C[6]HO)(C[6]C[6]H)(Cl){1|C<4>,1|H<1>,1|O<1>,1|O<2>}	H(C[6]C[6]2)	119.0960	0.518	2	119.0960	0.268	2	119.5344	0.467	5	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]Cl)2(H)	C[6](C[6]C[6]ZrO)(C[6]C[6]H)(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)2(H){1|Zr<7>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]ZrO)(C[6]C[6]H)(Cl){1|Cl<1>,2|C<3>}	H(C[6]C[6]2)	120.2260	0.048	2	120.2260	0.002	2	119.5344	0.467	5	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]B[6]H)(C[6]C[6]H)(H)	C[6](C[6]N[6]ZrH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]B[6]H)(C[6]C[6]H)(H){1|Zr<15>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6]ZrH)(C[6]C[6]H)(H){1|B<3>,1|H<1>}	H(C[6]C[6]2)	119.8980	0.000	1	119.8845	0.000	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]B[6]H)(C[6]C[6]H)(H)	C[6](C[6]N[6]ZrH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]B[6]H)(C[6]C[6]H)(H){1|Zr<15>,1|C<3>,1|H<2>,1|N<3>}	C[6](C[6]N[6]ZrH)(C[6]C[6]H)(H){1|B<3>,1|H<1>}	H(C[6]C[6]2)	119.8710	0.000	1	119.8845	0.000	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[3,5,6,6]O)(C[6]C[6]H)(H)	C[6](C[6]C[3,5,6,6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[3,5,6,6]O)(C[6]C[6]H)(H){2|H<1>,3|C<4>}	C[6](C[6]C[3,5,6,6]HH)(C[6]C[6]H)(H){1|O<1>,3|C<4>}	H(C[6]C[6]2)	118.6540	0.000	1	118.6540	0.000	1	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[3x6]O)(C[6]C[6]H)(H)	C[6](C[6]C[4x6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[3x6]O)(C[6]C[6]H)(H){2|C<4>,3|H<1>}	C[6](C[6]C[4x6]HH)(C[6]C[6]H)(H){1|C<4>,1|O<2>,2|C<3>}	H(C[6]C[6]2)	118.2330	0.000	1	118.2330	0.000	1	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[4,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[4,6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[4,6]H)(C[6]C[6]H)(H){2|C<4>,2|H<1>}	C[6](C[6]C[4,6]HH)(C[6]C[6]H)(H){1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.6280	0.000	1	119.6280	0.000	1	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,5,6]O)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]CC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,5,6]O)(C[6]C[6]H)(H){5|C<4>}	C[6](C[6]C[5,6]CC)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<1>,1|O<2>}	H(C[6]C[6]2)	118.3880	0.000	1	118.3880	0.000	1	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6,6]O)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]CC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6,6]O)(C[6]C[6]H)(H){5|C<4>}	C[6](C[6]C[5,6]CC)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<1>,1|O<2>}	H(C[6]C[6]2)	118.1830	0.000	1	118.1830	0.000	1	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]AlH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H){1|Al<5>,1|C<3>,1|C<5>,1|H<1>}	C[6](C[6]C[5,6]AlH)(C[6]C[6]H)(H){1|C<3>,1|N<3>,2|C<4>}	H(C[6]C[6]2)	119.2490	0.000	1	119.2490	0.000	1	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]CC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H){1|C<4>,4|C<3>}	C[6](C[6]C[6]CC)(C[6]C[6]H)(H){1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	117.6410	0.000	1	117.6410	0.000	1	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C[6a])(C[6]C[6]H)(H){1|P<4>,2|H<1>,3|C<3>}	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H){1|O<2>,2|C<3>}	H(C[6]C[6]2)	118.0560	0.000	1	118.0560	0.000	1	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){2|C<4>,3|H<1>}	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	117.8990	0.000	1	117.8990	0.000	1	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]HO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|H<1>,1|O<2>,2|C<4>}	C[6](C[6]C[5,6]HO)(C[6]C[6]H)(H){1|C<3>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.8233	0.289	6	119.8233	0.083	6	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]NdH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Nd<19>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]NdH)(C[6]C[6]H)(H){1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.9910	0.000	1	119.9910	0.000	1	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]Os2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Os<5>,1|Os<6>,1|C<3>,1|C<4>}	C[6](C[6]C[5,6]Os2)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	117.3055	0.012	2	117.3055	0.000	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]Ru2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ru<5>,1|Ru<7>,1|C<3>,1|C<4>}	C[6](C[6]C[5,6]Ru2)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	118.5855	0.260	2	118.5855	0.067	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]O)(C[6]C[6]H)(H)	C[6](C[6]C[5,5,6]CH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]O)(C[6]C[6]H)(H){1|H<1>,4|C<4>}	C[6](C[6]C[5,5,6]CH)(C[6]C[6]H)(H){1|O<1>,3|C<4>}	H(C[6]C[6]2)	118.9480	0.130	2	118.9480	0.017	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]O)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]HO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]O)(C[6]C[6]H)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]HO)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,1|O<1>}	H(C[6]C[6]2)	119.1325	0.390	2	119.1325	0.152	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[5]C[6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H){1|C<3>,1|N<3>,2|C<4>,2|H<1>}	C[6](C[6]C[5]C[6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	118.1720	0.123	2	118.1720	0.015	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6a]O[6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>,1|O<2>,2|S<2>}	C[6](C[6]C[6a]O[6]H)(C[6]C[6]H)(H){4|C<3>}	H(C[6]C[6]2)	118.8170	0.150	2	118.8170	0.022	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]O)(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]OO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]O)(C[6]C[6]H)(H){2|C<3>,2|O<2>}	C[6](C[6]C[5a,6]OO)(C[6]C[6]H)(H){1|C<3>,1|O<1>,1|O<2>}	H(C[6]C[6]2)	118.1565	0.073	2	118.1565	0.005	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]Li2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Li<4>,1|Li<5>,1|C<3>,1|C<4>}	C[6](C[6]C[6,6]Li2)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<3>}	H(C[6]C[6]2)	120.2810	0.000	1	120.0420	0.114	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]Li2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Li<4>,1|Li<5>,2|C<4>}	C[6](C[6]C[6,6]Li2)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<3>}	H(C[6]C[6]2)	119.8030	0.000	1	120.0420	0.114	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]TiO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Ti<12>,1|C<3>,1|C<4>,1|O<2>}	C[6](C[6]C[6,6]TiO)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	118.1430	0.586	5	118.4283	0.426	8	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]TiO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Ti<8>,1|C<3>,1|C<4>,1|O<2>}	C[6](C[6]C[6,6]TiO)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	118.3170	0.000	1	118.4283	0.426	8	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]TiO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Ti<9>,1|O<2>,2|C<3>}	C[6](C[6]C[6,6]TiO)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.1970	0.092	2	118.4283	0.426	8	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H)	C[6](C[6]C[3,6,6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H){2|H<1>,3|C<4>}	C[6](C[6]C[3,6,6]HH)(C[6]C[6]H)(H){1|O<1>,1|O<2>,2|C<4>}	H(C[6]C[6]2)	125.0355	1.488	2	125.0355	2.216	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H)	C[6](C[6]C[3,6,6]HO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H){1|H<1>,1|O<2>,3|C<4>}	C[6](C[6]C[3,6,6]HO)(C[6]C[6]H)(H){1|O<1>,1|O<2>,2|C<4>}	H(C[6]C[6]2)	118.7840	0.000	1	118.7840	0.000	1	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]CC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H){1|H<1>,4|C<4>}	C[6](C[6]C[6,6]CC)(C[6]C[6]H)(H){1|H<1>,1|O<1>,2|C<4>}	H(C[6]C[6]2)	119.5790	0.000	1	118.5470	0.808	3	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]CC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H){5|C<4>}	C[6](C[6]C[6,6]CC)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	118.1280	0.000	1	118.5470	0.808	3	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]CC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H){5|C<4>}	C[6](C[6]C[6,6]CC)(C[6]C[6]H)(H){1|H<1>,1|O<1>,2|C<4>}	H(C[6]C[6]2)	117.9340	0.000	1	118.5470	0.808	3	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]CO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H){1|O<2>,4|C<4>}	C[6](C[6]C[6,6]CO)(C[6]C[6]H)(H){1|H<1>,1|O<1>,2|C<4>}	H(C[6]C[6]2)	118.4210	0.000	1	118.4210	0.000	1	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H){1|C<3>,1|C<4>,2|H<1>}	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.1880	0.000	1	119.5408	0.231	6	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H){2|C<4>,3|H<1>}	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	119.5253	0.152	3	119.5408	0.231	6	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H){2|C<4>,3|H<1>}	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H){1|H<1>,1|O<1>,2|C<4>}	H(C[6]C[6]2)	118.7360	0.000	1	119.5408	0.231	6	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H){2|H<1>,3|C<4>}	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H){1|H<1>,1|O<1>,2|C<4>}	H(C[6]C[6]2)	119.7450	0.000	1	119.5408	0.231	6	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]OO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H){2|C<3>,2|O<2>}	C[6](C[6]C[6,6]OO)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<1>}	H(C[6]C[6]2)	119.7070	0.000	1	119.7070	0.000	1	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H)	C[6](C[6]C[6]CC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H){5|C<4>}	C[6](C[6]C[6]CC)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	118.2100	0.000	1	118.4280	0.149	3	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H)	C[6](C[6]C[6]CC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H){5|C<4>}	C[6](C[6]C[6]CC)(C[6]C[6]H)(H){1|C<4>,1|O<1>,2|H<1>}	H(C[6]C[6]2)	118.2010	0.000	1	118.4280	0.149	3	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H)	C[6](C[6]C[6]CC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H){5|C<4>}	C[6](C[6]C[6]CC)(C[6]C[6]H)(H){1|H<1>,1|O<1>,2|C<4>}	H(C[6]C[6]2)	118.8730	0.000	1	118.4280	0.149	3	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]AgH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H){1|Ag<5>,1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]AgH)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.8200	0.000	1	119.8200	0.000	1	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]C[6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H){1|H<1>,3|C<3>}	C[6](C[6]C[6,6a]C[6]H)(C[6]C[6]H)(H){1|H<1>,4|C<3>}	H(C[6]C[6]2)	120.2190	0.110	2	120.2190	0.012	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H){2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]HH)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3800	0.000	1	120.3800	0.000	1	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]Li2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H){2|Li<4>,2|C<3>}	C[6](C[6]C[6,6a]Li2)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.1920	0.000	1	120.1920	0.000	1	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]OO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(H){2|C<3>,2|O<2>}	C[6](C[6]C[6,6a]OO)(C[6]C[6]H)(H){1|O<1>,2|C<3>}	H(C[6]C[6]2)	118.5550	0.000	1	118.5550	0.000	1	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]B)(C[6]C[6]H)(H)	C[6](C[6]C[6]ScH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]B)(C[6]C[6]H)(H){1|Sc<13>,1|C<4>,1|H<1>,1|H<2>}	C[6](C[6]C[6]ScH)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4460	0.000	1	120.4460	0.000	1	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]B)(C[6]C[6]H)(H)	C[6](C[6]C[6]TiH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]B)(C[6]C[6]H)(H){1|Ti<12>,1|C<4>,2|H<1>}	C[6](C[6]C[6]TiH)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	118.6620	0.000	1	118.6620	0.000	1	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[5]C[6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){2|C<3>,2|H<1>}	C[6](C[6]C[5]C[6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	H(C[6]C[6]2)	118.3580	0.069	2	118.3580	0.005	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]2Ta)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Ta<10>,1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]2Ta)(C[6]C[6]H)(H){1|C<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.5370	0.272	2	119.5370	0.074	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]AlH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Al<4>,1|C<3>,2|H<1>}	C[6](C[6]C[6]AlH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.1360	1.297	3	120.1360	1.683	3	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]BH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>,1|P<4>}	C[6](C[6]C[6]BH)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	118.8740	0.000	1	118.8740	0.000	1	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]CC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[6]CC)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.5655	0.185	2	119.5655	0.034	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|C<4>,2|H<1>}	C[6](C[6]C[6]CH)(C[6]C[6]H)(H){1|C<3>,2|C<4>}	H(C[6]C[6]2)	119.5970	0.000	1	118.7335	0.383	4	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|C<4>,2|H<1>}	C[6](C[6]C[6]CH)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	118.5465	0.305	2	118.7335	0.383	4	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){2|C<4>,3|H<1>}	C[6](C[6]C[6]CH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	118.2440	0.000	1	118.7335	0.383	4	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]ErN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Er<10>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]ErN)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	119.3035	0.574	4	119.3035	0.329	4	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]Fe2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){2|Fe<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]Fe2)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.4737	0.122	11	119.4737	0.015	11	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,3|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.7145	0.274	2	119.9860	5.415	4	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<4>,3|C<3>}	H(C[6]C[6]2)	123.0750	0.000	1	119.9860	5.415	4	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){2|C<4>,2|H<1>}	H(C[6]C[6]2)	117.4400	0.000	1	119.9860	5.415	4	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]HO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,2|H<1>,2|O<2>}	C[6](C[6]C[6]HO)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.5310	0.000	1	120.5310	0.000	1	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]HP)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|P<4>,2|H<1>}	C[6](C[6]C[6]HP)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	118.3540	0.139	2	118.3540	0.019	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]Li2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){2|Li<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]Li2)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.6175	0.029	2	119.6175	0.001	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]LiTi)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Li<6>,1|Ti<9>,1|C<4>}	C[6](C[6]C[6]LiTi)(C[6]C[6]H)(H){1|C<2>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	124.1160	0.000	1	124.1160	0.000	1	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]MoSi)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Mo<10>,1|Si<4>,1|C<4>,1|H<1>}	C[6](C[6]C[6]MoSi)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.1320	0.000	1	119.1320	0.000	1	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]NU)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|U<11>,1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]NU)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	118.9750	0.092	2	118.9750	0.008	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]NV)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>,1|V<8>}	C[6](C[6]C[6]NV)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.3035	0.097	2	119.4402	0.021	6	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]NV)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<4>,1|V<9>}	C[6](C[6]C[6]NV)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	119.5085	0.116	4	119.4402	0.021	6	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]Ni2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Ni<3>,1|Ni<4>,1|C<4>,1|H<1>}	C[6](C[6]C[6]Ni2)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.0480	0.000	1	119.0480	0.000	1	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]NiH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Ni<4>,1|C<4>,2|H<1>}	C[6](C[6]C[6]NiH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.6850	0.000	1	119.6850	0.000	1	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]OV)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>,1|V<6>}	C[6](C[6]C[6]OV)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<4>}	H(C[6]C[6]2)	123.3990	0.000	1	121.2570	9.176	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]OV)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>,1|V<8>}	C[6](C[6]C[6]OV)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	H(C[6]C[6]2)	119.1150	0.000	1	121.2570	9.176	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]PdC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Pd<6>,1|H<1>,2|C<4>}	C[6](C[6]C[6]PdC)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	118.9010	0.000	1	118.9010	0.000	1	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]PdH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Pd<4>,1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]PdH)(C[6]C[6]H)(H){1|C<3>,2|C<4>}	H(C[6]C[6]2)	119.2790	0.000	1	119.2790	0.000	1	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]ScN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Sc<9>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]ScN)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|P<4>}	H(C[6]C[6]2)	119.1810	0.000	1	119.1810	0.000	1	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]SiW)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Si<4>,1|W<10>,1|C<4>,1|H<1>}	C[6](C[6]C[6]SiW)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	118.7880	0.000	1	118.7880	0.000	1	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]TaO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Ta<13>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]TaO)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|S<3>}	H(C[6]C[6]2)	118.5490	0.279	2	118.6747	0.086	3	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]TaO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Ta<7>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]TaO)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	118.9260	0.000	1	118.6747	0.086	3	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]ThN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Th<14>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]ThN)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<2>}	H(C[6]C[6]2)	118.9800	0.000	1	119.2350	0.090	3	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]ThN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Th<16>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]ThN)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.3625	0.286	2	119.2350	0.090	3	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]TiC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Ti<11>,1|H<1>,2|C<4>}	C[6](C[6]C[6]TiC)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<2>}	H(C[6]C[6]2)	118.6450	0.000	1	118.6450	0.000	1	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]TiN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Ti<6>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]TiN)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|P<3>}	H(C[6]C[6]2)	119.9100	0.000	1	118.6587	1.822	10	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]TiN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Ti<7>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]TiN)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|P<4>}	H(C[6]C[6]2)	116.9323	1.284	3	118.6587	1.822	10	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]TiN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Ti<8>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]TiN)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.3190	0.088	4	118.6587	1.822	10	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]TiN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Ti<9>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]TiN)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.3020	0.027	2	118.6587	1.822	10	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]TiO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Ti<8>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]TiO)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|S<3>}	H(C[6]C[6]2)	119.1220	0.000	1	119.1220	0.000	1	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]YbN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Yb<10>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]YbN)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	119.3487	0.293	8	119.3487	0.086	8	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]ZrN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Zr<13>,1|C<3>,1|N<3>}	C[6](C[6]C[6]ZrN)(C[6]C[6]H)(H){1|C<2>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.0260	0.000	1	119.0260	0.000	1	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6a]N[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6a]N[6]C)(C[6]C[6]H)(H){1|C<4>,4|C<3>}	H(C[6]C[6]2)	119.7650	0.182	3	119.7650	0.033	3	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]N[6]CH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|N<3>,2|H<1>}	C[6](C[6]N[6]CH)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	H(C[6]C[6]2)	119.7840	0.000	1	119.7840	0.000	1	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]N[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,4|H<1>}	C[6](C[6]N[6]HH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|S<4>}	H(C[6]C[6]2)	119.0360	0.000	1	119.0360	0.000	1	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]N[6]IrO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Ir<9>,1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]N[6]IrO)(C[6]C[6]H)(H){1|C<3>,1|C<4>}	H(C[6]C[6]2)	120.3370	0.000	1	120.3370	0.000	1	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	C[6](C[6]N[6]ErN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|Er<15>,1|H<1>,2|N<3>}	C[6](C[6]N[6]ErN)(C[6]C[6]H)(H){1|Cl<1>,1|C<3>}	H(C[6]C[6]2)	120.2840	0.000	1	120.2840	0.000	1	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	C[6](C[6]N[6]NY)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|Y<15>,1|H<1>,2|N<3>}	C[6](C[6]N[6]NY)(C[6]C[6]H)(H){1|Cl<1>,1|C<3>}	H(C[6]C[6]2)	120.3490	0.000	1	120.3490	0.000	1	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]HN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|N<3>,2|H<1>}	C[6](C[6]C[6]HN)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	119.1610	0.137	2	119.1610	0.019	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[5,6]CH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]CH)(C[6]C[6]H)(H){1|C<3>,1|O<1>,2|C<4>}	H(C[6]C[6]2)	119.6640	0.000	1	119.6640	0.000	1	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]2C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){5|C<4>}	C[6](C[6]C[6]2C)(C[6]C[6]H)(H){1|C<3>,1|O<1>,2|H<1>,3|C<4>}	H(C[6]C[6]2)	118.6320	0.549	3	118.6320	0.301	3	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]2Ru)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Ru<10>,1|H<1>,2|C<4>}	C[6](C[6]C[6]2Ru)(C[6]C[6]H)(H){1|O<2>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	119.6995	0.057	2	119.6995	0.003	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]CC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|S<2>,3|C<4>}	C[6](C[6]C[6]CC)(C[6]C[6]H)(H){1|C<4>,2|O<1>}	H(C[6]C[6]2)	117.9910	0.000	1	118.5090	0.145	8	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]CC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|H<1>,4|C<4>}	C[6](C[6]C[6]CC)(C[6]C[6]H)(H){1|C<4>,1|O<1>,2|H<1>}	H(C[6]C[6]2)	118.4108	0.216	5	118.5090	0.145	8	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]CC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){2|H<1>,3|C<4>}	C[6](C[6]C[6]CC)(C[6]C[6]H)(H){1|H<1>,1|O<1>,2|C<4>}	H(C[6]C[6]2)	119.0480	0.000	1	118.5090	0.145	8	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]CC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){5|C<4>}	C[6](C[6]C[6]CC)(C[6]C[6]H)(H){1|H<1>,1|O<1>,2|C<4>}	H(C[6]C[6]2)	118.9790	0.000	1	118.5090	0.145	8	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]CN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|H<1>,1|N<2>}	C[6](C[6]C[6]CN)(C[6]C[6]H)(H){1|Br<1>,1|C<3>,1|O<1>}	H(C[6]C[6]2)	122.4030	0.000	1	120.5338	2.144	5	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]CN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]CN)(C[6]C[6]H)(H){1|Br<1>,1|C<3>,1|O<1>}	H(C[6]C[6]2)	120.2980	0.000	1	120.5338	2.144	5	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]CN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]CN)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	119.1630	0.204	2	120.5338	2.144	5	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]CN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]CN)(C[6]C[6]H)(H){1|Br<1>,1|C<2>,1|O<1>}	H(C[6]C[6]2)	121.6420	0.000	1	120.5338	2.144	5	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]CO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|H<1>,1|O<2>}	C[6](C[6]C[6]CO)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	119.3660	0.105	2	119.9278	0.899	5	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]CO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|O<2>,2|C<4>}	C[6](C[6]C[6]CO)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	121.3800	0.000	1	119.9278	0.899	5	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]CO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[6]C[6]CO)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	119.1340	0.000	1	119.9278	0.899	5	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]CO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Si<4>,1|C<3>,1|C<4>,1|O<2>}	C[6](C[6]C[6]CO)(C[6]C[6]H)(H){1|C<3>,1|O<1>,1|O<2>}	H(C[6]C[6]2)	120.3930	0.000	1	119.9278	0.899	5	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,3|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|H<1>,1|O<1>,2|C<4>}	H(C[6]C[6]2)	118.4700	0.000	1	120.0258	2.510	8	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<4>,1|O<1>,2|H<1>}	H(C[6]C[6]2)	121.1570	0.349	2	120.0258	2.510	8	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<4>,1|O<2>,2|H<1>}	H(C[6]C[6]2)	122.7220	0.000	1	120.0258	2.510	8	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Si<4>,1|C<4>,3|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<4>,1|O<1>,2|H<1>}	H(C[6]C[6]2)	120.1780	0.000	1	120.0258	2.510	8	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){2|C<4>,3|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<4>,1|O<1>,2|H<1>}	H(C[6]C[6]2)	119.0100	0.890	2	120.0258	2.510	8	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){2|H<1>,3|C<4>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<4>,1|O<1>,2|H<1>}	H(C[6]C[6]2)	118.5020	0.000	1	120.0258	2.510	8	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]HN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<4>,1|N<3>,3|H<1>}	C[6](C[6]C[6]HN)(C[6]C[6]H)(H){1|C<4>,1|O<1>,2|H<1>}	H(C[6]C[6]2)	118.9570	0.000	1	118.9180	0.003	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]HN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|H<1>,1|N<3>,1|O<2>,2|C<4>}	C[6](C[6]C[6]HN)(C[6]C[6]H)(H){1|H<1>,1|O<1>,2|C<4>}	H(C[6]C[6]2)	118.8790	0.000	1	118.9180	0.003	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]HO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<4>,1|O<2>,3|H<1>}	C[6](C[6]C[6]HO)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<1>,1|O<2>}	H(C[6]C[6]2)	119.4620	0.000	1	119.1242	0.074	5	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]HO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|H<1>,2|C<4>,2|O<2>}	C[6](C[6]C[6]HO)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<1>,1|O<2>}	H(C[6]C[6]2)	119.1097	0.217	3	119.1242	0.074	5	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]HO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[6]C[6]HO)(C[6]C[6]H)(H){1|H<1>,1|O<1>,2|C<4>}	H(C[6]C[6]2)	118.8300	0.000	1	119.1242	0.074	5	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]NY)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Y<14>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]NY)(C[6]C[6]H)(H){1|C<3>,1|H<2>,1|O<2>}	H(C[6]C[6]2)	119.2840	0.000	1	119.2840	0.000	1	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]Ni2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Ni<3>,1|Ni<4>,1|C<4>,1|H<1>}	C[6](C[6]C[6]Ni2)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.9950	0.000	1	119.9950	0.000	1	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]OO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,2|O<2>}	C[6](C[6]C[6]OO)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.9850	0.000	1	119.9850	0.000	1	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]RuC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Ru<7>,1|H<1>,2|C<4>}	C[6](C[6]C[6]RuC)(C[6]C[6]H)(H){1|Ru<5>,1|C<3>,1|O<2>}	H(C[6]C[6]2)	119.7000	0.000	1	119.7000	0.000	1	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]TaN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Ta<12>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]TaN)(C[6]C[6]H)(H){1|C<3>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	119.5390	0.055	2	119.5390	0.003	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]TiN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Ti<10>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]TiN)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.8970	0.426	2	119.8970	0.181	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6a]2C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|H<1>,2|C<3>,2|C<4>}	C[6](C[6]C[6a]2C[6])(C[6]C[6]H)(H){1|C<4>,1|O<1>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.0020	0.000	1	118.9040	0.019	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6a]2C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Se<2>,3|C<3>}	C[6](C[6]C[6a]2C[6])(C[6]C[6]H)(H){1|H<1>,1|O<1>,5|C<3>}	H(C[6]C[6]2)	118.8060	0.000	1	118.9040	0.019	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6a]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[6a]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<1>,3|C<3>}	H(C[6]C[6]2)	123.5595	3.818	2	122.1190	7.771	4	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6a]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<4>,1|H<1>,2|C<3>}	C[6](C[6]C[6a]C[6]C)(C[6]C[6]H)(H){1|H<1>,1|O<1>,3|C<3>}	H(C[6]C[6]2)	120.6785	0.663	2	122.1190	7.771	4	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]N[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|N<3>,3|H<1>}	C[6](C[6]N[6]HH)(C[6]C[6]H)(H){1|C<4>,1|O<1>,1|S<4>}	H(C[6]C[6]2)	119.2840	0.000	1	119.2840	0.000	1	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]N[6]HO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|N<3>,1|O<2>,2|H<1>}	C[6](C[6]N[6]HO)(C[6]C[6]H)(H){1|C<4>,1|O<1>,1|S<4>}	H(C[6]C[6]2)	118.6500	0.000	1	118.6500	0.000	1	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]O[6]HO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<4>,2|H<1>,2|O<2>}	C[6](C[6]O[6]HO)(C[6]C[6]H)(H){1|C<4>,1|O<1>}	H(C[6]C[6]2)	119.6070	0.000	1	119.6070	0.000	1	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]MoH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mo<7>,1|C<4>,1|H<1>}	C[6](C[6]C[6]MoH)(C[6]C[6]H)(H){1|C<4>,1|N<2>,1|P<4>}	H(C[6]C[6]2)	120.2570	0.000	1	120.2570	0.000	1	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.2550	0.000	1	120.1660	0.016	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|N<2>,2|H<1>}	H(C[6]C[6]2)	120.0770	0.000	1	120.1660	0.016	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]RhH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<8>,1|C<4>,1|H<1>}	C[6](C[6]C[6]RhH)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	122.4220	0.000	1	122.4220	0.000	1	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]ZrO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zr<16>,1|O<2>,2|C<4>}	C[6](C[6]C[6]ZrO)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	119.6233	0.064	3	119.6233	0.004	3	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]CC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<4>,1|C<3>,2|C<4>}	C[6](C[6]C[6]CC)(C[6]C[6]H)(H){1|N<2>,2|N<3>}	H(C[6]C[6]2)	120.7225	0.073	2	120.7225	0.005	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|N<2>,2|N<3>}	H(C[6]C[6]2)	120.6060	0.000	1	120.6060	0.000	1	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](C[6]C[6a]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,3|C<4>}	C[6](C[6]C[6a]C[6]C)(C[6]C[6]H)(H){1|N<2>,1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.4575	0.357	2	119.4575	0.128	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|C<3>,1|C<4>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,1|O<1>}	H(C[6]C[6]2)	119.5070	0.000	1	119.2100	0.176	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|C<4>,1|S<4>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>,1|O<1>}	H(C[6]C[6]2)	118.9130	0.000	1	119.2100	0.176	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	C[6](C[6]C[6a]C[6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[6a]C[6]H)(C[6]C[6]H)(H){1|N<3>,1|O<1>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0403	0.289	3	120.0403	0.084	3	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]O[6]O)(H)	C[6](C[6]C[6]FF)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]O[6]O)(H){1|C<4>,2|F<1>}	C[6](C[6]C[6]FF)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<1>,1|O<2>}	H(C[6]C[6]2)	119.9140	0.000	1	119.9140	0.000	1	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]O[6]O)(H)	C[6](C[6]C[6]FH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]O[6]O)(H){1|C<4>,1|F<1>,1|H<1>}	C[6](C[6]C[6]FH)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>,1|O<2>}	H(C[6]C[6]2)	119.6915	0.028	2	119.6915	0.001	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]O[6]O)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]O[6]O)(H){1|C<4>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<1>,1|O<2>}	H(C[6]C[6]2)	119.5697	0.251	7	119.5697	0.063	7	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]O[6]O)(H)	C[6](C[6]C[6]HO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]O[6]O)(H){1|C<4>,1|H<1>,1|O<2>}	C[6](C[6]C[6]HO)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>,1|O<2>}	H(C[6]C[6]2)	119.4630	0.000	1	121.0210	4.855	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]O[6]O)(H)	C[6](C[6]C[6]HO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]O[6]O)(H){1|C<4>,1|H<1>,1|O<2>}	C[6](C[6]C[6]HO)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<1>,1|O<2>}	H(C[6]C[6]2)	122.5790	0.000	1	121.0210	4.855	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]B[6]PtH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Pt<6>,1|B<4>,2|H<1>}	C[6](C[6]B[6]PtH)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<4>}	H(C[6]C[6]2)	119.0917	0.110	3	119.0917	0.012	3	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[3x3,4,3x5,14x6]C[4,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|C<5>,2|H<1>}	C[6](C[6]C[3x3,4,3x5,14x6]C[4,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|C<6>,1|H<1>,4|B<6>}	H(C[6]C[6]2)	119.9770	0.000	1	119.9770	0.000	1	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[4]C[6]Ni)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ni<5>,1|H<1>,2|C<4>}	C[6](C[6]C[4]C[6]Ni)(C[6]C[6]H)(H){1|C<4>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.5905	0.009	2	119.5905	0.000	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5,6]HO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|O<2>,2|H<1>}	C[6](C[6]C[5,6]HO)(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.1290	0.000	1	120.1290	0.000	1	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]C[6]Dy)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Dy<11>,1|C<3>,2|C<4>}	C[6](C[6]C[5]C[6]Dy)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	119.6250	0.000	1	119.6250	0.000	1	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]C[6]Pd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Pd<5>,1|H<1>,2|C<4>}	C[6](C[6]C[5]C[6]Pd)(C[6]C[6]H)(H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.7370	0.000	1	119.7370	0.000	1	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]C[6]Yb)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Yb<15>,1|H<1>,2|C<4>}	C[6](C[6]C[5]C[6]Yb)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|H<2>,1|N<3>,1|P<3>}	H(C[6]C[6]2)	119.8460	0.000	1	119.8460	0.000	1	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]C[6]Zr)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Zr<13>,1|C<3>,1|C<5>,1|H<1>}	C[6](C[6]C[5]C[6]Zr)(C[6]C[6]H)(H){1|C<3>,1|H<1>,3|C<4>}	H(C[6]C[6]2)	119.6230	0.000	1	119.6230	0.000	1	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5]N[6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[5]N[6]H)(C[6]C[6]H)(H){1|Re<6>,1|C<3>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	119.3900	0.000	1	119.3900	0.000	1	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[5x3,5x5,20x6]C[4,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|C<6>,2|H<1>}	C[6](C[6]C[5x3,5x5,20x6]C[4,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,2|C<6>,4|B<6>}	H(C[6]C[6]2)	119.9390	0.000	1	119.9390	0.000	1	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]2C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,3|C<4>}	C[6](C[6]C[6]2C)(C[6]C[6]H)(H){1|C<3>,3|C<4>,3|H<1>}	H(C[6]C[6]2)	119.9100	0.000	1	119.9100	0.000	1	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]2Co)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Co<8>,1|H<1>,2|C<4>}	C[6](C[6]C[6]2Co)(C[6]C[6]H)(H){1|Ni<7>,1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.9550	0.150	4	119.9550	0.023	4	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]2Li)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Li<5>,1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]2Li)(C[6]C[6]H)(H){1|Ni<7>,1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.8710	0.000	1	120.0550	0.025	3	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]2Li)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Li<6>,1|H<1>,2|C<4>}	C[6](C[6]C[6]2Li)(C[6]C[6]H)(H){1|Ni<7>,1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.1470	0.006	2	120.0550	0.025	3	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]2Mn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Mn<8>,1|H<1>,2|C<4>}	C[6](C[6]C[6]2Mn)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>,2|C<4>}	H(C[6]C[6]2)	120.3641	0.282	8	120.4386	0.059	14	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]2Mn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Mn<8>,1|H<1>,2|C<4>}	C[6](C[6]C[6]2Mn)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.5378	0.151	6	120.4386	0.059	14	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]2Ni)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ni<8>,1|H<1>,2|C<4>}	C[6](C[6]C[6]2Ni)(C[6]C[6]H)(H){1|Ni<7>,1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.8130	0.274	4	119.8270	0.068	6	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]2Ni)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ni<9>,1|H<1>,2|C<4>}	C[6](C[6]C[6]2Ni)(C[6]C[6]H)(H){1|Ni<7>,1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.8550	0.337	2	119.8270	0.068	6	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]2Pr)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Pr<17>,1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]2Pr)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|H<2>,2|C<4>}	H(C[6]C[6]2)	118.4870	0.000	1	118.4870	0.000	1	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]2Re)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Re<8>,1|H<1>,2|C<4>}	C[6](C[6]C[6]2Re)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>,2|C<4>}	H(C[6]C[6]2)	120.0365	0.805	2	120.1310	0.351	3	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]2Re)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Re<8>,1|H<1>,2|C<4>}	C[6](C[6]C[6]2Re)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.3200	0.000	1	120.1310	0.351	3	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]2Ta)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ta<10>,1|C<4>,2|C<3>}	C[6](C[6]C[6]2Ta)(C[6]C[6]H)(H){1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.5050	0.000	1	120.5050	0.000	1	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]2Zr)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Zr<14>,1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]2Zr)(C[6]C[6]H)(H){1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.9980	0.378	2	119.9980	0.143	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]Al2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){2|Al<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]Al2)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.2030	0.000	1	120.2030	0.000	1	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]AlH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Al<4>,1|C<3>,2|H<1>}	C[6](C[6]C[6]AlH)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.9595	0.050	2	120.1403	0.047	7	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]AlH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Al<7>,1|C<3>,1|H<1>,1|H<2>}	C[6](C[6]C[6]AlH)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1532	0.196	4	120.1403	0.047	7	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]AlH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Al<7>,1|C<3>,1|H<2>}	C[6](C[6]C[6]AlH)(C[6]C[6]H)(H){1|C<2>,2|H<1>}	H(C[6]C[6]2)	120.4500	0.000	1	120.1403	0.047	7	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]BaH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ba<10>,1|C<4>,2|H<1>}	C[6](C[6]C[6]BaH)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.0520	0.000	1	121.0520	0.000	1	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]BaN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ba<10>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]BaN)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.0510	0.000	1	119.0510	0.000	1	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]CC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,3|C<4>}	C[6](C[6]C[6]CC)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.2240	0.000	1	119.3920	0.021	3	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]CC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,3|C<3>}	C[6](C[6]C[6]CC)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.4760	0.000	2	119.3920	0.021	3	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<2>,1|C<3>,2|H<1>}	C[6](C[6]C[6]CH)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9875	0.057	2	119.9099	0.611	8	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,2|H<1>}	C[6](C[6]C[6]CH)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.0925	0.182	2	119.9099	0.611	8	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,2|H<1>}	C[6](C[6]C[6]CH)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	121.5710	0.000	1	119.9099	0.611	8	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){2|C<4>,2|H<1>}	C[6](C[6]C[6]CH)(C[6]C[6]H)(H){1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	120.1180	0.000	1	119.9099	0.611	8	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){2|C<4>,2|H<1>}	C[6](C[6]C[6]CH)(C[6]C[6]H)(H){1|C<3>,3|H<1>}	H(C[6]C[6]2)	119.7150	0.110	2	119.9099	0.611	8	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]CO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|H<1>,1|O<2>}	C[6](C[6]C[6]CO)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	119.6790	0.168	2	119.6160	0.026	3	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]CO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|O<2>,2|C<4>}	C[6](C[6]C[6]CO)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	119.4900	0.000	1	119.6160	0.026	3	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]CU)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|U<11>,1|H<1>,2|C<4>}	C[6](C[6]C[6]CU)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.4915	0.030	2	119.1263	0.167	6	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]CU)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|U<22>,3|C<4>}	C[6](C[6]C[6]CU)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|H<2>}	H(C[6]C[6]2)	118.9437	0.380	4	119.1263	0.167	6	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]CW)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|W<12>,1|H<1>,2|C<4>}	C[6](C[6]C[6]CW)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.8487	0.098	6	119.8487	0.010	6	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]CY)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Y<10>,1|H<1>,2|C<4>}	C[6](C[6]C[6]CY)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|H<2>}	H(C[6]C[6]2)	120.1480	0.000	1	119.6022	0.185	4	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]CY)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Y<17>,1|H<1>,2|C<4>}	C[6](C[6]C[6]CY)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|H<2>}	H(C[6]C[6]2)	119.4203	0.280	3	119.6022	0.185	4	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]CaC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ca<12>,1|C<4>,1|C<5>,1|H<1>}	C[6](C[6]C[6]CaC)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.2490	0.171	2	118.2813	2.824	3	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]CaC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ca<8>,1|H<1>,2|C<4>}	C[6](C[6]C[6]CaC)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	116.3460	0.000	1	118.2813	2.824	3	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]CaH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ca<12>,1|C<4>,2|H<1>}	C[6](C[6]C[6]CaH)(C[6]C[6]H)(H){1|C<3>,1|C<5>,1|H<1>}	H(C[6]C[6]2)	120.7320	0.204	2	121.6287	2.433	3	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]CaH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ca<8>,1|C<4>,2|H<1>}	C[6](C[6]C[6]CaH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	123.4220	0.000	1	121.6287	2.433	3	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]CeC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ce<18>,1|H<1>,2|C<4>}	C[6](C[6]C[6]CeC)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|H<2>}	H(C[6]C[6]2)	119.0660	0.078	3	119.0660	0.006	3	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]CeF)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ce<22>,1|C<4>,1|F<2>,1|H<1>}	C[6](C[6]C[6]CeF)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5567	0.090	3	120.5567	0.008	3	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]CeH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ce<13>,1|C<4>,1|H<1>,1|H<2>}	C[6](C[6]C[6]CeH)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8660	0.000	1	120.8812	0.036	4	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]CeH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ce<18>,1|C<4>,1|H<1>,1|H<2>}	C[6](C[6]C[6]CeH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.8863	0.232	3	120.8812	0.036	4	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]CeN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ce<13>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]CeN)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|H<2>}	H(C[6]C[6]2)	119.1290	0.000	1	119.2223	0.017	4	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]CeN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ce<22>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]CeN)(C[6]C[6]H)(H){1|C<3>,1|F<2>,1|H<1>}	H(C[6]C[6]2)	119.2533	0.140	3	119.2223	0.017	4	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]ClZr)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Zr<14>,1|Cl<2>,1|C<3>,1|H<1>}	C[6](C[6]C[6]ClZr)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9035	0.111	2	119.9035	0.012	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]CoB)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Co<6>,1|B<4>,1|C<4>,1|H<1>}	C[6](C[6]C[6]CoB)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.6400	0.000	1	119.6400	0.000	1	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]CoC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Co<5>,3|C<4>}	C[6](C[6]C[6]CoC)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.6100	0.000	1	119.6100	0.000	1	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]CoH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Co<6>,1|C<4>,2|H<1>}	C[6](C[6]C[6]CoH)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0800	0.000	1	120.0800	0.000	1	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]CoNi)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Co<8>,1|Ni<7>,1|C<4>,1|H<1>}	C[6](C[6]C[6]CoNi)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.4650	0.118	4	119.4650	0.014	4	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]CrC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Cr<5>,1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]CrC)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7755	0.439	2	120.0256	4.376	7	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]CrC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Cr<5>,3|C<4>}	C[6](C[6]C[6]CrC)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.0593	2.933	4	120.0256	4.376	7	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]CrC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Cr<6>,3|C<4>}	C[6](C[6]C[6]CrC)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3910	0.000	1	120.0256	4.376	7	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]CrH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Cr<6>,1|C<4>,2|H<1>}	C[6](C[6]C[6]CrH)(C[6]C[6]H)(H){1|Si<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0830	0.000	1	120.0490	0.002	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]CrH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Cr<7>,1|C<4>,2|H<1>}	C[6](C[6]C[6]CrH)(C[6]C[6]H)(H){1|Si<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0150	0.000	1	120.0490	0.002	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]CrN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Cr<6>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]CrN)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.5355	0.049	2	119.5355	0.002	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]CrO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Cr<8>,1|C<3>,1|H<1>,1|O<3>}	C[6](C[6]C[6]CrO)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.5280	0.066	3	119.5280	0.004	3	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]CrSi)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Cr<6>,1|Si<5>,1|C<4>,1|H<1>}	C[6](C[6]C[6]CrSi)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8510	0.000	1	119.8955	0.004	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]CrSi)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Cr<7>,1|Si<5>,1|C<4>,1|H<1>}	C[6](C[6]C[6]CrSi)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9400	0.000	1	119.8955	0.004	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]Cu2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){2|Cu<2>,1|C<3>,1|H<1>}	C[6](C[6]C[6]Cu2)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0425	0.204	2	120.0425	0.042	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]CuB)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Cu<5>,1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]CuB)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.7250	0.095	2	120.0239	0.188	9	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]CuB)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Cu<6>,1|B<4>,1|C<4>,1|H<1>}	C[6](C[6]C[6]CuB)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8236	0.196	7	120.0239	0.188	9	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]CuC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Cu<4>,1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]CuC)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8632	0.041	4	119.8632	0.002	4	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]CuH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Cu<4>,1|C<3>,2|H<1>}	C[6](C[6]C[6]CuH)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.2450	0.000	1	120.9419	3.884	15	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]CuH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Cu<4>,1|C<4>,2|H<1>}	C[6](C[6]C[6]CuH)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7812	0.091	4	120.9419	3.884	15	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]CuH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Cu<4>,1|C<4>,2|H<1>}	C[6](C[6]C[6]CuH)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.2100	0.000	1	120.9419	3.884	15	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]CuH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Cu<5>,1|C<4>,1|H<1>}	C[6](C[6]C[6]CuH)(C[6]C[6]H)(H){1|C<2>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	125.7310	0.000	2	120.9419	3.884	15	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]CuH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Cu<6>,1|C<4>,2|H<1>}	C[6](C[6]C[6]CuH)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4410	0.231	7	120.9419	3.884	15	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]DyH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Dy<16>,1|B<4>,1|C<4>,1|H<1>}	C[6](C[6]C[6]DyH)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|H<2>}	H(C[6]C[6]2)	119.5000	0.096	4	119.5000	0.009	4	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]DyN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Dy<15>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]DyN)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.0390	0.000	1	120.0390	0.000	1	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]DyO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Dy<11>,1|C<3>,1|C<4>,1|O<3>}	C[6](C[6]C[6]DyO)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.8220	0.201	2	119.6338	0.303	5	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]DyO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Dy<15>,1|C<4>,1|H<1>,1|O<2>}	C[6](C[6]C[6]DyO)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3430	0.000	1	119.6338	0.303	5	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]DyO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){2|Dy<15>,1|C<5>,2|O<3>}	C[6](C[6]C[6]DyO)(C[6]C[6]H)(H){1|Dy<15>,1|C<4>,1|H<1>,1|O<3>}	H(C[6]C[6]2)	119.0910	0.100	2	119.6338	0.303	5	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]ErN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Er<16>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]ErN)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.6646	0.749	8	119.6646	0.561	8	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]FeB)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Fe<5>,1|C<3>,2|B<4>}	C[6](C[6]C[6]FeB)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8470	0.000	1	120.0145	0.644	8	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]FeB)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Fe<6>,1|B<4>,1|C<4>,1|H<1>}	C[6](C[6]C[6]FeB)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2000	0.976	5	120.0145	0.644	8	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]FeB)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Fe<7>,1|B<4>,1|C<4>,1|H<1>}	C[6](C[6]C[6]FeB)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<4>}	H(C[6]C[6]2)	119.6345	0.460	2	120.0145	0.644	8	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]FeC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Fe<10>,1|H<1>,2|C<4>}	C[6](C[6]C[6]FeC)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8410	0.000	1	119.8410	0.000	1	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]FeH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Fe<10>,1|C<4>,2|H<1>}	C[6](C[6]C[6]FeH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.2830	0.000	1	119.3037	1.149	6	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]FeH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Fe<6>,1|C<4>,2|H<1>}	C[6](C[6]C[6]FeH)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.1078	1.072	5	119.3037	1.149	6	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]FeP)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Fe<7>,1|C<4>,1|H<1>,1|P<4>}	C[6](C[6]C[6]FeP)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2055	0.088	2	120.1663	0.009	3	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]FeP)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Fe<8>,1|C<4>,1|H<1>,1|P<4>}	C[6](C[6]C[6]FeP)(C[6]C[6]H)(H){1|B<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0880	0.000	1	120.1663	0.009	3	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]FeS)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Fe<9>,1|C<4>,1|H<1>,1|S<3>}	C[6](C[6]C[6]FeS)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<3>}	H(C[6]C[6]2)	119.5493	0.105	6	119.5493	0.011	6	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]GdO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Gd<17>,1|C<3>,1|C<4>,1|O<3>}	C[6](C[6]C[6]GdO)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<3>}	H(C[6]C[6]2)	120.1880	0.064	2	120.1880	0.004	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]GePd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ge<5>,1|Pd<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]GePd)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8900	0.102	2	119.8900	0.010	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|B<4>,1|C<3>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.0540	0.000	1	120.1493	1.598	24	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<2>,1|C<3>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0030	0.000	1	120.1493	1.598	24	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.4720	0.000	1	120.1493	1.598	24	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|P<4>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.8820	0.000	1	120.1493	1.598	24	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|P<4>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<4>}	H(C[6]C[6]2)	121.1180	0.000	1	120.1493	1.598	24	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|P<4>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9050	0.000	1	120.1493	1.598	24	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,3|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.7827	1.612	4	120.1493	1.598	24	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,3|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<4>}	H(C[6]C[6]2)	119.8614	0.202	5	120.1493	1.598	24	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,3|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.0690	0.000	2	120.1493	1.598	24	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,3|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.9870	0.001	2	120.1493	1.598	24	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,3|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<3>,3|H<1>}	H(C[6]C[6]2)	122.0530	3.446	2	120.1493	1.598	24	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){2|C<3>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	118.0370	0.000	1	120.1493	1.598	24	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){2|C<3>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7285	0.146	2	120.1493	1.598	24	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]HN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,2|H<1>}	C[6](C[6]C[6]HN)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.6720	3.216	2	119.6720	10.342	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]HO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|O<1>,2|H<1>}	C[6](C[6]C[6]HO)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.0380	0.000	1	120.0798	0.672	5	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]HO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|O<2>,1|S<3>}	C[6](C[6]C[6]HO)(C[6]C[6]H)(H){1|C<3>,1|O<2>,2|H<1>}	H(C[6]C[6]2)	120.0185	0.736	2	120.0798	0.672	5	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]HO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|O<2>,2|C<4>}	C[6](C[6]C[6]HO)(C[6]C[6]H)(H){1|C<3>,1|O<2>,2|H<1>}	H(C[6]C[6]2)	120.1620	1.457	2	120.0798	0.672	5	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]HP)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<2>,1|H<1>,1|P<4>}	C[6](C[6]C[6]HP)(C[6]C[6]H)(H){1|C<2>,1|H<1>}	H(C[6]C[6]2)	119.9450	0.000	1	119.8057	0.131	51	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]HP)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<2>,1|P<4>,2|H<1>}	C[6](C[6]C[6]HP)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8708	0.148	5	119.8057	0.131	51	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]HP)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|P<4>,2|H<1>}	C[6](C[6]C[6]HP)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7954	0.382	45	119.8057	0.131	51	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]HU)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|U<11>,1|C<4>,2|H<1>}	C[6](C[6]C[6]HU)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.7460	0.146	2	120.7108	0.056	4	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]HU)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|U<15>,1|C<3>,2|H<1>}	C[6](C[6]C[6]HU)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4100	0.000	1	120.7108	0.056	4	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]HU)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|U<16>,1|C<3>,2|H<1>}	C[6](C[6]C[6]HU)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.9410	0.000	1	120.7108	0.056	4	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]HW)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|O<2>,1|W<7>}	C[6](C[6]C[6]HW)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	121.4230	0.000	1	121.4230	0.000	1	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]HY)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Y<10>,1|C<4>,1|H<1>,1|H<2>}	C[6](C[6]C[6]HY)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	121.4930	0.000	1	120.8137	0.286	4	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]HY)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Y<17>,1|C<4>,1|H<1>,1|H<2>}	C[6](C[6]C[6]HY)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.5873	0.348	3	120.8137	0.286	4	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]HfC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Hf<10>,1|H<1>,2|C<4>}	C[6](C[6]C[6]HfC)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.6850	0.000	1	119.8190	0.021	4	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]HfC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Hf<9>,1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]HfC)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8555	0.194	2	119.8190	0.021	4	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]HfC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Hf<9>,1|H<1>,2|C<4>}	C[6](C[6]C[6]HfC)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8800	0.000	1	119.8190	0.021	4	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]HfH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Hf<10>,1|C<4>,2|H<1>}	C[6](C[6]C[6]HfH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.3330	0.000	1	120.3415	0.000	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]HfH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Hf<9>,1|C<4>,2|H<1>}	C[6](C[6]C[6]HfH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.3500	0.000	1	120.3415	0.000	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]HfN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Hf<10>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]HfN)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.9780	0.157	4	120.0785	0.029	13	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]HfN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Hf<10>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]HfN)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.1750	0.000	1	120.0785	0.029	13	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]HfN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Hf<11>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]HfN)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.0540	0.111	3	120.0785	0.029	13	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]HfN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Hf<9>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]HfN)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.1544	0.207	5	120.0785	0.029	13	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]HfO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Hf<13>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]HfO)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<4>}	H(C[6]C[6]2)	119.7550	0.000	1	119.7550	0.000	1	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]IrC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ir<9>,3|C<4>}	C[6](C[6]C[6]IrC)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.2760	0.000	1	119.2760	0.000	1	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]IrH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ir<8>,1|B<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]IrH)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.7310	0.000	1	119.7310	0.000	1	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]IrRu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ir<5>,1|Ru<6>,1|C<4>,1|H<1>}	C[6](C[6]C[6]IrRu)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7060	0.000	1	119.7060	0.000	1	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]LaC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|La<18>,1|H<1>,2|C<4>}	C[6](C[6]C[6]LaC)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|H<2>}	H(C[6]C[6]2)	119.1437	0.123	3	119.1437	0.015	3	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]LaH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|La<18>,1|C<4>,1|H<1>,1|H<2>}	C[6](C[6]C[6]LaH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.7933	0.170	3	120.7933	0.029	3	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]LaO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|La<14>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]LaO)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<4>}	H(C[6]C[6]2)	119.8800	0.000	1	119.8800	0.000	1	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]Li2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){2|Li<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]Li2)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.1243	0.179	3	120.0645	0.292	12	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]Li2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){2|Li<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]Li2)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0493	0.668	8	120.0645	0.292	12	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]Li2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){2|Li<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]Li2)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.0070	0.000	1	120.0645	0.292	12	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]LiC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Li<5>,1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]LiC)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7980	0.143	2	120.0970	0.127	4	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]LiC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Li<5>,1|C<3>,2|C<4>}	C[6](C[6]C[6]LiC)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3620	0.000	1	120.0970	0.127	4	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]LiC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Li<6>,3|C<4>}	C[6](C[6]C[6]LiC)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4300	0.000	1	120.0970	0.127	4	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]LiH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Li<4>,1|C<3>,2|H<1>}	C[6](C[6]C[6]LiH)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.1310	0.000	1	120.1310	0.000	1	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]LiN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Li<4>,1|C<3>,1|H<1>,1|N<4>}	C[6](C[6]C[6]LiN)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.1910	0.598	2	119.1910	0.358	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]LiNi)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Li<3>,1|Ni<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]LiNi)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.0340	0.000	1	119.8146	0.080	5	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]LiNi)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Li<5>,1|Ni<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]LiNi)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.6770	0.000	1	119.8146	0.080	5	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]LiNi)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Li<5>,1|Ni<7>,1|C<4>,1|H<1>}	C[6](C[6]C[6]LiNi)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.1700	0.000	1	119.8146	0.080	5	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]LiNi)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Li<6>,1|Ni<7>,1|C<4>,1|H<1>}	C[6](C[6]C[6]LiNi)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.5960	0.171	2	119.8146	0.080	5	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]LiO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Li<5>,1|C<4>,1|H<1>,1|O<3>}	C[6](C[6]C[6]LiO)(C[6]C[6]H)(H){1|Zn<3>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.7117	0.263	3	119.7117	0.069	3	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]LiZn)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Li<5>,1|Zn<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]LiZn)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<3>}	H(C[6]C[6]2)	120.2927	0.090	3	120.2927	0.008	3	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]LuC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Lu<11>,1|H<1>,2|C<4>}	C[6](C[6]C[6]LuC)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<4>}	H(C[6]C[6]2)	119.6900	0.000	1	119.6900	0.000	1	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]LuN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Lu<11>,1|C<4>,1|H<1>,1|N<4>}	C[6](C[6]C[6]LuN)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.0390	0.000	1	120.0390	0.000	1	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]Mg2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){2|Mg<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]Mg2)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0970	0.000	1	120.0970	0.000	1	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]MgH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Mg<6>,1|C<3>,2|H<1>}	C[6](C[6]C[6]MgH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.3680	0.000	1	120.1150	0.128	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]MgH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Mg<7>,1|C<4>,2|H<1>}	C[6](C[6]C[6]MgH)(C[6]C[6]H)(H){1|Si<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8620	0.000	1	120.1150	0.128	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]MgSi)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Mg<7>,1|Si<5>,1|C<4>,1|H<1>}	C[6](C[6]C[6]MgSi)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9140	0.000	1	119.9140	0.000	1	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]MnC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Mn<7>,1|H<1>,2|C<4>}	C[6](C[6]C[6]MnC)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.5550	0.000	1	119.4337	0.045	15	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]MnC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Mn<8>,1|H<1>,2|C<4>}	C[6](C[6]C[6]MnC)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.4250	0.218	14	119.4337	0.045	15	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]MnH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Mn<7>,1|C<4>,2|H<1>}	C[6](C[6]C[6]MnH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.4990	0.000	1	120.4990	0.000	1	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]Mo2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Mo<8>,1|Mo<9>,1|C<4>,1|H<1>}	C[6](C[6]C[6]Mo2)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7310	0.170	2	119.7310	0.029	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]MoC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Mo<10>,1|H<1>,2|C<4>}	C[6](C[6]C[6]MoC)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7660	0.000	1	119.7697	0.000	3	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]MoC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Mo<5>,1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]MoC)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7715	0.029	2	119.7697	0.000	3	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]MoH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Mo<10>,1|C<4>,2|H<1>}	C[6](C[6]C[6]MoH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.0140	0.000	1	120.3930	0.118	3	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]MoH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Mo<9>,1|C<4>,2|H<1>}	C[6](C[6]C[6]MoH)(C[6]C[6]H)(H){1|Mo<8>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5825	0.145	2	120.3930	0.118	3	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]MoN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Mo<7>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]MoN)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7079	0.189	8	119.7079	0.036	8	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]NU)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|U<15>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]NU)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.5793	0.385	4	119.8034	0.275	32	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]NU)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|U<16>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]NU)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7216	0.254	8	119.8034	0.275	32	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]NU)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|U<16>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]NU)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<4>}	H(C[6]C[6]2)	119.2796	0.306	7	119.8034	0.275	32	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]NU)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|U<16>,1|C<4>,1|H<1>,1|N<4>}	C[6](C[6]C[6]NU)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4023	0.346	7	119.8034	0.275	32	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]NU)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|U<18>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]NU)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<4>}	H(C[6]C[6]2)	119.5040	0.252	3	119.8034	0.275	32	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]NU)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|U<18>,1|C<4>,1|H<1>,1|N<4>}	C[6](C[6]C[6]NU)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4450	0.113	3	119.8034	0.275	32	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]NV)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>,1|V<9>}	C[6](C[6]C[6]NV)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7258	0.147	17	119.7258	0.022	17	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]NW)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|W<11>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]NW)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7270	0.366	2	119.7270	0.134	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]NY)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Y<10>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]NY)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.5580	0.088	2	120.2380	0.311	3	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]NY)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Y<12>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]NY)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<3>}	H(C[6]C[6]2)	119.5980	0.000	1	120.2380	0.311	3	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6]La)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|La<16>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6]La)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4360	0.180	2	120.4360	0.032	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6]Th)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Th<16>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6]Th)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9550	0.552	2	120.0030	0.298	10	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6]Th)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Th<17>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6]Th)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9800	0.000	1	120.0030	0.298	10	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6]Th)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Th<17>,1|H<1>,1|N<3>,2|C<4>}	C[6](C[6]C[6]N[6]Th)(C[6]C[6]H)(H){1|C<3>,1|C<5>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.3220	0.000	1	120.0030	0.298	10	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6]Th)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Th<18>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6]Th)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4910	0.095	2	120.0030	0.298	10	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6]Th)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Th<21>,1|C<4>,1|C<5>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6]Th)(C[6]C[6]H)(H){1|C<3>,1|C<5>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.5895	0.779	2	120.0030	0.298	10	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6]Th)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Th<21>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6]Th)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3285	0.511	2	120.0030	0.298	10	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6]Ti)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ti<11>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6]Ti)(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	120.7435	0.067	2	120.7435	0.005	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6]Tm)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Tm<16>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6]Tm)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9365	0.514	2	120.2778	0.128	6	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]N[6]Tm)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Tm<17>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6]Tm)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4485	0.091	4	120.2778	0.128	6	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]NdC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Nd<18>,1|H<1>,2|C<4>}	C[6](C[6]C[6]NdC)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|H<2>}	H(C[6]C[6]2)	119.2547	0.130	3	119.2547	0.017	3	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]NdH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Nd<18>,1|C<4>,1|H<1>,1|H<2>}	C[6](C[6]C[6]NdH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.7853	0.205	3	120.7853	0.042	3	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]NdN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Nd<12>,1|C<3>,1|H<1>,1|N<4>}	C[6](C[6]C[6]NdN)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.8300	0.042	2	119.8300	0.002	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]Ni2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ni<4>,1|Ni<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]Ni2)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.8050	0.000	1	119.5697	0.018	8	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]Ni2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ni<7>,1|Ni<8>,1|C<4>,1|H<1>}	C[6](C[6]C[6]Ni2)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.5528	0.051	4	119.5697	0.018	8	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]Ni2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ni<7>,1|Ni<9>,1|C<4>,1|H<1>}	C[6](C[6]C[6]Ni2)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.5135	0.233	2	119.5697	0.018	8	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]Ni2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){2|Ni<4>,1|C<4>,1|H<1>}	C[6](C[6]C[6]Ni2)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.5150	0.000	1	119.5697	0.018	8	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]NiB)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ni<5>,1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]NiB)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9230	0.000	1	119.5253	0.163	3	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]NiB)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ni<5>,1|B<4>,1|C<4>,1|H<1>}	C[6](C[6]C[6]NiB)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.3265	0.298	2	119.5253	0.163	3	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]NiC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ni<5>,1|H<1>,2|C<4>}	C[6](C[6]C[6]NiC)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.6769	0.529	9	119.6959	0.226	11	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]NiC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ni<5>,3|C<4>}	C[6](C[6]C[6]NiC)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.7815	0.016	2	119.6959	0.226	11	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]NiH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ni<4>,1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]NiH)(C[6]C[6]H)(H){1|Ni<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9750	0.000	1	119.7326	1.351	18	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]NiH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ni<4>,1|C<4>,2|H<1>}	C[6](C[6]C[6]NiH)(C[6]C[6]H)(H){1|Ni<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1720	0.000	1	119.7326	1.351	18	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]NiH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ni<5>,1|C<4>,2|H<1>}	C[6](C[6]C[6]NiH)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6025	0.317	2	119.7326	1.351	18	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]NiH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ni<5>,1|C<4>,2|H<1>}	C[6](C[6]C[6]NiH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.4753	1.425	11	119.7326	1.351	18	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]NiH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ni<6>,1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]NiH)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7870	0.000	1	119.7326	1.351	18	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]NiH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ni<6>,1|C<4>,2|H<1>}	C[6](C[6]C[6]NiH)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.9700	0.000	1	119.7326	1.351	18	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]NiH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ni<6>,1|C<4>,2|H<1>}	C[6](C[6]C[6]NiH)(C[6]C[6]H)(H){1|Si<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8500	0.000	1	119.7326	1.351	18	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]NiSi)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ni<6>,1|Si<5>,1|C<4>,1|H<1>}	C[6](C[6]C[6]NiSi)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7100	0.000	1	119.7100	0.000	1	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]OO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,2|O<2>}	C[6](C[6]C[6]OO)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	118.9910	0.000	1	118.9350	0.006	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]OO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,2|O<2>}	C[6](C[6]C[6]OO)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	118.8790	0.000	1	118.9350	0.006	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]OU)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|U<16>,1|C<3>,1|C<4>,1|O<2>}	C[6](C[6]C[6]OU)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<3>}	H(C[6]C[6]2)	119.4892	0.494	20	119.4892	0.244	20	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]OV)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|O<2>,1|V<6>}	C[6](C[6]C[6]OV)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.9650	0.000	1	119.7306	0.184	34	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]OV)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|O<2>,1|V<8>}	C[6](C[6]C[6]OV)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<4>}	H(C[6]C[6]2)	119.6633	0.187	9	119.7306	0.184	34	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]OV)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|O<2>,1|V<9>}	C[6](C[6]C[6]OV)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<4>}	H(C[6]C[6]2)	119.6708	0.836	6	119.7306	0.184	34	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]OV)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|V<12>,1|C<4>,1|H<1>,1|O<2>}	C[6](C[6]C[6]OV)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.7712	0.356	18	119.7306	0.184	34	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]OW)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|O<2>,1|W<8>}	C[6](C[6]C[6]OW)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.3880	0.000	1	119.4861	0.462	28	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]OW)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|W<10>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]OW)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<4>}	H(C[6]C[6]2)	119.6700	0.008	2	119.4861	0.462	28	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]OW)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|W<10>,1|C<4>,1|H<1>,1|O<2>}	C[6](C[6]C[6]OW)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.5313	0.608	23	119.4861	0.462	28	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]OW)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|W<11>,1|C<4>,1|H<1>,1|O<2>}	C[6](C[6]C[6]OW)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	118.8315	1.831	2	119.4861	0.462	28	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]Os2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Os<4>,1|Os<5>,1|C<4>,1|H<1>}	C[6](C[6]C[6]Os2)(C[6]C[6]H)(H){1|Os<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1840	0.000	1	119.8697	0.257	12	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]Os2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Os<4>,1|Os<6>,1|C<4>,1|H<1>}	C[6](C[6]C[6]Os2)(C[6]C[6]H)(H){1|Os<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8757	0.262	3	119.8697	0.257	12	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]Os2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Os<5>,1|Os<6>,1|C<4>,1|H<1>}	C[6](C[6]C[6]Os2)(C[6]C[6]H)(H){1|Os<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3487	0.067	3	119.8697	0.257	12	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]Os2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Os<7>,1|Os<9>,1|C<4>,1|H<1>}	C[6](C[6]C[6]Os2)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.5100	0.000	1	119.8697	0.257	12	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]Os2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){2|Os<5>,1|C<4>,1|H<1>}	C[6](C[6]C[6]Os2)(C[6]C[6]H)(H){1|Os<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9730	0.000	1	119.8697	0.257	12	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]Os2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){2|Os<5>,1|C<4>,1|H<1>}	C[6](C[6]C[6]Os2)(C[6]C[6]H)(H){1|Os<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.7120	0.516	2	119.8697	0.257	12	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]Os2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){2|Os<9>,1|C<4>,1|H<1>}	C[6](C[6]C[6]Os2)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	118.6720	0.000	1	119.8697	0.257	12	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]OsC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Os<9>,1|H<1>,2|C<4>}	C[6](C[6]C[6]OsC)(C[6]C[6]H)(H){1|Os<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9230	0.000	1	119.6615	0.137	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]OsC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Os<9>,1|H<1>,2|C<4>}	C[6](C[6]C[6]OsC)(C[6]C[6]H)(H){1|Os<9>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.4000	0.000	1	119.6615	0.137	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]OsRu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Os<9>,1|Ru<9>,1|C<4>,1|H<1>}	C[6](C[6]C[6]OsRu)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.5890	0.000	1	119.6205	0.002	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]OsRu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Os<9>,1|Ru<9>,1|C<4>,1|H<1>}	C[6](C[6]C[6]OsRu)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.6520	0.000	1	119.6205	0.002	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]PdB)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Pd<5>,1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]PdB)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9920	0.042	2	119.9870	0.001	3	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]PdB)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Pd<5>,1|B<4>,1|C<4>,1|H<1>}	C[6](C[6]C[6]PdB)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9770	0.000	1	119.9870	0.001	3	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]PdC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Pd<4>,1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]PdC)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7650	0.072	2	119.6438	0.070	14	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]PdC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Pd<5>,1|H<1>,2|C<4>}	C[6](C[6]C[6]PdC)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.5630	0.351	5	119.6438	0.070	14	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]PdC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Pd<5>,3|C<4>}	C[6](C[6]C[6]PdC)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.8890	0.000	1	119.6438	0.070	14	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]PdC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Pd<6>,1|H<1>,2|C<4>}	C[6](C[6]C[6]PdC)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.4833	0.058	3	119.6438	0.070	14	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]PdC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Pd<6>,1|H<1>,2|C<4>}	C[6](C[6]C[6]PdC)(C[6]C[6]H)(H){1|Pd<6>,1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.7825	0.390	2	119.6438	0.070	14	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]PdC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Pd<6>,3|C<4>}	C[6](C[6]C[6]PdC)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7640	0.000	1	119.6438	0.070	14	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]PdH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Pd<5>,1|C<4>,2|H<1>}	C[6](C[6]C[6]PdH)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8980	0.000	1	119.9666	0.062	9	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]PdH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Pd<5>,1|C<4>,2|H<1>}	C[6](C[6]C[6]PdH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.8404	0.226	5	119.9666	0.062	9	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]PdH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Pd<6>,1|C<4>,2|H<1>}	C[6](C[6]C[6]PdH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.1997	0.149	3	119.9666	0.062	9	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]PdN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Pd<5>,1|C<3>,1|H<1>,1|N<4>}	C[6](C[6]C[6]PdN)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9500	0.081	2	119.7157	0.087	4	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]PdN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Pd<5>,1|C<4>,2|N<3>}	C[6](C[6]C[6]PdN)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.4815	0.183	2	119.7157	0.087	4	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]PrC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Pr<18>,1|H<1>,2|C<4>}	C[6](C[6]C[6]PrC)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|H<2>}	H(C[6]C[6]2)	119.1167	0.085	3	119.1167	0.007	3	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]PrH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Pr<17>,1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]PrH)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|H<2>}	H(C[6]C[6]2)	120.9840	0.000	1	120.7648	0.195	5	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]PrH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Pr<17>,1|C<3>,2|H<1>}	C[6](C[6]C[6]PrH)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.9910	0.000	1	120.7648	0.195	5	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]PrH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Pr<18>,1|C<4>,1|H<1>,1|H<2>}	C[6](C[6]C[6]PrH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.9497	0.125	3	120.7648	0.195	5	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]PtB)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Pt<6>,1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]PtB)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8035	0.204	2	119.8035	0.042	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]PtC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Pt<5>,1|H<1>,2|C<4>}	C[6](C[6]C[6]PtC)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.3705	0.414	2	119.3705	0.171	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]PtH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Pt<5>,1|C<4>,2|H<1>}	C[6](C[6]C[6]PtH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.1350	0.109	2	120.1350	0.012	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]ReC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Re<8>,1|H<1>,2|C<4>}	C[6](C[6]C[6]ReC)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.7857	0.611	3	119.7857	0.374	3	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]ReH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Re<7>,1|C<4>,1|H<1>,1|O<2>}	C[6](C[6]C[6]ReH)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3750	0.000	1	120.1833	0.098	3	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]ReH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Re<7>,1|C<4>,2|H<1>}	C[6](C[6]C[6]ReH)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0875	0.374	2	120.1833	0.098	3	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]RhB)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Rh<6>,1|B<4>,1|C<4>,1|H<1>}	C[6](C[6]C[6]RhB)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.5420	0.000	1	119.5420	0.000	1	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]RhC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Rh<5>,1|H<1>,2|C<4>}	C[6](C[6]C[6]RhC)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.4200	0.000	1	119.4603	0.011	3	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]RhC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Rh<6>,1|C<4>,1|C<5>,1|H<1>}	C[6](C[6]C[6]RhC)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.3810	0.000	1	119.4603	0.011	3	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]RhC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Rh<9>,3|C<4>}	C[6](C[6]C[6]RhC)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<4>}	H(C[6]C[6]2)	119.5800	0.000	1	119.4603	0.011	3	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]RhH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Rh<5>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]RhH)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.0680	0.000	1	119.9855	0.392	4	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]RhH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Rh<5>,1|C<4>,2|H<1>}	C[6](C[6]C[6]RhH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.3990	0.000	1	119.9855	0.392	4	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]RhH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Rh<6>,1|C<4>,2|H<1>}	C[6](C[6]C[6]RhH)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3700	0.000	1	119.9855	0.392	4	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]RhH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Rh<6>,1|C<4>,2|H<1>}	C[6](C[6]C[6]RhH)(C[6]C[6]H)(H){1|C<3>,1|C<5>,1|H<1>}	H(C[6]C[6]2)	120.1050	0.000	1	119.9855	0.392	4	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]Ru2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ru<5>,1|Ru<7>,2|C<4>}	C[6](C[6]C[6]Ru2)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.3315	0.063	2	119.4357	0.035	3	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]Ru2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){2|Ru<6>,1|C<4>,1|H<1>}	C[6](C[6]C[6]Ru2)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.6440	0.000	1	119.4357	0.035	3	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]RuC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ru<10>,1|H<1>,2|C<4>}	C[6](C[6]C[6]RuC)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.4520	0.000	1	119.6755	0.108	10	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]RuC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ru<10>,3|C<4>}	C[6](C[6]C[6]RuC)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<4>}	H(C[6]C[6]2)	119.6120	0.000	1	119.6755	0.108	10	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]RuC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ru<6>,1|H<1>,2|C<4>}	C[6](C[6]C[6]RuC)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8280	0.000	1	119.6755	0.108	10	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]RuC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ru<7>,1|H<1>,2|C<4>}	C[6](C[6]C[6]RuC)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.6397	0.555	3	119.6755	0.108	10	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]RuC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ru<8>,1|H<1>,2|C<4>}	C[6](C[6]C[6]RuC)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.5520	0.000	1	119.6755	0.108	10	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]RuC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ru<9>,1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]RuC)(C[6]C[6]H)(H){1|Os<9>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.6960	0.000	1	119.6755	0.108	10	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]RuC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ru<9>,1|H<1>,2|C<4>}	C[6](C[6]C[6]RuC)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1620	0.000	1	119.6755	0.108	10	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]RuC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ru<9>,1|H<1>,2|C<4>}	C[6](C[6]C[6]RuC)(C[6]C[6]H)(H){1|Os<9>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.5340	0.000	1	119.6755	0.108	10	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]RuH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ru<10>,1|C<4>,2|H<1>}	C[6](C[6]C[6]RuH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.3130	0.000	1	119.9529	0.083	8	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]RuH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ru<6>,1|C<4>,2|H<1>}	C[6](C[6]C[6]RuH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.8400	0.000	1	119.9529	0.083	8	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]RuH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ru<6>,1|C<4>,2|H<1>}	C[6](C[6]C[6]RuH)(C[6]C[6]H)(H){1|Ir<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.7170	0.000	1	119.9529	0.083	8	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]RuH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ru<6>,1|C<4>,2|H<1>}	C[6](C[6]C[6]RuH)(C[6]C[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1310	0.000	1	119.9529	0.083	8	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]RuH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ru<8>,1|C<4>,2|H<1>}	C[6](C[6]C[6]RuH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.9900	0.000	1	119.9529	0.083	8	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]RuH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ru<8>,1|H<2>,2|C<3>}	C[6](C[6]C[6]RuH)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9705	0.531	2	119.9529	0.083	8	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]RuH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ru<9>,1|C<4>,2|H<1>}	C[6](C[6]C[6]RuH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.6910	0.000	1	119.9529	0.083	8	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]RuS)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ru<9>,1|C<4>,1|H<1>,1|S<3>}	C[6](C[6]C[6]RuS)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<3>}	H(C[6]C[6]2)	119.3355	0.301	8	119.3355	0.091	8	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]SY)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Y<13>,1|C<3>,1|H<1>,1|S<3>}	C[6](C[6]C[6]SY)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2040	0.000	1	120.2040	0.000	1	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]ScC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Sc<11>,1|H<1>,2|C<4>}	C[6](C[6]C[6]ScC)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<4>}	H(C[6]C[6]2)	119.7390	0.000	1	119.7390	0.000	1	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]ScH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Sc<13>,1|C<4>,2|H<1>}	C[6](C[6]C[6]ScH)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<4>}	H(C[6]C[6]2)	120.2060	0.000	1	120.2060	0.000	1	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]ScN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Sc<11>,1|C<4>,1|H<1>,1|N<4>}	C[6](C[6]C[6]ScN)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.6350	0.000	1	119.6360	0.000	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]ScN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Sc<13>,1|C<4>,1|H<1>,1|N<4>}	C[6](C[6]C[6]ScN)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.6370	0.000	1	119.6360	0.000	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]SiH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Si<4>,1|C<3>,2|H<1>}	C[6](C[6]C[6]SiH)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.7365	0.206	2	120.7365	0.042	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]TaC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ta<6>,1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]TaC)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7840	0.795	2	119.7840	0.632	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]TaN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ta<10>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]TaN)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7862	0.155	4	119.6043	0.284	13	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]TaN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ta<9>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]TaN)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.4363	0.676	7	119.6043	0.284	13	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]TaN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ta<9>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]TaN)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8285	0.411	2	119.6043	0.284	13	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]TbH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Tb<16>,1|B<4>,1|C<4>,1|H<1>}	C[6](C[6]C[6]TbH)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|H<2>}	H(C[6]C[6]2)	119.5175	0.115	4	119.5175	0.013	4	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]TbO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Tb<11>,1|C<3>,1|C<4>,1|O<3>}	C[6](C[6]C[6]TbO)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.5840	0.136	2	119.7997	0.149	3	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]TbO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Tb<16>,1|C<3>,1|C<4>,1|O<3>}	C[6](C[6]C[6]TbO)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<3>}	H(C[6]C[6]2)	120.2310	0.000	1	119.7997	0.149	3	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]TeU)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Te<2>,1|U<13>,1|C<3>,1|H<1>}	C[6](C[6]C[6]TeU)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.4890	0.000	1	119.4890	0.000	1	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]ThC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Th<17>,1|H<1>,2|C<4>}	C[6](C[6]C[6]ThC)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|H<2>}	H(C[6]C[6]2)	119.3920	0.000	1	119.3500	0.002	4	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]ThC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Th<20>,1|H<1>,2|C<4>}	C[6](C[6]C[6]ThC)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|H<2>}	H(C[6]C[6]2)	119.3360	0.047	3	119.3500	0.002	4	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]ThH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Th<17>,1|C<4>,1|H<1>,1|H<2>}	C[6](C[6]C[6]ThH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.9350	0.000	1	120.7854	0.016	5	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]ThH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Th<20>,1|C<4>,1|H<1>,1|H<2>}	C[6](C[6]C[6]ThH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.7650	0.027	2	120.7854	0.016	5	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]ThH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Th<21>,1|C<4>,1|H<1>,1|H<2>}	C[6](C[6]C[6]ThH)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.7310	0.180	2	120.7854	0.016	5	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]ThN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Th<17>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]ThN)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<4>}	H(C[6]C[6]2)	119.5519	0.167	8	119.8673	0.263	24	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]ThN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Th<17>,1|C<4>,1|H<1>,1|N<4>}	C[6](C[6]C[6]ThN)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3526	0.307	8	119.8673	0.263	24	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]ThN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Th<18>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]ThN)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<4>}	H(C[6]C[6]2)	119.5260	0.186	3	119.8673	0.263	24	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]ThN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Th<18>,1|C<4>,1|H<1>,1|N<4>}	C[6](C[6]C[6]ThN)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2830	0.393	3	119.8673	0.263	24	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]ThN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Th<21>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]ThN)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|H<2>}	H(C[6]C[6]2)	119.0760	0.092	2	119.8673	0.263	24	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]TiC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ti<11>,1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]TiC)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.0320	1.564	2	119.0320	2.446	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]TiN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ti<10>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]TiN)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9763	0.070	3	119.7090	0.074	12	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]TiN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ti<10>,1|C<3>,1|N<3>,1|P<4>}	C[6](C[6]C[6]TiN)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.4713	0.361	3	119.7090	0.074	12	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]TiN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ti<11>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]TiN)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<3>}	H(C[6]C[6]2)	119.5010	0.093	2	119.7090	0.074	12	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]TiN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ti<11>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]TiN)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7957	0.132	3	119.7090	0.074	12	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]TiN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ti<8>,1|C<3>,1|N<3>,1|P<4>}	C[6](C[6]C[6]TiN)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7760	0.000	1	119.7090	0.074	12	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]TiO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ti<12>,1|C<3>,1|C<4>,1|O<2>}	C[6](C[6]C[6]TiO)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<3>}	H(C[6]C[6]2)	119.6167	0.164	8	119.5753	0.031	10	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]TiO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ti<8>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]TiO)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<3>}	H(C[6]C[6]2)	119.4095	0.135	2	119.5753	0.031	10	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]YbC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Yb<15>,1|H<1>,2|C<4>}	C[6](C[6]C[6]YbC)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.6215	0.336	4	119.6215	0.113	4	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]YbH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Yb<15>,1|C<4>,1|H<1>,1|H<2>}	C[6](C[6]C[6]YbH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.9600	0.000	1	120.1122	0.102	5	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]YbH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Yb<15>,1|C<4>,2|H<1>}	C[6](C[6]C[6]YbH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.1502	0.356	4	120.1122	0.102	5	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]YbN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Yb<10>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]YbN)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9660	0.526	2	120.0247	0.241	11	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]YbN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Yb<12>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]YbN)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.6375	0.091	2	120.0247	0.241	11	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]YbN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Yb<12>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]YbN)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<3>}	H(C[6]C[6]2)	119.4680	0.000	1	120.0247	0.241	11	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]YbN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Yb<12>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]YbN)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<3>}	H(C[6]C[6]2)	119.7000	0.000	1	120.0247	0.241	11	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]YbN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Yb<14>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]YbN)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<3>}	H(C[6]C[6]2)	119.6550	0.000	1	120.0247	0.241	11	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]YbN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Yb<15>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]YbN)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3130	0.730	2	120.0247	0.241	11	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]YbN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Yb<16>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]YbN)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8080	0.151	2	120.0247	0.241	11	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]YbO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Yb<12>,1|C<4>,1|H<1>,1|O<3>}	C[6](C[6]C[6]YbO)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3090	0.000	1	120.2865	0.001	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]YbO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Yb<14>,1|C<4>,1|H<1>,1|O<3>}	C[6](C[6]C[6]YbO)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2640	0.000	1	120.2865	0.001	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]Zn2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){2|Zn<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]Zn2)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0370	0.214	2	120.0370	0.046	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]ZnH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Zn<4>,1|C<3>,2|H<1>}	C[6](C[6]C[6]ZnH)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1500	0.293	2	120.1500	0.086	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]ZrC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Zr<10>,1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]ZrC)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7755	0.383	4	119.7971	0.137	29	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]ZrC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Zr<10>,1|H<1>,2|C<4>}	C[6](C[6]C[6]ZrC)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7185	0.187	2	119.7971	0.137	29	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]ZrC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Zr<10>,1|H<1>,2|C<4>}	C[6](C[6]C[6]ZrC)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.5175	0.187	2	119.7971	0.137	29	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]ZrC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Zr<12>,1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]ZrC)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1870	0.765	2	119.7971	0.137	29	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]ZrC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Zr<12>,1|H<1>,2|C<4>}	C[6](C[6]C[6]ZrC)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8673	0.633	3	119.7971	0.137	29	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]ZrC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Zr<13>,1|H<1>,2|C<3>}	C[6](C[6]C[6]ZrC)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7993	0.130	4	119.7971	0.137	29	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]ZrC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Zr<14>,1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]ZrC)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9387	0.260	3	119.7971	0.137	29	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]ZrC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Zr<15>,1|C<3>,1|C<5>,1|H<1>}	C[6](C[6]C[6]ZrC)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3380	0.000	1	119.7971	0.137	29	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]ZrC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Zr<8>,1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]ZrC)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7600	0.075	2	119.7971	0.137	29	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]ZrC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Zr<9>,1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]ZrC)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8065	0.180	4	119.7971	0.137	29	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]ZrC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Zr<9>,1|H<1>,2|C<4>}	C[6](C[6]C[6]ZrC)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.2340	0.407	2	119.7971	0.137	29	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]ZrH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Zr<10>,1|C<4>,2|H<1>}	C[6](C[6]C[6]ZrH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.4300	0.042	2	120.9361	4.023	12	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]ZrH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Zr<12>,1|C<4>,2|H<1>}	C[6](C[6]C[6]ZrH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.2443	0.346	3	120.9361	4.023	12	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]ZrH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Zr<13>,1|C<3>,2|H<1>}	C[6](C[6]C[6]ZrH)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	127.2430	0.000	1	120.9361	4.023	12	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]ZrH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Zr<14>,1|C<4>,2|H<1>}	C[6](C[6]C[6]ZrH)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4920	0.000	1	120.9361	4.023	12	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]ZrH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Zr<15>,1|C<3>,1|H<1>,1|H<2>}	C[6](C[6]C[6]ZrH)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0000	0.000	2	120.9361	4.023	12	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]ZrH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Zr<15>,1|C<3>,1|H<1>,1|H<2>}	C[6](C[6]C[6]ZrH)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.8370	0.000	1	120.9361	4.023	12	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]ZrH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Zr<9>,1|C<4>,2|H<1>}	C[6](C[6]C[6]ZrH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.5340	0.069	2	120.9361	4.023	12	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]ZrN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Zr<10>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]ZrN)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.3265	0.412	2	119.8703	0.444	18	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]ZrN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Zr<10>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]ZrN)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7420	0.175	2	119.8703	0.444	18	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]ZrN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Zr<11>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]ZrN)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.0263	0.134	4	119.8703	0.444	18	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]ZrN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Zr<11>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]ZrN)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1668	0.282	5	119.8703	0.444	18	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]ZrN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Zr<12>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]ZrN)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	118.5435	1.463	2	119.8703	0.444	18	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]ZrN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Zr<14>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]ZrN)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.3820	0.000	1	119.8703	0.444	18	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]ZrN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Zr<9>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]ZrN)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.0605	0.148	2	119.8703	0.444	18	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]ZrO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Zr<13>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]ZrO)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<4>}	H(C[6]C[6]2)	119.4850	0.013	2	119.5367	0.063	4	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]ZrO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Zr<13>,1|C<3>,1|O<2>,1|O<3>}	C[6](C[6]C[6]ZrO)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.2900	0.000	1	119.5367	0.063	4	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]ZrO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Zr<14>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]ZrO)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<4>}	H(C[6]C[6]2)	119.8870	0.000	1	119.5367	0.063	4	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]C[6]Cu)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Cu<4>,1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6a]C[6]Cu)(C[6]C[6]H)(H){2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.4150	0.000	1	119.4150	0.000	1	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]C[6]Fe)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Fe<6>,1|C<4>,2|C<3>}	C[6](C[6]C[6a]C[6]Fe)(C[6]C[6]H)(H){1|Fe<5>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.2320	1.249	5	120.0410	1.208	8	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]C[6]Fe)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Fe<6>,1|C<4>,2|C<3>}	C[6](C[6]C[6a]C[6]Fe)(C[6]C[6]H)(H){1|Fe<6>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.7227	0.929	3	120.0410	1.208	8	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]C[6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Si<4>,1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6a]C[6]H)(C[6]C[6]H)(H){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.4560	0.000	1	119.4560	0.000	1	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]C[6]Ni)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ni<6>,1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6a]C[6]Ni)(C[6]C[6]H)(H){2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.9370	0.000	1	119.9370	0.000	1	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]C[6]Ta)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ta<7>,3|C<3>}	C[6](C[6]C[6a]C[6]Ta)(C[6]C[6]H)(H){1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.5390	0.018	2	119.5390	0.000	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,2|H<1>}	C[6](C[6]C[6a]N[6]H)(C[6]C[6]H)(H){1|B<3>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.3820	0.000	1	120.2935	0.016	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6a]N[6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,2|H<1>}	C[6](C[6]C[6a]N[6]H)(C[6]C[6]H)(H){1|H<1>,4|C<3>}	H(C[6]C[6]2)	120.2050	0.000	1	120.2935	0.016	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]AlC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Al<5>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]N[6]AlC)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8897	0.187	3	119.8897	0.035	3	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]AlN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Al<5>,1|N<2>,2|N<3>}	C[6](C[6]N[6]AlN)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	118.8800	0.000	1	119.0340	0.014	6	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]AlN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Al<5>,3|N<3>}	C[6](C[6]N[6]AlN)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.0403	0.098	3	119.0340	0.014	6	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]AlN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Al<7>,1|N<2>,2|N<3>}	C[6](C[6]N[6]AlN)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.1015	0.125	2	119.0340	0.014	6	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]CH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,2|H<1>}	C[6](C[6]N[6]CH)(C[6]C[6]H)(H){1|Al<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.2360	0.277	2	119.5847	0.226	4	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]CH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,2|H<1>}	C[6](C[6]N[6]CH)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.1720	0.000	1	119.5847	0.226	4	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]CH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,2|H<1>}	C[6](C[6]N[6]CH)(C[6]C[6]H)(H){1|Li<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.6950	0.000	1	119.5847	0.226	4	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]CU)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|U<13>,1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]N[6]CU)(C[6]C[6]H)(H){1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.9260	0.158	2	119.6547	2.090	6	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]CU)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|U<14>,1|N<3>,2|C<4>}	C[6](C[6]N[6]CU)(C[6]C[6]H)(H){1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.0190	1.364	4	119.6547	2.090	6	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]CeC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ce<21>,1|N<3>,2|C<4>}	C[6](C[6]N[6]CeC)(C[6]C[6]H)(H){1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.1216	0.238	17	120.1216	0.056	17	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]CeH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ce<20>,1|H<1>,1|N<3>,1|N<4>}	C[6](C[6]N[6]CeH)(C[6]C[6]H)(H){1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.5325	0.087	2	119.5325	0.008	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]CeN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ce<20>,1|H<1>,1|N<3>,1|N<4>}	C[6](C[6]N[6]CeN)(C[6]C[6]H)(H){1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.5640	0.038	2	119.5640	0.001	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]CeO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ce<12>,1|C<4>,1|N<3>,1|O<2>}	C[6](C[6]N[6]CeO)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.0930	0.000	1	119.9257	0.155	10	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]CeO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ce<13>,1|C<4>,1|N<3>,1|O<2>}	C[6](C[6]N[6]CeO)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7740	0.000	1	119.9257	0.155	10	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]CeO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ce<16>,1|H<1>,1|N<4>,1|O<2>}	C[6](C[6]N[6]CeO)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.0487	0.281	8	119.9257	0.155	10	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]CoO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Co<6>,1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]N[6]CoO)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0950	0.000	1	120.0585	0.003	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]CoO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Co<7>,1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]N[6]CoO)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0220	0.000	1	120.0585	0.003	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]CrN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Cr<5>,1|C<3>,2|N<3>}	C[6](C[6]N[6]CrN)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8455	0.330	2	119.6539	0.051	13	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]CrN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Cr<6>,1|C<3>,2|N<3>}	C[6](C[6]N[6]CrN)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.6653	0.346	3	119.6539	0.051	13	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]CrN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Cr<7>,1|C<3>,2|N<3>}	C[6](C[6]N[6]CrN)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.6610	0.123	2	119.6539	0.051	13	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]CrN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Cr<8>,1|H<1>,2|N<3>}	C[6](C[6]N[6]CrN)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.5820	0.168	6	119.6539	0.051	13	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]CuN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Cu<5>,1|H<1>,2|N<3>}	C[6](C[6]N[6]CuN)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8180	0.000	1	119.8180	0.000	1	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]DyC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Dy<15>,1|N<3>,2|C<4>}	C[6](C[6]N[6]DyC)(C[6]C[6]H)(H){1|C<4>,1|H<1>}	H(C[6]C[6]2)	122.0470	0.000	1	120.4435	0.645	6	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]DyC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Dy<17>,1|N<3>,2|C<5>}	C[6](C[6]N[6]DyC)(C[6]C[6]H)(H){1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.3245	0.064	2	120.4435	0.645	6	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]DyC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Dy<21>,1|N<3>,2|C<4>}	C[6](C[6]N[6]DyC)(C[6]C[6]H)(H){1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.9883	0.014	3	120.4435	0.645	6	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]ErN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Er<15>,1|H<1>,2|N<3>}	C[6](C[6]N[6]ErN)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.2223	0.278	3	119.2223	0.077	3	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]EuN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Eu<9>,1|C<4>,2|N<3>}	C[6](C[6]N[6]EuN)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.7440	0.000	1	119.7440	0.000	1	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]FeO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Fe<7>,1|C<4>,1|N<3>,1|O<2>}	C[6](C[6]N[6]FeO)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.3510	0.236	3	119.3470	0.037	4	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]FeO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Fe<7>,1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]N[6]FeO)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.3350	0.000	1	119.3470	0.037	4	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]GdC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Gd<17>,1|N<3>,2|C<5>}	C[6](C[6]N[6]GdC)(C[6]C[6]H)(H){1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.0470	0.154	3	120.0470	0.024	3	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,3|H<1>}	C[6](C[6]N[6]HH)(C[6]C[6]H)(H){1|Mg<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.5410	0.000	1	119.7712	1.352	4	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,3|H<1>}	C[6](C[6]N[6]HH)(C[6]C[6]H)(H){1|Mg<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.9900	0.000	1	119.7712	1.352	4	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|N<3>,4|H<1>}	C[6](C[6]N[6]HH)(C[6]C[6]H)(H){1|H<1>,2|C<4>}	H(C[6]C[6]2)	118.7770	0.025	2	119.7712	1.352	4	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]HfN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Hf<10>,1|C<4>,2|N<3>}	C[6](C[6]N[6]HfN)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9280	0.000	1	119.9295	0.000	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]HfN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Hf<10>,1|H<1>,2|N<3>}	C[6](C[6]N[6]HfN)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9310	0.000	1	119.9295	0.000	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]IrC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ir<7>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]N[6]IrC)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1300	0.000	1	120.1300	0.000	1	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]IrN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ir<7>,1|H<1>,1|N<3>,1|N<4>}	C[6](C[6]N[6]IrN)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.3900	0.000	1	119.5965	0.085	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]IrN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ir<7>,1|H<1>,2|N<3>}	C[6](C[6]N[6]IrN)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8030	0.000	1	119.5965	0.085	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]IrO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ir<7>,1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]N[6]IrO)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.2930	0.000	1	119.0595	0.109	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]IrO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ir<9>,1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]N[6]IrO)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	118.8260	0.000	1	119.0595	0.109	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]LaH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|La<16>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]N[6]LaH)(C[6]C[6]H)(H){1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.4385	0.214	2	120.4385	0.046	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]LiN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Li<5>,1|H<1>,1|N<3>,1|N<4>}	C[6](C[6]N[6]LiN)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.2595	0.665	2	119.2287	0.224	3	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]LiN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Li<5>,3|N<3>}	C[6](C[6]N[6]LiN)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.1670	0.000	1	119.2287	0.224	3	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]MnS)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Mn<7>,1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]N[6]MnS)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.6150	0.000	1	119.6150	0.000	1	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]MoN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Mo<8>,1|C<3>,2|N<3>}	C[6](C[6]N[6]MoN)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	116.3735	15.286	2	116.3735	233.647	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]NW)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|W<7>,2|N<3>}	C[6](C[6]N[6]NW)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.4320	0.502	2	119.4320	0.252	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]NdN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Nd<12>,1|C<4>,2|N<3>}	C[6](C[6]N[6]NdN)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.3357	0.407	3	119.3357	0.166	3	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]NiN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ni<5>,1|N<4>,2|N<3>}	C[6](C[6]N[6]NiN)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	118.6600	0.148	2	118.6600	0.022	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]NiO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Cl<1>,1|Ni<6>,1|N<3>,1|O<2>}	C[6](C[6]N[6]NiO)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8790	0.000	1	119.8075	0.010	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]NiO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ni<6>,1|C<4>,1|N<3>,1|O<2>}	C[6](C[6]N[6]NiO)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.7360	0.000	1	119.8075	0.010	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]OsC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Os<10>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]N[6]OsC)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3270	0.000	1	120.2362	0.074	5	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]OsC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Os<7>,1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]N[6]OsC)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6550	0.000	1	120.2362	0.074	5	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]OsC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Os<8>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]N[6]OsC)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0663	0.114	3	120.2362	0.074	5	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]PdN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Pd<5>,3|N<3>}	C[6](C[6]N[6]PdN)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.3760	0.000	1	119.3760	0.000	1	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]ReS)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Re<8>,1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]N[6]ReS)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0290	0.000	1	120.0290	0.000	1	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]RhN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Rh<6>,1|H<1>,2|N<3>}	C[6](C[6]N[6]RhN)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9190	0.141	2	119.6081	0.091	7	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]RhN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Rh<8>,1|C<3>,2|N<3>}	C[6](C[6]N[6]RhN)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.5235	0.125	2	119.6081	0.091	7	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]RhN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Rh<9>,1|C<3>,2|N<3>}	C[6](C[6]N[6]RhN)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.4573	0.344	3	119.6081	0.091	7	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]RhS)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Rh<9>,1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]N[6]RhS)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.5105	0.653	2	119.5105	0.426	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]RuC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ru<10>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]N[6]RuC)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1210	0.204	2	119.8811	0.076	8	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]RuC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ru<7>,1|C<4>,1|N<2>,1|N<3>}	C[6](C[6]N[6]RuC)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9140	0.000	1	119.8811	0.076	8	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]RuC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ru<8>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]N[6]RuC)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.7565	0.343	2	119.8811	0.076	8	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]RuC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ru<8>,1|C<4>,1|N<2>,1|N<3>}	C[6](C[6]N[6]RuC)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.6340	0.231	2	119.8811	0.076	8	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]RuC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ru<9>,1|C<5>,1|N<2>,1|N<3>}	C[6](C[6]N[6]RuC)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1120	0.000	1	119.8811	0.076	8	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]RuN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ru<6>,1|H<1>,2|N<3>}	C[6](C[6]N[6]RuN)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.6630	0.000	1	119.6614	0.100	7	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]RuN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ru<7>,1|C<4>,2|N<3>}	C[6](C[6]N[6]RuN)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2000	0.000	1	119.6614	0.100	7	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]RuN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ru<7>,1|H<1>,1|N<3>,1|N<4>}	C[6](C[6]N[6]RuN)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8530	0.000	1	119.6614	0.100	7	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]RuN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ru<7>,1|H<1>,2|N<3>}	C[6](C[6]N[6]RuN)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.3115	0.129	2	119.6614	0.100	7	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]RuN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ru<9>,1|H<1>,1|N<3>,1|N<4>}	C[6](C[6]N[6]RuN)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.6455	0.095	2	119.6614	0.100	7	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]RuO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ru<7>,1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]N[6]RuO)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.3830	0.000	1	119.3135	0.010	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]RuO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ru<7>,1|N<2>,1|N<3>,1|O<2>}	C[6](C[6]N[6]RuO)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.2440	0.000	1	119.3135	0.010	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]SU)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|U<13>,1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]N[6]SU)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0150	0.146	4	120.0150	0.021	4	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]SW)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>,1|W<8>}	C[6](C[6]N[6]SW)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9830	0.205	4	119.9027	0.087	6	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]SW)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>,1|W<9>}	C[6](C[6]N[6]SW)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.7420	0.482	2	119.9027	0.087	6	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]ScS)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Sc<13>,1|H<1>,1|N<3>,1|S<2>}	C[6](C[6]N[6]ScS)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.1030	0.000	1	121.1030	0.000	1	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]SeW)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Se<2>,1|H<1>,1|N<3>,1|W<9>}	C[6](C[6]N[6]SeW)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3720	0.222	2	120.3720	0.049	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]SmN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Sm<9>,1|C<4>,2|N<3>}	C[6](C[6]N[6]SmN)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.6020	0.000	1	119.6020	0.000	1	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]SnN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Sn<6>,1|C<4>,2|N<3>}	C[6](C[6]N[6]SnN)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.0170	0.024	4	119.0170	0.001	4	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]TaC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ta<10>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]N[6]TaC)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.6715	0.091	2	119.7683	0.013	6	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]TaC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ta<14>,1|N<3>,2|C<4>}	C[6](C[6]N[6]TaC)(C[6]C[6]H)(H){1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.7955	0.162	2	119.7683	0.013	6	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]TaC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ta<14>,1|N<3>,2|C<5>}	C[6](C[6]N[6]TaC)(C[6]C[6]H)(H){1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.8380	0.054	2	119.7683	0.013	6	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]TaN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ta<9>,3|N<3>}	C[6](C[6]N[6]TaN)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.0845	0.071	2	119.0845	0.005	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]ThC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Th<19>,1|N<4>,2|C<4>}	C[6](C[6]N[6]ThC)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.8240	0.000	1	120.2402	0.062	6	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]ThC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Th<21>,1|N<3>,2|C<4>}	C[6](C[6]N[6]ThC)(C[6]C[6]H)(H){1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.3234	0.161	5	120.2402	0.062	6	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]ThH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Th<16>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]N[6]ThH)(C[6]C[6]H)(H){1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.1450	0.409	2	120.2481	0.133	7	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]ThH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Th<17>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]N[6]ThH)(C[6]C[6]H)(H){1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.9480	0.000	1	120.2481	0.133	7	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]ThH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Th<18>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]N[6]ThH)(C[6]C[6]H)(H){1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.4760	0.069	2	120.2481	0.133	7	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]ThH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Th<21>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]N[6]ThH)(C[6]C[6]H)(H){1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.2735	0.641	2	120.2481	0.133	7	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]TiC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ti<10>,1|C<5>,1|H<1>,1|N<3>}	C[6](C[6]N[6]TiC)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4060	0.000	1	120.4060	0.000	1	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]TiN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ti<7>,1|C<3>,2|N<3>}	C[6](C[6]N[6]TiN)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.6767	0.368	4	119.6841	0.071	7	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]TiN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ti<7>,1|H<1>,2|N<3>}	C[6](C[6]N[6]TiN)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.5840	0.000	1	119.6841	0.071	7	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]TiN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ti<9>,1|H<1>,2|N<3>}	C[6](C[6]N[6]TiN)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.7490	0.024	2	119.6841	0.071	7	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]TiO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ti<8>,1|C<4>,1|N<3>,1|O<2>}	C[6](C[6]N[6]TiO)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.5555	0.195	4	119.5555	0.038	4	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]TmH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Tm<16>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]N[6]TmH)(C[6]C[6]H)(H){1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.9045	0.504	2	120.2615	0.154	6	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]TmH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Tm<17>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]N[6]TmH)(C[6]C[6]H)(H){1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.4400	0.211	4	120.2615	0.154	6	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]YbC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Yb<14>,1|C<4>,1|C<5>,1|N<3>}	C[6](C[6]N[6]YbC)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.9160	0.000	1	120.9160	0.000	1	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]YbN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Yb<14>,1|N<2>,2|N<3>}	C[6](C[6]N[6]YbN)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.7230	0.000	1	119.5000	0.250	5	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]YbN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Yb<15>,1|H<1>,2|N<3>}	C[6](C[6]N[6]YbN)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.6600	0.000	1	119.5000	0.250	5	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]YbN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Yb<9>,1|C<4>,2|N<3>}	C[6](C[6]N[6]YbN)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1350	0.000	1	119.5000	0.250	5	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]YbN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){2|Yb<12>,3|N<3>}	C[6](C[6]N[6]YbN)(C[6]C[6]H)(H){1|C<4>,1|H<1>}	H(C[6]C[6]2)	118.9600	0.000	1	119.5000	0.250	5	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]YbN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){2|Yb<12>,3|N<3>}	C[6](C[6]N[6]YbN)(C[6]C[6]H)(H){1|Yb<12>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.0220	0.000	1	119.5000	0.250	5	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]ZrC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Zr<14>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]N[6]ZrC)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8707	0.177	3	119.8707	0.031	3	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]ZrN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Zr<11>,1|C<3>,2|N<3>}	C[6](C[6]N[6]ZrN)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.1740	0.035	2	119.7767	0.213	4	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]ZrN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Zr<8>,1|H<1>,2|N<3>}	C[6](C[6]N[6]ZrN)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.3795	0.073	2	119.7767	0.213	4	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]ZrO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Zr<16>,1|C<3>,1|N<4>,1|O<2>}	C[6](C[6]N[6]ZrO)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.0275	0.030	2	120.0275	0.001	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[5])(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]C[6]H)(H){1|Br<1>,1|H<1>,2|C<3>,2|C<4>}	C[6](C[6]C[6a]C[6]H)(C[6]C[6]H)(H){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	118.8090	0.000	1	118.8090	0.000	1	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]O)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]O)(C[6]C[6]H)(H){2|C<4>,2|H<1>}	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>,1|O<1>}	H(C[6]C[6]2)	124.1060	0.000	1	121.6930	11.645	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]O)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]O)(C[6]C[6]H)(H){2|C<4>,2|H<1>}	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,1|O<1>}	H(C[6]C[6]2)	119.2800	0.000	1	121.6930	11.645	2	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]O)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]HO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]O)(C[6]C[6]H)(H){1|H<1>,1|O<2>,2|C<4>}	C[6](C[6]C[6,6]HO)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,1|O<1>}	H(C[6]C[6]2)	118.7120	0.000	1	118.7120	0.000	1	119.7723	0.893	1364	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:I-1:	C[6]-3:	C[6](C[6]C[6]I)(C[6]C[6]O)(H)	C[6](C[6]C[6]HO)(C[6]C[6]H)(I)	H(C[6]C[6]2)	C[6](C[6]C[6]I)(C[6]C[6]O)(H){1|C<4>,1|O<2>,3|H<1>}	C[6](C[6]C[6]HO)(C[6]C[6]H)(I){1|C<4>,1|H<1>,1|O<1>,1|O<2>}	H(C[6]C[6]2)	119.0830	0.000	1	119.0830	0.000	1	119.0830	0.000	1	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[3,6,6]H)(C[6]C[6]O)(H)	C[6](C[6]C[3,6]HH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[3,6,6]H)(C[6]C[6]O)(H){2|H<1>,3|C<4>}	C[6](C[6]C[3,6]HH)(C[6]C[6]H)(O){2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.6760	0.417	2	118.6760	0.174	2	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[3,6,6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6,6]CH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[3,6,6]H)(C[6]C[6]O)(H){1|H<1>,4|C<4>}	C[6](C[6]C[6,6]CH)(C[6]C[6]H)(O){2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.1340	0.000	1	119.1340	0.000	1	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[3,6]H)(C[6]C[6]O)(H)	C[6](C[6]C[3,6,6]HH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[3,6]H)(C[6]C[6]O)(H){2|C<4>,3|H<1>}	C[6](C[6]C[3,6,6]HH)(C[6]C[6]H)(O){1|H<1>,3|C<4>}	H(C[6]C[6]2)	119.8950	0.000	1	119.8950	0.000	1	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[3x6]C)(C[6]C[6]O)(H)	C[6](C[6]C[3x6]CO)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[3x6]C)(C[6]C[6]O)(H){1|H<1>,1|O<2>,3|C<4>}	C[6](C[6]C[3x6]CO)(C[6]C[6]H)(O){1|H<1>,3|C<4>}	H(C[6]C[6]2)	119.3787	0.289	3	119.3787	0.084	3	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[3x6]C[5])(C[6]C[6]O)(H)	C[6](C[6]C[3x6]CO)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[3x6]C[5])(C[6]C[6]O)(H){1|H<1>,1|O<2>,6|C<4>}	C[6](C[6]C[3x6]CO)(C[6]C[6]H)(O){1|H<1>,3|C<4>}	H(C[6]C[6]2)	113.2080	0.000	1	113.2080	0.000	1	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[3x6]H)(C[6]C[6]O)(H)	C[6](C[6]C[3x6]CF)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[3x6]H)(C[6]C[6]O)(H){1|F<1>,1|H<1>,3|C<4>}	C[6](C[6]C[3x6]CF)(C[6]C[6]H)(O){2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.5150	0.000	1	119.5150	0.000	1	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[3x6]H)(C[6]C[6]O)(H)	C[6](C[6]C[3x6]CO)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[3x6]H)(C[6]C[6]O)(H){1|H<1>,1|O<2>,3|C<4>}	C[6](C[6]C[3x6]CO)(C[6]C[6]H)(O){2|C<4>,2|H<1>}	H(C[6]C[6]2)	120.5050	0.000	1	120.5050	0.000	1	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[3x6]H)(C[6]C[6]O)(H)	C[6](C[6]C[3x6]HH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[3x6]H)(C[6]C[6]O)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[6]C[3x6]HH)(C[6]C[6]H)(O){1|C<4>,1|H<1>,2|O<2>}	H(C[6]C[6]2)	118.9845	0.064	2	118.9845	0.004	2	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[3x6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[3x6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|N<3>,2|H<1>}	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(O){1|C<4>,1|O<2>,2|H<1>}	H(C[6]C[6]2)	118.9400	0.000	1	117.4637	1.782	3	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[3x6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[3x6]H)(C[6]C[6]O)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(O){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	117.1090	0.000	1	117.4637	1.782	3	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[3x6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[3x6]H)(C[6]C[6]O)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(O){2|C<4>,2|H<1>}	H(C[6]C[6]2)	116.3420	0.000	1	117.4637	1.782	3	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[4,6]O)(C[6]C[6]O)(H)	C[6](C[6]C[4,5,6,6]HH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[4,6]O)(C[6]C[6]O)(H){2|C<4>,3|H<1>}	C[6](C[6]C[4,5,6,6]HH)(C[6]C[6]H)(O){1|O<2>,3|C<4>}	H(C[6]C[6]2)	118.8910	0.000	1	118.8910	0.000	1	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[4]C[6])(C[6]C[6]O)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[4]C[6])(C[6]C[6]O)(H){1|O<2>,3|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(O){4|C<4>}	H(C[6]C[6]2)	118.5530	0.000	1	118.3795	0.060	2	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[4]C[6])(C[6]C[6]O)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[4]C[6])(C[6]C[6]O)(H){3|C<4>,5|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(O){2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.2060	0.000	1	118.3795	0.060	2	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,3x6]H)(C[6]C[6]O)(H)	C[6](C[6]C[3x6]CC)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,3x6]H)(C[6]C[6]O)(H){5|C<4>}	C[6](C[6]C[3x6]CC)(C[6]C[6]H)(O){2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.5960	0.000	1	118.5960	0.000	1	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,3x6]H)(C[6]C[6]O)(H)	C[6](C[6]C[3x6]HH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,3x6]H)(C[6]C[6]O)(H){2|H<1>,3|C<4>}	C[6](C[6]C[3x6]HH)(C[6]C[6]H)(O){2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.0910	0.000	1	119.0910	0.000	1	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,5,6]H)(C[6]C[6]O)(H)	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,5,6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|N<3>,2|H<1>}	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(O){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	118.4165	0.023	2	118.6573	0.079	4	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,5,6]H)(C[6]C[6]O)(H)	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,5,6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|N<3>,2|H<1>}	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(O){2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.9490	0.000	1	118.6573	0.079	4	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,5,6]H)(C[6]C[6]O)(H)	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,5,6]H)(C[6]C[6]O)(H){1|N<3>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(O){2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.8470	0.000	1	118.6573	0.079	4	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6,6]H)(C[6]C[6]O)(H)	C[6](C[6]C[5,5,6,6]Cl2)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6,6]H)(C[6]C[6]O)(H){2|Cl<1>,1|C<3>,2|C<4>}	C[6](C[6]C[5,5,6,6]Cl2)(C[6]C[6]H)(O){1|H<1>,1|O<2>,2|C<4>}	H(C[6]C[6]2)	118.1810	0.000	1	118.1810	0.000	1	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6,6]H)(C[6]C[6]O)(H)	C[6](C[6]C[5,6,6]HH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6,6]H)(C[6]C[6]O)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6,6]HH)(C[6]C[6]H)(O){1|H<1>,1|N<3>,2|C<4>}	H(C[6]C[6]2)	118.8290	0.000	1	118.8290	0.000	1	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6,6]H)(C[6]C[6]O)(H)	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6,6]H)(C[6]C[6]O)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(O){1|C<4>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.0350	0.000	1	118.7840	0.126	2	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6,6]H)(C[6]C[6]O)(H)	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6,6]H)(C[6]C[6]O)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(O){2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.5330	0.000	1	118.7840	0.126	2	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6,6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6,6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|N<3>,2|H<1>}	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(O){2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.0150	0.000	1	119.0150	0.000	1	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[6]O)(H)	C[6](C[6]C[5,6]CH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[6]O)(H){1|C<4>,1|H<1>,2|C<3>}	C[6](C[6]C[5,6]CH)(C[6]C[6]H)(O){1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	117.8950	0.000	1	117.8950	0.000	1	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[6]O)(H)	C[6](C[6]C[5,6]C[6a]H)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[6]O)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]C[6a]H)(C[6]C[6]H)(O){1|H<1>,2|C<3>,3|C<4>}	H(C[6]C[6]2)	112.0570	0.000	1	112.0570	0.000	1	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[6]O)(H)	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[6]O)(H){2|C<4>,3|H<1>}	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(O){1|H<1>,3|C<4>}	H(C[6]C[6]2)	116.2075	3.245	2	116.2075	10.529	2	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[6]O)(H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(O){1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	117.9260	0.000	1	117.9260	0.000	1	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6]C[6])(C[6]C[6]O)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C[6])(C[6]C[6]O)(H){3|C<4>,5|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(O){4|C<4>}	H(C[6]C[6]2)	119.0350	0.000	1	119.0350	0.000	1	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6]C[6a])(C[6]C[6]O)(H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C[6a])(C[6]C[6]O)(H){1|H<1>,2|C<4>,4|C<3>}	C[6](C[6]C[6]CH)(C[6]C[6]H)(O){1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	117.9270	0.000	1	117.9270	0.000	1	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6]C[6a])(C[6]C[6]O)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C[6a])(C[6]C[6]O)(H){1|C<4>,2|H<1>,4|C<3>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(O){1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	117.8260	0.000	1	117.8260	0.000	1	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	C[6](C[6]C[5,6]BrH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|Br<1>,1|H<1>,1|O<2>,2|C<4>}	C[6](C[6]C[5,6]BrH)(C[6]C[6]H)(O){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	118.8300	0.413	2	118.8300	0.171	2	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	C[6](C[6]C[5,6]CH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,3|C<4>}	C[6](C[6]C[5,6]CH)(C[6]C[6]H)(O){2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.5140	0.000	1	118.5140	0.000	1	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	C[6](C[6]C[5,6]ClH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|Cl<1>,1|H<1>,1|O<2>,2|C<4>}	C[6](C[6]C[5,6]ClH)(C[6]C[6]H)(O){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	118.9832	0.304	5	118.9832	0.093	5	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|N<3>,2|H<1>}	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(O){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	118.8473	0.235	4	118.7541	0.416	35	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|N<3>,2|H<1>}	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(O){2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.9400	0.000	1	118.7541	0.416	35	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|O<2>,2|H<1>}	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(O){2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.1810	0.000	1	118.7541	0.416	35	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(O){1|C<4>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	117.7970	0.000	1	118.7541	0.416	35	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|N<3>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(O){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	118.6785	0.312	2	118.7541	0.416	35	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|N<3>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(O){2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.9306	0.124	5	118.7541	0.416	35	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(O){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	118.9473	0.196	6	118.7541	0.416	35	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(O){1|C<4>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	118.8820	0.277	3	118.7541	0.416	35	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(O){1|C<4>,1|O<2>,2|H<1>}	H(C[6]C[6]2)	117.6953	1.946	3	118.7541	0.416	35	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(O){2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.8513	0.321	9	118.7541	0.416	35	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(O){1|C<4>,3|H<1>}	H(C[6]C[6]2)	119.0710	0.000	1	118.8860	0.068	2	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(O){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	118.7010	0.000	1	118.8860	0.068	2	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6]O)(C[6]C[6]O)(H)	C[6](C[6]C[5,6]CC)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]O)(C[6]C[6]O)(H){1|O<2>,4|C<4>}	C[6](C[6]C[5,6]CC)(C[6]C[6]H)(O){1|H<1>,1|O<2>,2|C<4>}	H(C[6]C[6]2)	118.5340	0.267	2	118.5340	0.071	2	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6]O)(C[6]C[6]O)(H)	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]O)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|O<2>,2|H<1>}	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(O){1|C<3>,1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	118.9790	0.000	1	118.9790	0.000	1	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,6]O)(C[6]C[6]O)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]O)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|O<2>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(O){1|H<1>,1|O<2>,2|C<4>}	H(C[6]C[6]2)	119.2435	0.214	19	119.2435	0.046	19	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]O)(H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]O)(H){1|C<4>,1|N<2>,2|C<3>,3|H<1>}	C[6](C[6]C[6]CH)(C[6]C[6]H)(O){1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	118.4780	0.000	1	118.5020	0.030	3	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]O)(H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]O)(H){1|C<4>,1|N<3>,2|C<3>,3|H<1>}	C[6](C[6]C[6]CH)(C[6]C[6]H)(O){1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	118.3430	0.000	1	118.5020	0.030	3	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]O)(H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]O)(H){1|C<4>,1|O<2>,2|C<3>,3|H<1>}	C[6](C[6]C[6]CH)(C[6]C[6]H)(O){1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	118.6850	0.000	1	118.5020	0.030	3	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]O)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|N<3>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(O){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	117.9850	0.000	1	118.2690	0.161	2	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]O)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|S<2>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(O){1|C<3>,1|O<2>,2|C<4>}	H(C[6]C[6]2)	118.5530	0.000	1	118.2690	0.161	2	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]C)(C[6]C[6]O)(H){2|H<1>,3|C<4>}	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(O){1|H<1>,3|C<4>}	H(C[6]C[6]2)	118.1700	0.000	1	118.1700	0.000	1	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6,6]HO)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]C)(C[6]C[6]O)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[6]C[6,6]HO)(C[6]C[6]H)(O){4|C<4>}	H(C[6]C[6]2)	118.5235	1.063	2	118.5235	1.130	2	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6,6]CC)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|C<3>,4|C<4>}	C[6](C[6]C[6,6]CC)(C[6]C[6]H)(O){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.3733	0.213	3	118.8085	1.019	31	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6,6]CC)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|C<3>,4|C<4>}	C[6](C[6]C[6,6]CC)(C[6]C[6]H)(O){2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.3640	0.371	4	118.8085	1.019	31	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6,6]CC)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|H<1>,4|C<4>}	C[6](C[6]C[6,6]CC)(C[6]C[6]H)(O){2|C<4>,2|H<1>}	H(C[6]C[6]2)	114.9350	0.000	1	118.8085	1.019	31	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6,6]CC)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){5|C<4>}	C[6](C[6]C[6,6]CC)(C[6]C[6]H)(O){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	117.9000	0.000	1	118.8085	1.019	31	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6,6]CC)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){5|C<4>}	C[6](C[6]C[6,6]CC)(C[6]C[6]H)(O){2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.8932	0.532	22	118.8085	1.019	31	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6,6]CH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[6,6]CH)(C[6]C[6]H)(O){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.2090	0.308	2	119.3063	0.076	3	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6,6]CH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[6,6]CH)(C[6]C[6]H)(O){1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.5010	0.000	1	119.3063	0.076	3	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|N<3>,2|H<1>}	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(O){1|C<4>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	118.4420	0.000	1	119.0099	0.066	25	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|O<2>,2|H<1>}	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(O){1|C<4>,1|O<2>,2|H<1>}	H(C[6]C[6]2)	119.2000	0.000	1	119.0099	0.066	25	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|O<2>,2|H<1>}	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(O){2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.9583	0.054	3	119.0099	0.066	25	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|C<4>,1|N<3>,1|O<1>,2|H<1>}	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(O){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	118.9750	0.000	1	119.0099	0.066	25	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(O){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.1713	0.194	6	119.0099	0.066	25	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(O){1|C<4>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.0512	0.299	5	119.0099	0.066	25	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(O){1|C<4>,1|O<2>,2|H<1>}	H(C[6]C[6]2)	118.9330	0.000	1	119.0099	0.066	25	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){2|C<4>,3|H<1>}	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(O){1|C<4>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	118.8720	0.000	1	119.0099	0.066	25	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){2|C<4>,3|H<1>}	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(O){2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.0378	0.215	5	119.0099	0.066	25	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){2|H<1>,3|C<4>}	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(O){2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.4770	0.000	1	119.0099	0.066	25	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6,6]HO)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|H<1>,2|C<4>,2|O<2>}	C[6](C[6]C[6,6]HO)(C[6]C[6]H)(O){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.5360	0.103	2	119.5360	0.011	2	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6,6]OO)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){2|O<2>,3|C<4>}	C[6](C[6]C[6,6]OO)(C[6]C[6]H)(O){2|C<4>,2|H<1>}	H(C[6]C[6]2)	115.5120	0.000	1	115.5120	0.000	1	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6,6]SeH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|Se<2>,1|H<1>,1|O<2>,2|C<4>}	C[6](C[6]C[6,6]SeH)(C[6]C[6]H)(O){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	118.7630	0.000	1	118.7630	0.000	1	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(O){1|C<4>,3|H<1>}	H(C[6]C[6]2)	118.4690	0.247	2	118.0330	0.508	4	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){2|H<1>,3|C<4>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(O){1|C<4>,3|H<1>}	H(C[6]C[6]2)	117.5970	0.837	2	118.0330	0.508	4	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]O)(H)	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|O<2>,2|H<1>}	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(O){1|H<1>,1|O<2>,2|C<4>}	H(C[6]C[6]2)	119.3300	0.000	1	119.1937	0.091	3	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]O)(H)	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]O)(H){1|C<3>,1|C<4>,3|H<1>}	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(O){1|H<1>,1|O<2>,2|C<4>}	H(C[6]C[6]2)	119.4030	0.000	1	119.1937	0.091	3	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]O)(H)	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]O)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(O){1|H<1>,1|O<2>,2|C<4>}	H(C[6]C[6]2)	118.8480	0.000	1	119.1937	0.091	3	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]O)(H)	C[6](C[6]C[6]BrH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]O)(H){1|Br<1>,1|H<1>,1|O<2>,2|C<4>}	C[6](C[6]C[6]BrH)(C[6]C[6]H)(O){1|C<4>,3|O<2>}	H(C[6]C[6]2)	118.5440	1.377	2	118.5440	1.897	2	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]C[6]O)(H)	C[6](C[6]C[6,6a]CO)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]C[6]O)(H){1|C<4>,1|O<2>,2|C<3>}	C[6](C[6]C[6,6a]CO)(C[6]C[6]H)(O){1|C<4>,2|C<3>}	H(C[6]C[6]2)	118.8000	0.000	1	118.8000	0.000	1	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(H)	C[6](C[6]C[6,6a]CC)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(H){1|C<4>,3|C<3>}	C[6](C[6]C[6,6a]CC)(C[6]C[6]H)(O){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.5280	0.000	1	119.5280	0.000	1	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(H)	C[6](C[6]C[6,6a]CO)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(H){1|C<4>,1|O<2>,2|C<3>}	C[6](C[6]C[6,6a]CO)(C[6]C[6]H)(O){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.5617	0.057	3	119.5617	0.003	3	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(H)	C[6](C[6]C[6,6a]C[5]C)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(H){2|C<3>,2|C<4>}	C[6](C[6]C[6,6a]C[5]C)(C[6]C[6]H)(O){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.2910	0.000	1	119.2910	0.000	1	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(H)	C[6](C[6]C[6,6a]C[6]H)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(H){1|C<4>,1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]C[6]H)(C[6]C[6]H)(O){2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.7910	0.000	1	119.7910	0.000	1	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(H)	C[6](C[6]C[6,6a]ClC)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(H){1|Cl<1>,3|C<3>}	C[6](C[6]C[6,6a]ClC)(C[6]C[6]H)(O){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.0360	0.000	1	119.0360	0.000	1	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(H)	C[6](C[6]C[6,6a]OO)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]O)(H){2|C<3>,2|O<2>}	C[6](C[6]C[6,6a]OO)(C[6]C[6]H)(O){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3215	0.101	2	120.3215	0.010	2	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]O)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]O)(H){2|C<4>,3|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(O){1|Br<1>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.0180	0.000	2	119.0180	0.000	2	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]2H)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){2|C<4>,3|H<1>}	C[6](C[6]C[6]2H)(C[6]C[6]H)(O){1|C<3>,3|C<4>,3|H<1>}	H(C[6]C[6]2)	118.0070	0.000	1	118.0070	0.000	1	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|H<1>,1|O<2>,3|C<4>}	C[6](C[6]C[6]CH)(C[6]C[6]H)(O){4|C<4>}	H(C[6]C[6]2)	118.3150	0.000	1	118.3513	0.044	3	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[6]C[6]CH)(C[6]C[6]H)(O){1|H<1>,1|O<2>,2|C<4>}	H(C[6]C[6]2)	118.5760	0.000	1	118.3513	0.044	3	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){2|C<4>,3|H<1>}	C[6](C[6]C[6]CH)(C[6]C[6]H)(O){2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.1630	0.000	1	118.3513	0.044	3	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]CO)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|H<1>,1|O<2>}	C[6](C[6]C[6]CO)(C[6]C[6]H)(O){1|C<3>,2|C<4>}	H(C[6]C[6]2)	119.7190	0.126	2	119.7190	0.016	2	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]FH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|C<4>,1|F<1>,1|O<2>,2|H<1>}	C[6](C[6]C[6]FH)(C[6]C[6]H)(O){1|H<1>,1|O<2>,2|C<4>}	H(C[6]C[6]2)	118.1250	0.280	2	118.1250	0.078	2	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|F<1>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(O){1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	117.8450	0.000	1	118.4283	0.071	26	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|C<3>,1|C<4>,3|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(O){1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	117.7830	0.000	1	118.4283	0.071	26	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|C<3>,1|C<4>,3|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(O){4|C<4>}	H(C[6]C[6]2)	118.4405	0.035	4	118.4283	0.071	26	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(O){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	118.8495	0.052	2	118.4283	0.071	26	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(O){1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	118.3730	0.000	1	118.4283	0.071	26	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(O){1|C<3>,3|C<4>}	H(C[6]C[6]2)	118.3050	0.023	2	118.4283	0.071	26	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(O){1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	118.3610	0.000	1	118.4283	0.071	26	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(O){1|C<4>,3|C<3>}	H(C[6]C[6]2)	118.3630	0.000	1	118.4283	0.071	26	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(O){2|C<3>,2|C<4>}	H(C[6]C[6]2)	118.6427	0.249	3	118.4283	0.071	26	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(O){2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.4628	0.246	6	118.4283	0.071	26	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(O){4|C<4>}	H(C[6]C[6]2)	118.4990	0.099	2	118.4283	0.071	26	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){2|H<1>,3|C<4>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(O){1|H<1>,3|C<4>}	H(C[6]C[6]2)	118.3185	0.029	2	118.4283	0.071	26	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]HO)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|C<4>,2|H<1>,2|O<2>}	C[6](C[6]C[6]HO)(C[6]C[6]H)(O){1|H<1>,1|O<2>,2|C<4>}	H(C[6]C[6]2)	118.3780	0.000	1	118.3780	0.000	1	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]HS)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|S<4>,2|C<4>,2|H<1>}	C[6](C[6]C[6]HS)(C[6]C[6]H)(O){1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	117.6060	0.000	1	117.6060	0.000	1	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]O)(H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]O)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[6]C[6]CH)(C[6]C[6]H)(O){1|Cl<1>,1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.1300	0.448	2	119.1300	0.201	2	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<4>,1|O<1>,2|H<1>}	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(O){1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.0280	0.000	1	119.0280	0.000	1	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[5,6]HO)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]HO)(C[6]C[6]H)(O){1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.6740	0.000	1	119.6740	0.000	1	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]2C)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){2|H<1>,3|C<4>}	C[6](C[6]C[6]2C)(C[6]C[6]H)(O){1|C<3>,2|C<4>,4|H<1>}	H(C[6]C[6]2)	118.4200	0.000	1	118.6965	0.153	2	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]2C)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){5|C<4>}	C[6](C[6]C[6]2C)(C[6]C[6]H)(O){1|C<3>,3|C<4>,3|H<1>}	H(C[6]C[6]2)	118.9730	0.000	1	118.6965	0.153	2	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]2H)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|H<1>,4|C<4>}	C[6](C[6]C[6]2H)(C[6]C[6]H)(O){1|C<3>,2|C<4>,4|H<1>}	H(C[6]C[6]2)	118.4292	0.218	5	118.4292	0.048	5	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]CC)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){5|C<4>}	C[6](C[6]C[6]CC)(C[6]C[6]H)(O){2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.6527	0.456	3	118.6527	0.208	3	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|H<1>,2|C<3>,2|C<4>}	C[6](C[6]C[6]CH)(C[6]C[6]H)(O){1|C<4>,3|H<1>}	H(C[6]C[6]2)	118.9870	0.000	1	118.9733	0.264	4	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[6]C[6]CH)(C[6]C[6]H)(O){2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.7590	0.000	1	118.9733	0.264	4	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){2|C<4>,3|H<1>}	C[6](C[6]C[6]CH)(C[6]C[6]H)(O){1|C<4>,3|H<1>}	H(C[6]C[6]2)	119.0735	0.852	2	118.9733	0.264	4	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]CO)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|H<1>,1|O<2>}	C[6](C[6]C[6]CO)(C[6]C[6]H)(O){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.2605	0.136	2	119.1393	0.038	6	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]CO)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|H<1>,1|N<3>,1|O<2>,2|C<4>}	C[6](C[6]C[6]CO)(C[6]C[6]H)(O){2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.9540	0.000	1	119.1393	0.038	6	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]CO)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|H<1>,2|C<4>,2|O<2>}	C[6](C[6]C[6]CO)(C[6]C[6]H)(O){1|C<4>,1|O<2>,2|H<1>}	H(C[6]C[6]2)	119.1203	0.232	3	119.1393	0.038	6	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]CS)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|S<2>,3|C<4>}	C[6](C[6]C[6]CS)(C[6]C[6]H)(O){1|C<4>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	118.0350	0.000	1	118.0350	0.000	1	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(O){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	114.6130	4.272	2	117.8256	6.681	8	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<4>,1|N<3>,3|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(O){1|C<4>,3|H<1>}	H(C[6]C[6]2)	118.9540	0.000	1	117.8256	6.681	8	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<4>,1|O<2>,3|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(O){1|C<4>,1|O<2>,2|H<1>}	H(C[6]C[6]2)	119.4560	0.000	1	117.8256	6.681	8	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(O){1|C<4>,3|H<1>}	H(C[6]C[6]2)	118.4335	0.433	2	117.8256	6.681	8	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(O){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.1280	0.000	1	117.8256	6.681	8	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){2|H<1>,3|C<4>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(O){2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.9740	0.000	1	117.8256	6.681	8	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]OO)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,2|O<2>}	C[6](C[6]C[6]OO)(C[6]C[6]H)(O){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.2040	0.000	1	119.2040	0.000	1	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]PdH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Pd<4>,1|C<4>,1|H<1>,1|O<1>}	C[6](C[6]C[6]PdH)(C[6]C[6]H)(O){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.4495	0.241	2	119.4495	0.058	2	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]SiH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Si<4>,1|C<4>,3|H<1>}	C[6](C[6]C[6]SiH)(C[6]C[6]H)(O){1|C<4>,3|H<1>}	H(C[6]C[6]2)	116.6890	0.000	1	116.6890	0.000	1	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6a]C[6]H)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,3|H<1>}	C[6](C[6]C[6a]C[6]H)(C[6]C[6]H)(O){2|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.6770	0.000	1	118.6770	0.000	1	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6a]N[6]H)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|N<3>,1|O<2>,2|H<1>}	C[6](C[6]C[6a]N[6]H)(C[6]C[6]H)(O){1|C<4>,1|H<1>,1|S<4>,2|C<3>}	H(C[6]C[6]2)	118.6830	0.000	1	118.9775	0.173	2	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6a]N[6]H)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|N<3>,3|H<1>}	C[6](C[6]C[6a]N[6]H)(C[6]C[6]H)(O){1|C<4>,1|H<1>,1|S<4>,2|C<3>}	H(C[6]C[6]2)	119.2720	0.000	1	118.9775	0.173	2	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]O[6]CH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<4>,2|H<1>,2|O<2>}	C[6](C[6]O[6]CH)(C[6]C[6]H)(O){1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.6670	0.000	1	119.6670	0.000	1	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]I)(C[6]C[6]O)(H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]I)(C[6]C[6]O)(H){1|H<1>,1|O<1>,2|C<4>}	C[6](C[6]C[6]CH)(C[6]C[6]H)(O){1|C<3>,1|I<1>,2|H<1>}	H(C[6]C[6]2)	118.8040	0.000	1	118.8040	0.000	1	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]I)(C[6]C[6]O)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]I)(C[6]C[6]O)(H){1|C<4>,1|O<2>,3|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(O){1|C<4>,1|H<1>,1|I<1>,1|O<2>}	H(C[6]C[6]2)	119.0990	0.000	1	119.0990	0.000	1	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]C[6]O)(H)	C[6](C[6]C[6]CC)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]C[6]O)(H){2|H<1>,3|C<4>}	C[6](C[6]C[6]CC)(C[6]C[6]H)(O){1|C<4>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	116.8880	0.000	1	116.8880	0.000	1	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]C[6]O)(H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]C[6]O)(H){1|C<3>,1|C<4>,3|H<1>}	C[6](C[6]C[6]CH)(C[6]C[6]H)(O){1|H<1>,1|N<3>,2|C<4>}	H(C[6]C[6]2)	117.9155	1.309	2	117.9155	1.713	2	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]C[6]O)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]C[6]O)(H){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(O){1|C<4>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	118.2210	1.721	7	118.6489	1.398	25	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]C[6]O)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]C[6]O)(H){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(O){1|N<3>,1|O<2>,2|C<4>}	H(C[6]C[6]2)	118.5760	0.000	1	118.6489	1.398	25	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]N)(C[6]C[6]O)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]C[6]O)(H){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(O){1|N<3>,3|C<4>}	H(C[6]C[6]2)	118.8294	0.933	17	118.6489	1.398	25	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]C)(H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]C)(H){1|C<4>,1|H<1>,2|C<3>}	C[6](C[6]C[6]CH)(C[6]C[6]H)(O){1|C<3>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	118.4820	0.000	1	118.4820	0.000	1	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|C<3>,1|C<4>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(O){1|C<2>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.2855	0.173	2	119.2986	0.085	5	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|C<4>,1|S<4>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(O){1|C<3>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	118.9720	0.000	1	119.2986	0.085	5	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){2|C<4>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(O){1|C<3>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7410	0.000	1	119.2986	0.085	5	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){2|C<4>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(O){1|C<4>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.2090	0.000	1	119.2986	0.085	5	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]O)(C[6]O[6]H)(H)	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]O[6]H)(H){1|C<4>,2|H<1>}	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(O){1|H<1>,1|O<2>,2|C<3>}	H(C[6]C[6]2)	119.5930	0.192	2	119.5930	0.037	2	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]O)(C[6]O[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]O[6]H)(H){1|C<4>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(O){1|C<3>,1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.8320	0.000	1	120.0136	1.753	7	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]O)(C[6]O[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]O[6]H)(H){1|C<4>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(O){1|C<3>,1|O<2>,2|H<1>}	H(C[6]C[6]2)	119.2165	0.490	2	120.0136	1.753	7	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]O)(C[6]O[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]O[6]H)(H){1|C<4>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(O){1|C<4>,1|O<2>,2|H<1>}	H(C[6]C[6]2)	120.4575	1.652	4	120.0136	1.753	7	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]O)(C[6]O[6]O)(H)	C[6](C[6]C[6]CC)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]O[6]O)(H){3|C<4>}	C[6](C[6]C[6]CC)(C[6]C[6]H)(O){1|C<4>,1|H<1>,1|O<1>,1|O<2>}	H(C[6]C[6]2)	119.5560	0.151	2	119.5560	0.023	2	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]O)(C[6]S[6]C)(H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]S[6]C)(H){1|H<1>,2|C<4>}	C[6](C[6]C[6]CH)(C[6]C[6]H)(O){1|C<4>,1|S<2>,2|H<1>}	H(C[6]C[6]2)	117.3410	0.000	1	117.3410	0.000	1	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]O)2(H)	C[6](C[6]C[6]CF)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]O)2(H){1|C<4>,2|C<3>,2|F<1>}	C[6](C[6]C[6]CF)(C[6]C[6]H)(O){1|C<3>,1|C<4>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	117.6750	2.288	2	117.6750	5.236	2	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]O)2(H)	C[6](C[6]C[6]CO)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]O)2(H){1|C<3>,1|O<2>,3|C<4>}	C[6](C[6]C[6]CO)(C[6]C[6]H)(O){1|C<4>,1|O<1>,1|O<2>}	H(C[6]C[6]2)	118.4553	0.280	3	118.4553	0.078	3	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]O)2(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]O)2(H){1|C<3>,1|C<4>,1|N<3>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(O){1|C<4>,1|O<2>,2|H<1>}	H(C[6]C[6]2)	118.6990	0.000	1	119.1208	3.340	17	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]O)2(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]O)2(H){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(O){1|C<4>,1|O<1>,2|H<1>}	H(C[6]C[6]2)	118.1325	0.419	2	119.1208	3.340	17	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]O)2(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]O)2(H){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(O){1|C<4>,1|O<2>,2|H<1>}	H(C[6]C[6]2)	118.4410	0.000	1	119.1208	3.340	17	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]O)2(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]O)2(H){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(O){1|H<1>,1|O<1>,2|C<4>}	H(C[6]C[6]2)	118.3972	3.815	4	119.1208	3.340	17	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]O)2(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]O)2(H){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(O){1|O<2>,3|C<4>}	H(C[6]C[6]2)	119.7844	0.346	9	119.1208	3.340	17	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]O)2(H)	C[6](C[6]N[6]CH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6]O)2(H){1|C<4>,1|N<3>,3|H<1>}	C[6](C[6]N[6]CH)(C[6]C[6]H)(O){1|C<3>,1|C<4>,1|O<2>}	H(C[6]C[6]2)	119.9320	0.000	1	119.9320	0.000	1	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]O)(H)	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]O)(H){1|C<4>,2|C<2>,2|C<3>,2|H<1>}	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(O){1|C<4>,3|C<3>}	H(C[6]C[6]2)	117.8160	0.000	1	117.8160	0.000	1	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]O)(H)	C[6](C[6]C[6]CC)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]O)(H){2|C<4>,2|H<1>,3|C<3>}	C[6](C[6]C[6]CC)(C[6]C[6]H)(O){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	115.3780	0.000	1	115.3780	0.000	1	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]O)(H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]O)(H){1|C<4>,3|C<3>,3|H<1>}	C[6](C[6]C[6]CH)(C[6]C[6]H)(O){1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	118.1256	0.214	12	118.1256	0.046	12	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]O)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]O)(H){1|C<4>,1|O<2>,2|C<3>,3|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(O){1|C<3>,1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	118.7480	0.000	1	118.5370	0.055	3	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]O)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]O)(H){1|C<4>,2|C<3>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(O){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	118.5770	0.000	1	118.5370	0.055	3	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]O)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]O)(H){1|C<4>,2|C<3>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(O){1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	118.2860	0.000	1	118.5370	0.055	3	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]O)(H)	C[6](C[6]C[6]HS)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]O)(H){1|C<4>,1|S<4>,2|C<3>,3|H<1>}	C[6](C[6]C[6]HS)(C[6]C[6]H)(O){1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	117.7050	0.115	2	117.7050	0.013	2	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]O)(H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]O)(H){1|C<4>,1|H<1>,4|C<3>}	C[6](C[6]C[6]CH)(C[6]C[6]H)(O){1|C<3>,1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	112.7020	0.000	1	112.7020	0.000	1	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6a]O[6])(C[6]C[6]O)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6a]O[6])(C[6]C[6]O)(H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(O){1|C<3>,1|O<2>,2|H<1>}	H(C[6]C[6]2)	119.1820	0.000	1	119.1820	0.000	1	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]N[5,6]C[6a])(C[6]C[6]O)(H)	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]N[5,6]C[6a])(C[6]C[6]O)(H){2|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(O){1|C<3>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.1693	0.242	3	119.1940	0.041	4	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]N[5,6]C[6a])(C[6]C[6]O)(H)	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]N[5,6]C[6a])(C[6]C[6]O)(H){2|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(O){1|C<3>,1|N<3>,2|C<4>}	H(C[6]C[6]2)	119.2680	0.000	1	119.1940	0.041	4	118.7034	1.278	369	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ru2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ru<7>,1|Ru<9>,1|C<4>,1|H<1>}	C[6](N[6]C[6]Ru2)(C[6]C[6]H)(H){1|C<3>,2|C<4>}	H(C[6]C[6]2)	119.1835	0.107	2	119.3950	0.140	3	120.3192	1.544	14	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ru2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ru<8>,1|Ru<9>,1|C<4>,1|H<1>}	C[6](N[6]C[6]Ru2)(C[6]C[6]H)(H){1|Rh<8>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	119.8180	0.000	1	119.3950	0.140	3	120.3192	1.544	14	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]CeO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ce<16>,1|C<4>,1|H<1>,1|O<2>}	C[6](N[6]C[6]CeO)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.1294	0.320	7	120.1294	0.103	7	120.3192	1.544	14	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ru2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){2|Ru<9>,1|C<5>,1|H<1>}	C[6](N[6]C[6]Ru2)(C[6]C[6]H)(H){1|Ru<9>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	124.3510	0.000	1	124.3510	0.000	1	120.3192	1.544	14	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6]RuC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<10>,1|C<3>,1|C<4>,1|H<1>}	C[6](N[6]C[6]RuC)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4760	0.025	2	120.4760	0.001	2	120.3192	1.544	14	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	N[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](N[6]C[6]Ru2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|Ru<10>,1|Ru<8>,1|C<4>,1|H<1>}	C[6](N[6]C[6]Ru2)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<2>}	H(C[6]C[6]2)	120.0750	0.000	1	120.0750	0.000	1	120.3192	1.544	14	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	P[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]P[6]H)(H)	C[6](P[6]C[6]Cu2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]P[6]H)(H){2|Cu<4>,1|C<3>,1|H<1>}	C[6](P[6]C[6]Cu2)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	118.3730	0.000	1	118.3730	0.000	1	117.4602	3.316	5	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	P[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]P[6]H)(H)	C[6](P[6]C[6]N[6]2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]P[6]H)(H){1|C<3>,1|H<1>,2|N<3>}	C[6](P[6]C[6]N[6]2)(C[6]C[6]H)(H){1|C<3>,2|H<1>,4|C<4>}	H(C[6]C[6]2)	117.7485	3.340	2	117.7485	11.153	2	117.4602	3.316	5	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	P[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(C[6]P[6]H)(H)	C[6](P[6]C[6]RuO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]P[6]H)(H){1|Ru<9>,1|O<2>,2|C<4>}	C[6](P[6]C[6]RuO)(C[6]C[6]H)(H){1|C<3>,1|P<4>,2|H<1>}	H(C[6]C[6]2)	116.7155	0.052	2	116.7155	0.003	2	117.4602	3.316	5	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	Si[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]Si[5,6]H)(C[6]C[6]C)(H)	C[6](Si[5,6]C[5]2C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]Si[5,6]H)(C[6]C[6]C)(H){2|C<3>,2|C<4>}	C[6](Si[5,6]C[5]2C[6])(C[6]C[6]H)(H){4|Si<4>,1|H<1>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	115.3510	0.000	1	115.3510	0.000	1	115.3510	0.000	1	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:C[6]-3:H-1:	Si[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]Si[6]O)(H)	C[6](Si[6]C[6,6a]CC)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]Si[6]O)(H){2|C<3>,2|C<4>}	C[6](Si[6]C[6,6a]CC)(C[6]C[6]H)(O){1|H<1>,2|C<3>}	H(C[6]C[6]2)	117.8250	0.000	1	117.8250	0.000	1	117.8250	0.000	1	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[3,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[3,6]H)(N[6]C[6]S)(H)	C[6](C[3,6]C[3,6]C[3]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[3,6]H)(N[6]C[6]S)(H){2|H<1>,3|C<4>}	C[6](C[3,6]C[3,6]C[3]C)(C[6]N[6]H)(H){1|S<4>,2|C<4>,2|H<1>}	H(C[6]C[6]N[6])	122.0135	3.391	2	122.0135	11.496	2	120.2418	5.534	5	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[3,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[3,6]H)(N[6]C[6]S)(H)	C[6](C[3,6]C[3,6]C[3]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[3,6]H)(N[6]C[6]S)(H){2|C<4>,3|H<1>}	C[6](C[3,6]C[3,6]C[3]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|S<4>,2|H<1>}	H(C[6]C[6]N[6])	119.0970	0.413	2	119.0970	0.171	2	120.2418	5.534	5	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[3,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[3,6]H)(N[6]C[6]S)(H)	C[6](C[3,6]C[3,6]C[6a]C[3])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[3,6]H)(N[6]C[6]S)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[3,6]C[3,6]C[6a]C[3])(C[6]N[6]H)(H){1|C<4>,1|S<4>,2|C<3>,3|H<1>}	H(C[6]C[6]N[6])	118.9880	0.000	1	118.9880	0.000	1	120.2418	5.534	5	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[4,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[4,6]H)(N[6]C[6]C)(H)	C[6](C[4,6]C[4,5,6]C[4]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[4,6]H)(N[6]C[6]C)(H){1|H<1>,1|O<1>,2|C<4>}	C[6](C[4,6]C[4,5,6]C[4]H)(C[6]N[6]H)(H){1|C<2>,1|C<3>,4|C<4>}	H(C[6]C[6]N[6])	117.8650	0.000	1	117.8650	0.000	1	118.8513	0.731	3	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[4,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[4,6]H)(N[6]C[6]S)(H)	C[6](C[4,6]C[4]2C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[4,6]H)(N[6]C[6]S)(H){1|C<4>,1|H<1>,2|C<3>}	C[6](C[4,6]C[4]2C[6])(C[6]N[6]H)(H){1|N<3>,1|O<1>,1|S<4>,2|C<3>,2|H<1>}	H(C[6]C[6]N[6])	119.3445	0.047	2	119.3445	0.002	2	118.8513	0.731	3	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(N[6]C[6]S)(H)	C[6](C[5,6]C[5,6a]C[5]C[6])(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[5,6]H)(N[6]C[6]S)(H){1|H<1>,3|C<3>}	C[6](C[5,6]C[5,6a]C[5]C[6])(C[6]N[6]H)(H){1|H<1>,1|N<3>,1|O<1>,1|S<4>,3|C<3>}	H(C[6]C[6]N[6])	119.1955	0.156	2	119.1955	0.024	2	119.1955	0.024	2	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6,6]-4:C[6]-3:F-1:	C[6]-3:	C[6](C[6]C[6,6]F)(N[6]C[6,6]C)(H)	C[6](C[6,6]C[6,6]2H)(C[6]N[6]H)(F)	H(C[6]C[6]N[6])	C[6](C[6]C[6,6]F)(N[6]C[6,6]C)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[6,6]C[6,6]2H)(C[6]N[6]H)(F){1|F<1>,1|H<1>,2|C<3>,3|C<4>}	H(C[6]C[6]N[6])	119.9970	0.000	1	119.9970	0.000	1	119.9970	0.000	1	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(N[6]C[6,6]C)(H)	C[6](C[6,6]C[6,6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6,6]H)(N[6]C[6,6]C)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[6,6]C[6,6]C[6]H)(C[6]N[6]H)(H){1|C<4>,1|I<1>,2|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.9280	0.000	1	118.9280	0.000	1	118.7525	0.062	2	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(N[6]C[6,6]S)(H)	C[6](C[6,6]C[6,6a]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6,6]H)(N[6]C[6,6]S)(H){1|C<4>,1|H<1>,1|O<2>,2|C<3>}	C[6](C[6,6]C[6,6a]C[6,6]H)(C[6]N[6]H)(H){1|H<1>,1|S<4>,2|C<3>,2|C<4>}	H(C[6]C[6]N[6])	118.5770	0.000	1	118.5770	0.000	1	118.7525	0.062	2	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]B[6]C)(H)	C[6](C[6]C[6]HH)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]B[6]C)(H){1|C<4>,1|N<3>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]N[6]H)(H){1|B<3>,1|C<4>,2|H<1>}	H(C[6]C[6]N[6])	119.7770	1.748	2	119.7770	3.055	2	119.5886	2.608	31	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]B)(H)	C[6](C[6]C[6]HH)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]B)(H){1|C<3>,3|H<1>}	C[6](C[6]C[6]HH)(C[6]N[6]H)(H){1|B<3>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.8770	0.464	2	117.8770	0.215	2	119.5886	2.608	31	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[5]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,1|C<4>,2|H<1>}	C[6](C[6]C[5]C[6]H)(C[6]N[6]H)(H){1|C<2>,1|H<1>,4|C<3>}	H(C[6]C[6]N[6])	119.1940	0.000	1	119.1940	0.000	1	119.5886	2.608	31	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6]HH)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,3|H<1>}	C[6](C[6]C[6]HH)(C[6]N[6]H)(H){1|C<2>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	118.7670	0.076	2	119.8390	2.591	4	119.5886	2.608	31	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6]HH)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,3|H<1>}	C[6](C[6]C[6]HH)(C[6]N[6]H)(H){1|C<4>,2|C<3>}	H(C[6]C[6]N[6])	122.1700	0.000	1	119.8390	2.591	4	119.5886	2.608	31	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6]HH)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){2|C<3>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	119.6520	0.000	1	119.8390	2.591	4	119.5886	2.608	31	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6]HW)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,1|C<4>,1|W<7>,2|H<1>}	C[6](C[6]C[6]HW)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	123.0735	4.098	2	120.9000	8.441	5	119.5886	2.608	31	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6]HW)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|W<7>,2|C<4>,2|H<1>}	C[6](C[6]C[6]HW)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	119.4510	0.782	3	120.9000	8.441	5	119.5886	2.608	31	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6a]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<4>,1|H<1>,2|C<3>}	C[6](C[6]C[6a]C[6]H)(C[6]N[6]H)(H){1|C<4>,4|C<3>}	H(C[6]C[6]N[6])	118.9060	0.000	1	120.8795	7.789	2	119.5886	2.608	31	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	C[6](C[6]C[6a]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]C)(H){2|C<3>,2|H<1>}	C[6](C[6]C[6a]C[6]H)(C[6]N[6]H)(H){1|C<4>,4|C<3>}	H(C[6]C[6]N[6])	122.8530	0.000	1	120.8795	7.789	2	119.5886	2.608	31	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]DH)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|D<1>,2|H<1>}	C[6](C[6]C[6]DH)(C[6]N[6]H)(H){1|C<2>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.7420	0.000	1	118.7420	0.000	1	119.5886	2.608	31	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	C[6](C[6]C[6]HW)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<4>,1|W<7>,2|H<1>}	C[6](C[6]C[6]HW)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	120.2160	0.000	1	120.2160	0.000	1	119.5886	2.608	31	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	C[6](C[6]C[6a]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|H<1>,3|C<3>}	C[6](C[6]C[6a]C[6]H)(C[6]N[6]H)(H){1|O<1>,4|C<3>}	H(C[6]C[6]N[6])	119.8760	0.191	2	119.8760	0.036	2	119.5886	2.608	31	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]S)(H)	C[6](C[6]C[5a]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]S)(H){2|C<3>,2|H<1>}	C[6](C[6]C[5a]C[6]H)(C[6]N[6]H)(H){1|H<1>,1|S<4>,3|C<3>}	H(C[6]C[6]N[6])	118.6155	0.112	2	118.6155	0.013	2	119.5886	2.608	31	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]S)(H)	C[6](C[6]C[6]HH)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]S)(H){1|C<3>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|S<4>}	H(C[6]C[6]N[6])	119.0510	0.000	1	119.0510	0.000	1	119.5886	2.608	31	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]S)(H)	C[6](C[6]C[6a]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]S)(H){1|C<3>,1|C<4>,1|H<1>,1|O<1>}	C[6](C[6]C[6a]C[6]H)(C[6]N[6]H)(H){1|C<4>,1|H<1>,1|S<4>,3|C<3>}	H(C[6]C[6]N[6])	119.0250	0.000	1	118.7508	0.074	5	119.5886	2.608	31	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]S)(H)	C[6](C[6]C[6a]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]S)(H){1|C<3>,1|C<4>,3|H<1>}	C[6](C[6]C[6a]C[6]H)(C[6]N[6]H)(H){1|H<1>,1|S<4>,2|C<3>,2|C<4>}	H(C[6]C[6]N[6])	118.3320	0.000	1	118.7508	0.074	5	119.5886	2.608	31	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]S)(H)	C[6](C[6]C[6a]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]S)(H){2|C<3>,2|H<1>}	C[6](C[6]C[6a]C[6]H)(C[6]N[6]H)(H){1|C<4>,1|S<4>,3|C<3>}	H(C[6]C[6]N[6])	118.7435	0.146	2	118.7508	0.074	5	119.5886	2.608	31	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]S)(H)	C[6](C[6]C[6a]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]S)(H){2|C<3>,2|H<1>}	C[6](C[6]C[6a]C[6]H)(C[6]N[6]H)(H){1|S<4>,4|C<3>}	H(C[6]C[6]N[6])	118.9100	0.000	1	118.7508	0.074	5	119.5886	2.608	31	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]C[6]S)(H)	C[6](C[6]O[6]HH)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]C[6]S)(H){1|C<3>,1|O<2>,2|H<1>}	C[6](C[6]O[6]HH)(C[6]N[6]H)(H){1|C<3>,1|S<4>}	H(C[6]C[6]N[6])	119.4905	0.019	2	119.4905	0.000	2	119.5886	2.608	31	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	C[6]-3:N[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)(N[6]N[6]H)(H)	C[6](C[6]C[6a]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]H)(N[6]N[6]H)(H){1|Re<6>,1|H<1>,2|C<3>}	C[6](C[6]C[6a]C[6]H)(C[6]N[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]N[6])	119.4040	0.000	1	119.4040	0.000	1	119.5886	2.608	31	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	N[5a,6]-3:C[6]-3:H-1:	C[5,6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](N[5a,6]N[5a,6]C[5a])(C[6]C[5,6,6]H)(H)	C[6](C[5,6,6]C[5,6,6]N[5,5,6]H)(C[6]N[5a,6]H)(H)	H(C[6]N[5a,6]C[6])	C[6](N[5a,6]N[5a,6]C[5a])(C[6]C[5,6,6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|O<1>,2|N<3>}	C[6](C[5,6,6]C[5,6,6]N[5,5,6]H)(C[6]N[5a,6]H)(H){1|C<3>,1|H<1>,1|N<3>,1|S<4>,2|C<4>}	H(C[6]N[5a,6]C[6])	119.1480	0.093	2	119.1480	0.009	2	119.1480	0.009	2	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	N[5a,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](N[5a,6]C[5a,6,6]C[5a,6a])(C[6]C[6,6]H)(H)	C[6](C[6,6]C[3x6]C[6]C)(C[6]N[5a,6]H)(H)	H(C[6]N[5a,6]C[6])	C[6](N[5a,6]C[5a,6,6]C[5a,6a])(C[6]C[6,6]H)(H){3|C<3>,3|C<4>}	C[6](C[6,6]C[3x6]C[6]C)(C[6]N[5a,6]H)(H){1|C<4>,1|N<3>,2|C<3>,3|H<1>}	H(C[6]N[5a,6]C[6])	119.9990	0.112	2	119.9990	0.012	2	119.9990	0.012	2	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	N[6,6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](N[6,6]C[5a,6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]N[5a,6]HH)(C[6]N[6,6]H)(H)	H(C[6]N[6,6]C[6])	C[6](N[6,6]C[5a,6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|N<2>,1|N<3>,3|H<1>}	C[6](C[6]N[5a,6]HH)(C[6]N[6,6]H)(H){3|C<3>}	H(C[6]N[6,6]C[6])	120.1780	0.000	1	120.1780	0.000	1	120.1780	0.000	1	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[4x6]-4:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[4,6,6]C)(C[6]C[4x6]H)(H)	C[6](C[4x6]C[4,4x6]C[5x6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[4,6,6]C)(C[6]C[4x6]H)(H){2|H<1>,3|C<4>}	C[6](C[4x6]C[4,4x6]C[5x6]H)(C[6]N[6]H)(H){2|N<3>,5|C<4>}	H(C[6]C[6]N[6])	117.5640	0.061	2	117.5640	0.004	2	117.5640	0.004	2	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6]C[6a])(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6]O[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6]C[6a])(C[6]C[6,6]H)(H){1|C<4>,1|O<2>,2|H<1>,3|C<3>}	C[6](C[6,6]C[6,6]O[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>,2|C<4>}	H(C[6]C[6]N[6])	118.4880	0.000	1	118.4880	0.000	1	118.4880	0.000	1	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:Cl-1:	C[6]-3:	C[6](N[6]B[5]C[6])(C[6]C[6]Cl)(H)	C[6](C[6]C[6]HH)(C[6]N[6]H)(Cl)	H(C[6]C[6]N[6])	C[6](N[6]B[5]C[6])(C[6]C[6]Cl)(H){1|C<3>,2|O<2>,3|H<1>}	C[6](C[6]C[6]HH)(C[6]N[6]H)(Cl){1|Cl<1>,1|B<3>,1|C<3>}	H(C[6]C[6]N[6])	119.1003	0.390	4	119.1003	0.152	4	119.1003	0.152	4	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](N[6]B[5]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]B[5]C[6])(C[6]C[6]H)(H){2|C<3>,2|H<1>,2|O<2>}	C[6](C[6]C[6]HH)(C[6]N[6]H)(H){1|B<3>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.6040	0.000	1	118.6040	0.000	1	118.0158	1.357	55	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](N[6]B[5a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]2N)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]B[5a]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,3|N<3>}	C[6](C[6]C[6]2N)(C[6]N[6]H)(H){1|B<3>,1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]N[6])	117.9070	0.286	4	117.9070	0.082	4	118.0158	1.357	55	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[5,6]S)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]C[6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[5,6]S)(C[6]C[6]H)(H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]C[5,6]C[6a]H)(C[6]N[6]H)(H){1|C<4>,1|H<1>,1|S<4>,3|C<3>}	H(C[6]C[6]N[6])	118.4578	0.590	13	118.4578	0.348	13	118.0158	1.357	55	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[5]C[6])(C[6]C[6]H)(H)	C[6](C[6]N[6]OsO)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[5]C[6])(C[6]C[6]H)(H){1|Os<8>,1|C<4>,1|H<1>,1|N<3>,1|O<1>,2|O<2>}	C[6](C[6]N[6]OsO)(C[6]N[6]H)(H){1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	119.1200	0.000	1	119.1200	0.000	1	118.0158	1.357	55	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6a]C)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]CC)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]C)(C[6]C[6]H)(H){2|C<3>,2|C<4>}	C[6](C[6]C[6,6a]CC)(C[6]N[6]H)(H){1|C<4>,2|C<3>}	H(C[6]C[6]N[6])	118.3800	0.269	2	118.3800	0.072	2	118.0158	1.357	55	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Al)(C[6]C[6]H)(H)	C[6](C[6]C[6]CH)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Al)(C[6]C[6]H)(H){1|C<3>,1|C<4>,2|H<1>}	C[6](C[6]C[6]CH)(C[6]N[6]H)(H){1|Al<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	117.3023	1.353	8	117.3023	1.832	8	118.0158	1.357	55	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Al)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Al)(C[6]C[6]H)(H){1|C<3>,3|H<1>}	C[6](C[6]C[6]HH)(C[6]N[6]H)(H){1|Al<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.0950	1.233	4	118.0950	1.520	4	118.0158	1.357	55	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	C[6](C[6]C[6]CH)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|C<3>,1|C<4>,2|H<1>}	C[6](C[6]C[6]CH)(C[6]N[6]H)(H){1|Fe<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	116.8905	0.281	2	116.8905	0.079	2	118.0158	1.357	55	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mg)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mg)(C[6]C[6]H)(H){1|C<3>,3|H<1>}	C[6](C[6]C[6]HH)(C[6]N[6]H)(H){1|Mg<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	116.8005	0.130	6	116.6215	0.226	8	118.0158	1.357	55	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Mg)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mg)(C[6]C[6]H)(H){1|C<3>,3|H<1>}	C[6](C[6]C[6]HH)(C[6]N[6]H)(H){1|Mg<5>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	116.0845	0.855	2	116.6215	0.226	8	118.0158	1.357	55	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	C[6](C[6]N[6]HO)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]N[6]HO)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	119.1940	0.000	1	119.1940	0.000	1	118.0158	1.357	55	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Si)(C[6]C[6]H)(H)	C[6](C[6]C[6]FeH)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Si)(C[6]C[6]H)(H){1|Fe<9>,1|C<4>,2|H<1>}	C[6](C[6]C[6]FeH)(C[6]N[6]H)(H){1|Si<4>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	118.7910	0.000	3	118.7910	0.000	3	118.0158	1.357	55	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]C[6a]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<1>,3|C<3>}	C[6](C[6]C[5,6]C[6a]H)(C[6]N[6]H)(H){1|C<4>,5|C<3>}	H(C[6]C[6]N[6])	118.8540	0.160	2	118.8540	0.026	2	118.0158	1.357	55	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]2H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(H){1|C<4>,2|H<1>,3|C<3>}	C[6](C[6]C[6]2H)(C[6]N[6]H)(H){2|H<1>,4|C<3>}	H(C[6]C[6]N[6])	118.4955	0.036	2	118.4955	0.001	2	118.0158	1.357	55	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,4|C<3>}	C[6](C[6]C[6a]C[6]H)(C[6]N[6]H)(H){5|C<3>}	H(C[6]C[6]N[6])	122.0510	0.000	1	120.4075	5.402	2	118.0158	1.357	55	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(H){2|H<1>,4|C<3>}	C[6](C[6]C[6a]C[6]H)(C[6]N[6]H)(H){5|C<3>}	H(C[6]C[6]N[6])	118.7640	0.000	1	120.4075	5.402	2	118.0158	1.357	55	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6a]N[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>,3|C<3>}	C[6](C[6]C[6a]N[6]H)(C[6]N[6]H)(H){5|C<3>}	H(C[6]C[6]N[6])	118.8570	0.000	1	118.8570	0.000	1	118.0158	1.357	55	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	N[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(H){1|Cl<1>,1|C<4>,1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6]N[6]H)(C[6]N[6]H)(H){1|Si<4>,1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]N[6])	117.3170	0.000	1	117.3170	0.000	1	118.0158	1.357	55	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:1:	3:	N[6]-3:C[6]-3:H-1:	S[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6,6]H)(C[6]S[6]H)(H)	C[6](S[6]C[6,6]OO)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6]H)(C[6]S[6]H)(H){2|C<3>,2|O<1>}	C[6](S[6]C[6,6]OO)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	H(C[6]C[6]N[6])	117.5650	0.528	2	117.5650	0.278	2	117.5650	0.278	2	119.3358	1.194	3772	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[5,6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:N-2:	C[6]-3:	C[6](C[5,6]C[5,5,6]N[5])(C[6]C[6]N)(H)	C[6](C[6]C[5,6]HH)(C[6]C[5,6]H)(NN[5])	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,5,6]N[5])(C[6]C[6]N)(H){1|C<3>,1|S<4>,2|H<1>,3|C<4>}	C[6](C[6]C[5,6]HH)(C[6]C[5,6]H)(NN[5]){1|C<4>,1|H<1>,2|N<3>}	H(C[6]C[5,6]C[6])	119.5230	0.320	2	119.5230	0.102	2	119.5230	0.102	2	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	As-4:C[6]-3:C[6]-2:	C[6]-3:	C[6](C[6]C[6]As)(C[6]C[6]H)(H)	C[6](AsC[6]2Pd)(C[6]C[6]H)(C[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6]As)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](AsC[6]2Pd)(C[6]C[6]H)(C[6]C[6]){1|C<3>,2|H<1>}	H(C[6]C[6]2)	116.4920	0.000	1	116.4920	0.000	1	121.1337	31.765	3	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	As-4:C[6]-3:C[6]-2:	C[6]-3:	C[6](C[6]C[6]As)(C[6]C[6]H)(H)	C[6](AsC[6a]MoO)(C[6]C[6]H)(C[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6]As)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](AsC[6a]MoO)(C[6]C[6]H)(C[6]C[6]){1|C<3>,2|H<1>}	H(C[6]C[6]2)	123.4545	5.587	2	123.4545	31.213	2	121.1337	31.765	3	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[3,5,6]-4:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[3,5,6]O)(C[6]C[6]O)(H)	C[6](C[3,5,6]C[3,5]C[5,6]O[3])(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[3,5,6]O)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|H<1>,1|O<2>}	C[6](C[3,5,6]C[3,5]C[5,6]O[3])(C[6]C[6]H)(OC){1|C<3>,1|O<1>,3|C<4>}	H(C[6]C[6]2)	119.3130	0.000	1	119.3130	0.000	1	119.3130	0.000	1	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[3,6]-4:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[3,6]N)(C[6]C[6]H)(H)	C[6](C[3,6]C[3,6]C[3]H)(C[6]C[6]H)(NS)	H(C[6]C[6]2)	C[6](C[6]C[3,6]N)(C[6]C[6]H)(H){1|H<1>,1|N<2>,2|C<4>}	C[6](C[3,6]C[3,6]C[3]H)(C[6]C[6]H)(NS){2|H<1>,3|C<3>}	H(C[6]C[6]2)	118.6455	0.042	2	118.6455	0.002	2	118.6455	0.002	2	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[3,6]-4:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[3,6]O)(C[6]C[6]H)(H)	C[6](C[3,6]C[3,6]C[3]H)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[3,6]O)(C[6]C[6]H)(H){1|C<3>,1|H<1>,2|C<4>}	C[6](C[3,6]C[3,6]C[3]H)(C[6]C[6]H)(OC){2|C<3>,3|H<1>}	H(C[6]C[6]2)	119.6980	0.000	1	119.6980	0.000	1	119.6980	0.000	1	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[3]-4:C[6]-3:C[6]-2:	C[6]-3:	C[6](C[6]C[3]C[6])(C[6]C[6]H)(H)	C[6](C[3]C[3]2H)(C[6]C[6]H)(C[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[3]C[6])(C[6]C[6]H)(H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[3]C[3]2H)(C[6]C[6]H)(C[6]C[6]){2|C<3>,4|H<1>}	H(C[6]C[6]2)	120.3240	0.000	1	120.3240	0.000	1	120.3240	0.000	1	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[3x6]-4:C[6]-3:N[6]-2:	C[6]-3:	C[6](C[6]C[3x6]N[6])(C[6]N[6]C)(H)	C[6](C[3x6]C[6,6]3)(C[6]C[6]H)(N[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[3x6]N[6])(C[6]N[6]C)(H){1|Fe<8>,1|C<3>,3|C<4>}	C[6](C[3x6]C[6,6]3)(C[6]C[6]H)(N[6]C[6]){1|N<3>,2|C<3>,3|C<4>,6|H<1>}	H(C[6]C[6]2)	119.6550	0.000	1	119.6550	0.000	1	119.6550	0.000	1	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[3x6]-4:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[3x6]O)(C[6]C[6]H)(H)	C[6](C[3x6]C[4x6]C[6,6]H)(C[6]C[6]H)(OH)	H(C[6]C[6]2)	C[6](C[6]C[3x6]O)(C[6]C[6]H)(H){2|C<4>,3|H<1>}	C[6](C[3x6]C[4x6]C[6,6]H)(C[6]C[6]H)(OH){2|C<3>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	118.2300	0.000	1	118.2300	0.000	1	118.2300	0.000	1	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[4,6]-4:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[4,6]N)(C[6]C[5,6]H)(H)	C[6](C[4,6]C[4]2O[6])(C[6]C[6]H)(NN)	H(C[6]C[6]2)	C[6](C[6]C[4,6]N)(C[6]C[5,6]H)(H){2|O<2>,3|C<4>}	C[6](C[4,6]C[4]2O[6])(C[6]C[6]H)(NN){2|C<4>,5|H<1>}	H(C[6]C[6]2)	119.7525	0.360	2	119.7525	0.130	2	119.7525	0.130	2	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[4,6]-4:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[4,6]O)(C[6]C[6]O)(H)	C[6](C[4,6]C[4,5,6,6]C[4]H)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[4,6]O)(C[6]C[6]O)(H){2|C<4>,3|H<1>}	C[6](C[4,6]C[4,5,6,6]C[4]H)(C[6]C[6]H)(OC){1|O<1>,2|H<1>,3|C<4>}	H(C[6]C[6]2)	118.8690	0.000	1	118.8690	0.000	1	119.0765	0.086	2	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[4,6]-4:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[4,6]O)(C[6]O[6]O)(H)	C[6](C[4,6]C[4,6]C[4]H)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[4,6]O)(C[6]O[6]O)(H){1|H<1>,2|C<4>}	C[6](C[4,6]C[4,6]C[4]H)(C[6]C[6]H)(OC){1|C<4>,1|H<1>,1|O<1>,1|O<2>,2|C<3>}	H(C[6]C[6]2)	119.2840	0.000	1	119.2840	0.000	1	119.0765	0.086	2	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[5,6,6]-4:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[5,6,6]O)(C[6]C[6,6a]O)(H)	C[6](C[5,6,6]C[6,6,6a]C[5,6]C[5])(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[5,6,6]O)(C[6]C[6,6a]O)(H){2|C<3>,2|C<4>}	C[6](C[5,6,6]C[6,6,6a]C[5,6]C[5])(C[6]C[6]H)(OC){1|O<1>,2|C<4>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	118.8700	0.000	1	118.8700	0.000	1	118.8700	0.000	1	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[5,6]N)(C[6]C[6]H)(H)	C[6](C[5,6]C[5]2C[6])(C[6]C[6]H)(NC)	H(C[6]C[6]2)	C[6](C[6]C[5,6]N)(C[6]C[6]H)(H){1|H<1>,3|C<3>}	C[6](C[5,6]C[5]2C[6])(C[6]C[6]H)(NC){2|H<1>,5|C<3>}	H(C[6]C[6]2)	119.1965	0.050	2	119.1965	0.003	2	119.1973	0.001	3	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[5,6]N)(H)	C[6](C[5,6]C[6,6a]C[5]2)(C[6]C[6]H)(NC)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[5,6]N)(H){4|C<3>}	C[6](C[5,6]C[6,6a]C[5]2)(C[6]C[6]H)(NC){1|H<1>,6|C<3>}	H(C[6]C[6]2)	119.1990	0.000	1	119.1990	0.000	1	119.1973	0.001	3	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[3x6]H)(C[6]C[5,6]O)(H)	C[6](C[5,6]C[5,3x6]O[5]H)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[3x6]H)(C[6]C[5,6]O)(H){1|H<1>,1|O<2>,2|C<4>}	C[6](C[5,6]C[5,3x6]O[5]H)(C[6]C[6]H)(OC){1|C<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	118.7060	0.000	1	118.7060	0.000	1	119.4839	0.642	41	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[5,6,6]O)(C[6]C[5,6]O)(H)	C[6](C[5,6]C[5,6,6]C[5,6]H)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[5,6,6]O)(C[6]C[5,6]O)(H){1|H<1>,1|O<2>,3|C<4>}	C[6](C[5,6]C[5,6,6]C[5,6]H)(C[6]C[6]H)(OC){1|H<1>,1|O<1>,2|C<3>,3|C<4>}	H(C[6]C[6]2)	121.1910	0.000	1	121.1910	0.000	1	119.4839	0.642	41	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[5,6]O)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Ti)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[5,6]O)(C[6]C[6]H)(H){1|Ti<13>,1|C<3>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Ti)(C[6]C[6]H)(OC){1|Si<5>,1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.5456	0.120	5	119.5456	0.014	5	119.4839	0.642	41	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[5,6]O)(C[6]C[6]O)(H)	C[6](C[5,6]C[5,6]C[6]N[5])(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[5,6]O)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[5,6]C[5,6]C[6]N[5])(C[6]C[6]H)(OC){1|H<1>,1|O<1>,2|C<4>,4|C<3>}	H(C[6]C[6]2)	119.8520	0.160	2	119.8520	0.026	2	119.4839	0.642	41	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[5,6]O)(C[6]C[6]O)(H)	C[6](C[5,6]C[5,6]O[5]C)(C[6]C[6]H)(OH)	H(C[6]C[6]2)	C[6](C[6]C[5,6]O)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|O<2>,2|H<1>}	C[6](C[5,6]C[5,6]O[5]C)(C[6]C[6]H)(OH){1|C<4>,1|H<1>,1|O<1>,2|C<3>}	H(C[6]C[6]2)	119.0260	0.000	1	118.7200	0.111	3	119.4839	0.642	41	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[5,6]O)(C[6]C[6]O)(H)	C[6](C[5,6]C[5,6]O[5]C)(C[6]C[6]H)(OH)	H(C[6]C[6]2)	C[6](C[6]C[5,6]O)(C[6]C[6]O)(H){1|O<2>,4|C<4>}	C[6](C[5,6]C[5,6]O[5]C)(C[6]C[6]H)(OH){1|C<3>,1|H<1>,1|O<1>,2|C<4>}	H(C[6]C[6]2)	118.5670	0.286	2	118.7200	0.111	3	119.4839	0.642	41	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[5,6]O)(C[6]C[6]O)(H)	C[6](C[5,6]C[5,6a]C[5]C[6])(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[5,6]O)(C[6]C[6]O)(H){1|C<4>,1|H<1>,2|C<3>}	C[6](C[5,6]C[5,6a]C[5]C[6])(C[6]C[6]H)(OC){1|O<1>,1|O<2>,1|P<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.3910	0.013	2	119.3910	0.000	2	119.4839	0.642	41	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[5,6]O)(C[6]C[6]O)(H)	C[6](C[5,6]C[5]2C[6])(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[5,6]O)(C[6]C[6]O)(H){1|C<4>,1|O<2>,2|C<3>}	C[6](C[5,6]C[5]2C[6])(C[6]C[6]H)(OC){1|C<3>,1|C<4>,1|N<3>,2|O<1>,3|H<1>}	H(C[6]C[6]2)	119.0410	0.000	1	119.0410	0.000	1	119.4839	0.642	41	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[5,6]O)(C[6]C[6]O)(H)	C[6](C[5,6]C[5]C[6]O[5])(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[5,6]O)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|H<1>,1|O<2>}	C[6](C[5,6]C[5]C[6]O[5])(C[6]C[6]H)(OC){1|C<4>,1|O<1>,1|O<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	122.3545	0.800	2	119.5281	0.837	24	119.4839	0.642	41	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[5,6]O)(C[6]C[6]O)(H)	C[6](C[5,6]C[5]C[6]O[5])(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[5,6]O)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|O<2>,2|H<1>}	C[6](C[5,6]C[5]C[6]O[5])(C[6]C[6]H)(OC){1|H<1>,2|C<3>,2|C<4>,2|O<1>}	H(C[6]C[6]2)	119.2351	0.213	19	119.5281	0.837	24	119.4839	0.642	41	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[5,6]O)(C[6]C[6]O)(H)	C[6](C[5,6]C[5]C[6]O[5])(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[5,6]O)(C[6]C[6]O)(H){1|H<1>,1|O<2>,2|C<3>}	C[6](C[5,6]C[5]C[6]O[5])(C[6]C[6]H)(OC){2|O<1>,4|C<3>}	H(C[6]C[6]2)	119.4125	0.385	2	119.5281	0.837	24	119.4839	0.642	41	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[5,6]O)(C[6]C[6]O)(H)	C[6](C[5,6]C[5]C[6]O[5])(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[5,6]O)(C[6]C[6]O)(H){2|C<3>,2|O<2>}	C[6](C[5,6]C[5]C[6]O[5])(C[6]C[6]H)(OC){1|H<1>,2|O<1>,3|C<3>}	H(C[6]C[6]2)	119.6740	0.000	1	119.5281	0.837	24	119.4839	0.642	41	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[5,6]O)2(H)	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[5,6]O)2(H){1|H<1>,2|C<3>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(OC){1|C<4>,1|O<1>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	119.8130	0.000	1	119.8130	0.000	1	119.4839	0.642	41	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6,6a]O)(C[6]C[5,6]O)(H)	C[6](C[5,6]C[6,6a]C[5]O[5])(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]O)(C[6]C[5,6]O)(H){1|C<4>,1|O<2>,2|C<3>}	C[6](C[5,6]C[6,6a]C[5]O[5])(C[6]C[6]H)(OC){1|C<4>,1|O<1>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.0380	0.000	1	119.0380	0.000	1	119.4839	0.642	41	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[5]-4:C[6]-3:C[6]-2:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H)	C[6](C[5]C[5,5]C[6a]O[5])(C[6]C[6]H)(C[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<2>,2|C<3>}	C[6](C[5]C[5,5]C[6a]O[5])(C[6]C[6]H)(C[6]C[6]){1|N<4>,2|C<4>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	122.0120	0.000	1	122.0120	0.000	1	119.7927	5.530	3	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[5]-4:C[6]-3:C[6]-2:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H)	C[6](C[5]C[6a]C[5]N[5])(C[6]C[6]H)(C[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H){1|Br<1>,1|N<3>,3|C<3>}	C[6](C[5]C[6a]C[5]N[5])(C[6]C[6]H)(C[6]C[6]){1|N<3>,1|O<1>,1|S<4>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.0380	0.000	1	120.0380	0.000	1	119.7927	5.530	3	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[5]-4:C[6]-3:C[6]-2:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H)	C[6](C[5]O[5]2H)(C[6]C[6]H)(C[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H){1|C<3>,2|H<1>,2|O<2>}	C[6](C[5]O[5]2H)(C[6]C[6]H)(C[6]C[6]){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	117.3280	0.000	1	117.3280	0.000	1	119.7927	5.530	3	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[5]-4:C[6]-3:O[6]-2:	C[6]-3:	C[6](C[6]C[5]O[6])(C[6]O[6]C)(H)	C[6](C[5]C[5]2Fe)(C[6]C[6]H)(O[6]B[6])	H(C[6]C[6]2)	C[6](C[6]C[5]O[6])(C[6]O[6]C)(H){1|Fe<10>,1|B<4>,2|C<4>}	C[6](C[5]C[5]2Fe)(C[6]C[6]H)(O[6]B[6]){1|O<2>,2|F<1>,2|H<1>,3|C<4>}	H(C[6]C[6]2)	119.2090	0.000	1	119.2090	0.000	1	119.9540	1.110	2	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[5]-4:C[6]-3:O[6]-2:	C[6]-3:	C[6](C[6]C[5]O[6])(C[6]O[6]C)(H)	C[6](C[5]C[5]P[5]Fe)(C[6]C[6]H)(O[6]B[6])	H(C[6]C[6]2)	C[6](C[6]C[5]O[6])(C[6]O[6]C)(H){1|Fe<10>,1|B<4>,1|C<4>,1|P<3>}	C[6](C[5]C[5]P[5]Fe)(C[6]C[6]H)(O[6]B[6]){1|C<3>,1|O<2>,2|F<1>,3|C<4>}	H(C[6]C[6]2)	120.6990	0.000	1	120.6990	0.000	1	119.9540	1.110	2	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6,6]C)(C[6]C[6]H)(H)	C[6](C[6,6]C[6,6]C[6]Ru)(C[6]C[6]H)(CC)	H(C[6]C[6]2)	C[6](C[6]C[6,6]C)(C[6]C[6]H)(H){1|Ru<11>,1|H<1>,2|C<4>}	C[6](C[6,6]C[6,6]C[6]Ru)(C[6]C[6]H)(CC){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.8295	0.213	2	118.8295	0.045	2	118.8295	0.045	2	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]C)(H)	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]C)(H){1|H<1>,2|C<4>}	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(OC){1|C<2>,3|C<4>,3|H<1>}	H(C[6]C[6]2)	117.8880	0.000	1	117.8880	0.000	1	119.2067	0.453	17	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]O)(H)	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(OH)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]O)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(OH){1|H<1>,1|N<3>,2|C<4>,2|O<1>}	H(C[6]C[6]2)	118.8860	0.000	1	118.8860	0.000	1	119.2067	0.453	17	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]O)(H)	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]O)(H){1|C<3>,1|C<4>,3|H<1>}	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(OC){1|C<3>,1|H<1>,2|C<4>,2|O<1>}	H(C[6]C[6]2)	119.4630	0.000	1	119.4630	0.000	1	119.2067	0.453	17	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]O)(H)	C[6](C[6,6]C[6,6]C[6]O[6])(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]O)(H){1|Br<1>,1|H<1>,1|O<2>,2|C<4>}	C[6](C[6,6]C[6,6]C[6]O[6])(C[6]C[6]H)(OC){1|C<3>,1|H<1>,1|O<1>,2|C<4>,3|O<2>}	H(C[6]C[6]2)	118.5840	1.484	2	118.5840	2.201	2	119.2067	0.453	17	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]O)(H)	C[6](C[6,6]C[6,6a]C[6,6]O)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|O<2>,2|H<1>}	C[6](C[6,6]C[6,6a]C[6,6]O)(C[6]C[6]H)(OC){1|H<1>,1|O<1>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	119.2980	0.000	1	119.2980	0.000	1	119.2067	0.453	17	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]O)(H)	C[6](C[6,6]C[6]3)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]O)(H){1|C<3>,1|O<2>,2|C<4>}	C[6](C[6,6]C[6]3)(C[6]C[6]H)(OC){1|O<1>,2|C<3>,3|C<4>,3|H<1>}	H(C[6]C[6]2)	118.6360	0.000	1	118.8140	0.063	2	119.2067	0.453	17	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]O)(H)	C[6](C[6,6]C[6]3)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]O)(H){1|C<3>,1|O<2>,2|C<4>}	C[6](C[6,6]C[6]3)(C[6]C[6]H)(OC){1|O<1>,2|C<4>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	118.9920	0.000	1	118.8140	0.063	2	119.2067	0.453	17	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]O[6]O)(H)	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]O[6]O)(H){1|C<3>,2|C<4>}	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(OC){1|C<3>,1|C<4>,1|O<1>,1|O<2>,2|H<1>}	H(C[6]C[6]2)	120.2850	0.000	1	120.2850	0.000	1	119.2067	0.453	17	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6,6]O)2(H)	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)2(H){1|C<3>,1|H<1>,3|C<4>}	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(OC){2|C<4>,2|H<1>,2|O<1>}	H(C[6]C[6]2)	119.4070	0.000	1	119.3912	0.031	4	119.2067	0.453	17	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6,6]O)2(H)	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)2(H){5|C<4>}	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(OC){1|O<1>,1|O<2>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	119.3860	0.216	3	119.3912	0.031	4	119.2067	0.453	17	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6,6]O)2(H)	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)2(H){1|C<3>,1|H<1>,3|C<4>}	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(OC){1|O<1>,2|C<4>,4|H<1>}	H(C[6]C[6]2)	119.5740	0.122	2	119.5832	0.006	4	119.2067	0.453	17	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6,6]O)2(H)	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)2(H){1|C<3>,1|H<1>,3|C<4>}	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(OC){2|O<1>,4|C<4>}	H(C[6]C[6]2)	119.5630	0.000	1	119.5832	0.006	4	119.2067	0.453	17	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6,6]O)2(H)	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)2(H){2|H<1>,3|C<4>}	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(OC){1|C<3>,1|H<1>,1|O<1>,2|C<4>,2|O<2>}	H(C[6]C[6]2)	119.6220	0.000	1	119.5832	0.006	4	119.2067	0.453	17	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C[6]-2:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6]2)(C[6]C[6]H)(C[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6]H)(H){1|H<1>,4|C<3>}	C[6](C[6]C[6a]C[6]2)(C[6]C[6]H)(C[6]C[6]){4|H<1>,5|C<3>}	H(C[6]C[6]2)	123.5390	0.000	1	123.5390	0.000	1	121.5415	7.980	2	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C[6]-2:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6]O)(H)	C[6](C[6]C[6,6a]C[5,6]H)(C[6]C[6]H)(C[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6]O)(H){1|C<4>,1|H<1>,1|O<2>,2|C<3>}	C[6](C[6]C[6,6a]C[5,6]H)(C[6]C[6]H)(C[6]C[6]){1|C<4>,3|O<2>,4|C<3>}	H(C[6]C[6]2)	119.5440	0.000	1	119.5440	0.000	1	121.5415	7.980	2	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(NO)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]N)(H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(NO){1|C<4>,1|S<2>,2|H<1>}	H(C[6]C[6]2)	118.4720	0.000	1	118.4720	0.000	1	119.1276	1.256	17	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(NN)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]N)(H){2|H<1>,3|C<4>}	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(NN){2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.8910	0.000	1	118.8910	0.000	1	119.1276	1.256	17	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]N)(H)	C[6](C[6]C[6]CC)(C[6]C[6]H)(NN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]N)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[6]CC)(C[6]C[6]H)(NN){2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.2935	0.474	2	118.2935	0.225	2	119.1276	1.256	17	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]N)(H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(NN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]N)(H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]C[6]CH)(C[6]C[6]H)(NN){1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	118.1240	0.000	1	118.1240	0.000	1	119.1276	1.256	17	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]N)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(NN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]N)(H){2|H<1>,3|C<4>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(NN){2|C<4>,2|H<1>}	H(C[6]C[6]2)	117.9750	0.000	1	117.9750	0.000	1	119.1276	1.256	17	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]CoH)(C[6]C[6]H)(NC[5a])	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|Co<5>,1|C<3>,2|H<1>}	C[6](C[6]C[6]CoH)(C[6]C[6]H)(NC[5a]){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.2258	0.213	4	120.2258	0.045	4	119.1276	1.256	17	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]FeH)(C[6]C[6]H)(NC[5])	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|Fe<5>,1|C<3>,2|H<1>}	C[6](C[6]C[6]FeH)(C[6]C[6]H)(NC[5]){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	119.7235	0.135	2	119.7235	0.018	2	119.1276	1.256	17	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]FeH)(C[6]C[6]H)(NC[5a])	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|Fe<5>,1|C<3>,2|H<1>}	C[6](C[6]C[6]FeH)(C[6]C[6]H)(NC[5a]){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.5135	0.257	2	120.5135	0.066	2	119.1276	1.256	17	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]LiH)(C[6]C[6]H)(NC[5a])	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|Li<5>,1|C<3>,2|H<1>}	C[6](C[6]C[6]LiH)(C[6]C[6]H)(NC[5a]){1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	117.4470	0.580	2	117.4470	0.336	2	119.1276	1.256	17	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]N)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(NN)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]N)(H){1|C<4>,2|H<1>,3|C<3>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(NN){1|N<3>,3|C<3>}	H(C[6]C[6]2)	118.8490	0.000	1	118.8490	0.000	1	119.1276	1.256	17	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[3,6]O)(C[6]C[6]O)(H)	C[6](C[6]C[3,6]HO)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[3,6]O)(C[6]C[6]O)(H){1|C<4>,2|H<1>,2|O<2>}	C[6](C[6]C[3,6]HO)(C[6]C[6]H)(OC){1|O<1>,1|O<2>,2|C<4>}	H(C[6]C[6]2)	119.4040	0.000	1	119.4040	0.000	1	119.8222	1.687	70	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[4,6]O)(C[6]C[6]O)(H)	C[6](C[6]C[4,5,6,6]HH)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[4,6]O)(C[6]C[6]O)(H){2|C<4>,3|H<1>}	C[6](C[6]C[4,5,6,6]HH)(C[6]C[6]H)(OC){1|O<1>,3|C<4>}	H(C[6]C[6]2)	119.3705	0.035	2	119.3705	0.001	2	119.8222	1.687	70	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(OH)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|C<3>,1|O<2>,2|H<1>}	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(OH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.8670	0.000	1	119.8670	0.000	1	119.8222	1.687	70	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[5,6]O)(C[6]C[6]O)(H)	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[5,6]O)(C[6]C[6]O)(H){2|H<1>,3|C<4>}	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(OC){1|O<1>,1|O<2>,2|C<4>}	H(C[6]C[6]2)	119.4520	0.000	1	119.4520	0.000	1	119.8222	1.687	70	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[5,6]O)(C[6]C[6]O)(H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[5,6]O)(C[6]C[6]O)(H){1|H<1>,2|C<3>,2|C<4>}	C[6](C[6]C[6]CH)(C[6]C[6]H)(OC){1|C<3>,1|C<4>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	118.9650	0.000	1	118.9650	0.000	1	119.8222	1.687	70	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[5a,6]O)(C[6]C[6]O)(H)	C[6](C[6]C[5a,6]OO)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]O)(C[6]C[6]O)(H){2|C<3>,2|O<2>}	C[6](C[6]C[5a,6]OO)(C[6]C[6]H)(OC){1|C<3>,1|O<1>,1|O<2>}	H(C[6]C[6]2)	118.4310	0.000	1	118.4310	0.000	1	119.8222	1.687	70	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]O)(H)	C[6](C[6]C[6,6]CC)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]O)(H){1|C<3>,4|C<4>}	C[6](C[6]C[6,6]CC)(C[6]C[6]H)(OC){1|H<1>,1|O<1>,2|C<4>}	H(C[6]C[6]2)	120.7180	3.142	2	120.7180	9.875	2	119.8222	1.687	70	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]O)(H)	C[6](C[6]C[6,6]HO)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]O)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[6]C[6,6]HO)(C[6]C[6]H)(OC){1|H<1>,1|O<1>,2|C<4>}	H(C[6]C[6]2)	119.0680	0.000	1	119.0680	0.000	1	119.8222	1.687	70	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]DyO)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|Dy<15>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]DyO)(C[6]C[6]H)(OC){1|C<3>,2|C<4>}	H(C[6]C[6]2)	119.5160	0.000	1	119.5160	0.000	1	119.8222	1.687	70	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]CC)(C[6]C[6]H)(OIr)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|H<1>,3|C<3>}	C[6](C[6]C[6]CC)(C[6]C[6]H)(OIr){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3630	0.000	2	120.3630	0.000	2	119.8222	1.687	70	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[6]CH)(C[6]C[6]H)(OC){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	126.0770	0.000	1	126.0770	0.000	1	119.8222	1.687	70	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]CP)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|H<1>,1|P<4>,2|C<3>}	C[6](C[6]C[6]CP)(C[6]C[6]H)(OC){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	117.7420	0.197	2	117.7420	0.039	2	119.8222	1.687	70	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]CP)(C[6]C[6]H)(ORh)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|H<1>,1|P<4>,2|C<3>}	C[6](C[6]C[6]CP)(C[6]C[6]H)(ORh){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.1555	0.315	2	119.1555	0.099	2	119.8222	1.687	70	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]DyO)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Dy<15>,1|C<3>,1|H<1>,1|O<3>}	C[6](C[6]C[6]DyO)(C[6]C[6]H)(OC){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.6035	0.081	2	119.6035	0.007	2	119.8222	1.687	70	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]GdO)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Gd<15>,1|C<3>,1|H<1>,1|O<3>}	C[6](C[6]C[6]GdO)(C[6]C[6]H)(OC){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.6700	0.074	2	119.6700	0.005	2	119.8222	1.687	70	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(ORu)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(ORu){1|C<4>,3|H<1>}	H(C[6]C[6]2)	115.8700	0.000	1	115.8700	0.000	1	119.8222	1.687	70	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]HW)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<4>,1|W<7>,2|H<1>}	C[6](C[6]C[6]HW)(C[6]C[6]H)(OC){1|C<3>,2|H<1>}	H(C[6]C[6]2)	122.4360	0.000	1	122.4360	0.000	1	119.8222	1.687	70	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]ReH)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Re<7>,1|C<4>,2|H<1>}	C[6](C[6]C[6]ReH)(C[6]C[6]H)(OC){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2910	0.000	1	120.2910	0.000	1	119.8222	1.687	70	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]RhH)(C[6]C[6]H)(OP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Rh<5>,1|C<3>,1|H<1>,1|H<2>}	C[6](C[6]C[6]RhH)(C[6]C[6]H)(OP){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.9075	0.153	2	120.9075	0.024	2	119.8222	1.687	70	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6a]C[6]Pd)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Pd<4>,1|H<1>,2|C<3>}	C[6](C[6]C[6a]C[6]Pd)(C[6]C[6]H)(OC){1|H<1>,1|O<2>,3|C<3>}	H(C[6]C[6]2)	120.1665	0.345	4	120.1665	0.119	4	119.8222	1.687	70	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]N[6]RuO)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Ru<7>,1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]N[6]RuO)(C[6]C[6]H)(OC){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8615	0.117	2	119.8615	0.014	2	119.8222	1.687	70	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]N)(C[6]C[6]O)(H)	C[6](C[6]C[6]DyO)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]C[6]O)(H){1|Dy<16>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]DyO)(C[6]C[6]H)(OC){1|C<3>,1|C<4>,1|N<2>}	H(C[6]C[6]2)	120.4063	0.232	3	120.4063	0.054	3	119.8222	1.687	70	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]N)(C[6]C[6]O)(H)	C[6](C[6]C[6]TbO)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]C[6]O)(H){1|Tb<16>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]TbO)(C[6]C[6]H)(OC){1|C<3>,1|C<4>,1|N<2>}	H(C[6]C[6]2)	120.0013	0.573	3	120.0013	0.328	3	119.8222	1.687	70	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	C[6](C[6]C[6]Ru2)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|Ru<10>,1|Ru<8>,1|C<4>}	C[6](C[6]C[6]Ru2)(C[6]C[6]H)(OC){1|C<4>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.6270	0.000	1	120.6270	0.000	1	119.8222	1.687	70	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]N[6]O)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]N[6]O)(H){1|C<3>,1|C<4>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(OH){1|C<4>,1|H<1>,1|N<3>,1|O<1>}	H(C[6]C[6]2)	119.0490	0.175	2	119.0490	0.031	2	119.8222	1.687	70	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]O[6]O)(H)	C[6](C[6]C[5,6]CH)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]O[6]O)(H){1|H<1>,2|C<4>}	C[6](C[6]C[5,6]CH)(C[6]C[6]H)(OC){1|O<1>,1|O<2>,2|C<3>}	H(C[6]C[6]2)	119.3200	0.000	1	119.3200	0.000	1	119.8222	1.687	70	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]O[6]O)(H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]O[6]O)(H){1|H<1>,2|C<4>}	C[6](C[6]C[6]CH)(C[6]C[6]H)(OC){1|C<3>,1|H<1>,1|O<1>,1|O<2>}	H(C[6]C[6]2)	120.3577	1.195	3	120.2463	1.001	4	119.8222	1.687	70	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]O[6]O)(H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]O[6]O)(H){1|H<1>,2|C<4>}	C[6](C[6]C[6]CH)(C[6]C[6]H)(OC){1|C<4>,1|H<1>,1|O<1>,1|O<2>}	H(C[6]C[6]2)	119.9120	0.000	1	120.2463	1.001	4	119.8222	1.687	70	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]O[6]O)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]O[6]O)(H){1|C<4>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(OC){1|C<3>,1|H<1>,1|O<1>,1|O<2>}	H(C[6]C[6]2)	119.5700	0.270	2	119.5700	0.073	2	119.8222	1.687	70	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]O[6]O)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]O[6]O)(H){1|C<4>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(OH){1|C<3>,1|H<1>,1|O<1>,1|O<2>}	H(C[6]C[6]2)	122.3870	0.000	1	122.3870	0.000	1	119.8222	1.687	70	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)2(H)	C[6](C[6]C[5,6]C[6]Pd)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]O)2(H){1|Pd<5>,1|C<3>,1|C<5>,1|O<2>}	C[6](C[6]C[5,6]C[6]Pd)(C[6]C[6]H)(OC){1|C<3>,1|O<2>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	120.4530	0.000	1	120.4530	0.000	1	119.8222	1.687	70	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)2(H)	C[6](C[6]C[6]CC)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]O)2(H){1|C<3>,1|O<2>,3|C<4>}	C[6](C[6]C[6]CC)(C[6]C[6]H)(OC){1|C<4>,2|O<1>}	H(C[6]C[6]2)	118.5400	0.338	2	118.5400	0.114	2	119.8222	1.687	70	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)2(H)	C[6](C[6]C[6]CN)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]O)2(H){1|C<3>,1|C<4>,1|N<3>,2|H<1>}	C[6](C[6]C[6]CN)(C[6]C[6]H)(OC){1|C<4>,1|O<1>,2|H<1>}	H(C[6]C[6]2)	119.7200	0.000	1	119.7200	0.000	1	119.8222	1.687	70	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)2(H)	C[6](C[6]C[6]CO)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]O)2(H){1|C<3>,1|C<4>,1|H<1>,1|O<2>}	C[6](C[6]C[6]CO)(C[6]C[6]H)(OC){1|C<3>,1|O<1>,1|O<2>}	H(C[6]C[6]2)	118.9825	0.303	2	118.9825	0.092	2	119.8222	1.687	70	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)2(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]O)2(H){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(OC){1|O<1>,3|C<4>}	H(C[6]C[6]2)	119.6570	0.000	1	119.6570	0.000	1	119.8222	1.687	70	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)2(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(OC[6a])	H(C[6]C[6]2)	C[6](C[6]C[6]O)2(H){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(OC[6a]){1|O<1>,3|C<4>}	H(C[6]C[6]2)	119.8857	0.398	6	119.8857	0.159	6	119.8222	1.687	70	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)2(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]O)2(H){1|C<4>,3|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(OH){1|C<3>,1|O<1>,2|H<1>}	H(C[6]C[6]2)	121.0470	0.000	1	120.4165	0.795	2	119.8222	1.687	70	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)2(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]O)2(H){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(OH){1|O<1>,3|C<4>}	H(C[6]C[6]2)	119.7860	0.000	1	120.4165	0.795	2	119.8222	1.687	70	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)2(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(OPd)	H(C[6]C[6]2)	C[6](C[6]C[6]O)2(H){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(OPd){1|O<1>,3|C<4>}	H(C[6]C[6]2)	119.0410	0.000	1	119.0410	0.000	1	119.8222	1.687	70	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)2(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(OPt)	H(C[6]C[6]2)	C[6](C[6]C[6]O)2(H){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(OPt){1|C<4>,1|O<1>,2|H<1>}	H(C[6]C[6]2)	118.4060	0.000	1	118.4060	0.000	1	119.8222	1.687	70	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)2(H)	C[6](C[6]C[6a]C[6]O)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]O)2(H){1|H<1>,1|O<2>,2|C<3>}	C[6](C[6]C[6a]C[6]O)(C[6]C[6]H)(OC){1|O<1>,1|O<2>,3|C<3>}	H(C[6]C[6]2)	119.2700	0.147	2	119.2700	0.022	2	119.8222	1.687	70	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]O)2(H)	C[6](C[6]N[6]HH)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]O)2(H){1|C<4>,1|N<3>,3|H<1>}	C[6](C[6]N[6]HH)(C[6]C[6]H)(OC){1|C<3>,1|C<4>,1|O<1>}	H(C[6]C[6]2)	119.9370	0.000	1	119.9370	0.000	1	119.8222	1.687	70	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]S)(H)	C[6](C[6]C[6]TiO)(C[6]C[6]H)(SC[6a])	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]S)(H){1|Ti<9>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]TiO)(C[6]C[6]H)(SC[6a]){1|C<3>,1|C<4>,1|S<2>}	H(C[6]C[6]2)	119.0355	0.263	4	119.0355	0.069	4	119.1650	0.136	5	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]O)(C[6]C[6]S)(H)	C[6](C[6]C[6]HS)(C[6]C[6]H)(SPd)	H(C[6]C[6]2)	C[6](C[6]C[6]O)(C[6]C[6]S)(H){1|C<2>,1|H<1>,1|O<2>,1|S<2>}	C[6](C[6]C[6]HS)(C[6]C[6]H)(SPd){1|C<3>,1|O<2>}	H(C[6]C[6]2)	119.6830	0.000	1	119.6830	0.000	1	119.1650	0.136	5	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	Ge-4:C[6]-3:C[6]-2:	C[6]-3:	C[6](C[6]C[6]Ge)(C[6]C[6]H)(H)	C[6](GeC[6a]2Pt)(C[6]C[6]H)(C[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6]Ge)(C[6]C[6]H)(H){1|C<3>}	C[6](GeC[6a]2Pt)(C[6]C[6]H)(C[6]C[6]){1|C<2>,2|H<1>}	H(C[6]C[6]2)	118.7120	0.000	1	118.7120	0.000	1	118.3090	0.325	2	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	Ge-4:C[6]-3:C[6]-2:	C[6]-3:	C[6](C[6]C[6]Ge)(C[6]C[6]H)(H)	C[6](GeC[6a]2Rh)(C[6]C[6]H)(C[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6]Ge)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](GeC[6a]2Rh)(C[6]C[6]H)(C[6]C[6]){1|C<3>,2|H<1>}	H(C[6]C[6]2)	117.9060	0.000	1	117.9060	0.000	1	118.3090	0.325	2	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	P-4:C[6]-3:C[6]-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](PC[6a]2C[6])(C[6]C[6]H)(C[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<3>,1|H<1>}	C[6](PC[6a]2C[6])(C[6]C[6]H)(C[6]C[6]){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1480	0.000	1	120.1480	0.000	1	118.8053	3.507	20	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	P-4:C[6]-3:C[6]-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](PC[6a]2Ir)(C[6]C[6]H)(C[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<3>,1|H<1>}	C[6](PC[6a]2Ir)(C[6]C[6]H)(C[6]C[6]){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.4890	0.000	1	119.4890	0.000	1	118.8053	3.507	20	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	P-4:C[6]-3:C[6]-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](PC[6a]2Pd)(C[6]C[6]H)(C[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<3>,1|H<1>}	C[6](PC[6a]2Pd)(C[6]C[6]H)(C[6]C[6]){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7610	0.000	1	119.7610	0.000	1	118.8053	3.507	20	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	P-4:C[6]-3:C[6]-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](PC[6a]2Ru)(C[6]C[6]H)(C[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<3>,1|H<1>}	C[6](PC[6a]2Ru)(C[6]C[6]H)(C[6]C[6]){1|C<3>,2|H<1>}	H(C[6]C[6]2)	121.3590	0.000	1	121.3590	0.000	1	118.8053	3.507	20	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	P-4:C[6]-3:C[6]-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](PC[6a]C[5]Ag)(C[6]C[6]H)(C[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<3>,1|H<1>}	C[6](PC[6a]C[5]Ag)(C[6]C[6]H)(C[6]C[6]){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7190	0.580	4	119.7190	0.336	4	118.8053	3.507	20	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	P-4:C[6]-3:C[6]-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](PC[6a]C[6]Ni)(C[6]C[6]H)(C[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<3>,1|H<1>}	C[6](PC[6a]C[6]Ni)(C[6]C[6]H)(C[6]C[6]){1|C<3>,2|H<1>}	H(C[6]C[6]2)	113.2350	0.000	1	113.2350	0.000	1	118.8053	3.507	20	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	P-4:C[6]-3:C[6]-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](PC[6a]C[6]Pd)(C[6]C[6]H)(C[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<3>,1|H<1>}	C[6](PC[6a]C[6]Pd)(C[6]C[6]H)(C[6]C[6]){1|C<3>,2|H<1>}	H(C[6]C[6]2)	116.4990	0.000	1	116.4990	0.000	1	118.8053	3.507	20	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	P-4:C[6]-3:C[6]-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](PC[6a]CoC)(C[6]C[6]H)(C[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<3>,1|H<1>}	C[6](PC[6a]CoC)(C[6]C[6]H)(C[6]C[6]){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2660	0.000	1	120.2660	0.000	1	118.8053	3.507	20	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	P-4:C[6]-3:C[6]-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](PC[6a]IrC)(C[6]C[6]H)(C[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<3>}	C[6](PC[6a]IrC)(C[6]C[6]H)(C[6]C[6]){1|C<2>,2|H<1>}	H(C[6]C[6]2)	118.7700	0.000	1	118.7700	0.000	1	118.8053	3.507	20	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	P-4:C[6]-3:C[6]-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](PC[6a]NiC)(C[6]C[6]H)(C[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<3>,1|H<1>}	C[6](PC[6a]NiC)(C[6]C[6]H)(C[6]C[6]){1|C<3>,2|H<1>}	H(C[6]C[6]2)	116.5750	0.000	1	116.5750	0.000	1	118.8053	3.507	20	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	P-4:C[6]-3:C[6]-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](PC[6a]OsC)(C[6]C[6]H)(C[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<3>,1|H<1>}	C[6](PC[6a]OsC)(C[6]C[6]H)(C[6]C[6]){1|C<3>,2|H<1>}	H(C[6]C[6]2)	118.9770	0.000	1	118.9770	0.000	1	118.8053	3.507	20	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	P-4:C[6]-3:C[6]-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](PC[6a]PdO)(C[6]C[6]H)(C[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<3>,1|H<1>}	C[6](PC[6a]PdO)(C[6]C[6]H)(C[6]C[6]){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2210	0.000	1	120.2210	0.000	1	118.8053	3.507	20	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	P-4:C[6]-3:C[6]-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](PC[6a]PtC)(C[6]C[6]H)(C[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<3>,1|H<1>}	C[6](PC[6a]PtC)(C[6]C[6]H)(C[6]C[6]){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9990	0.000	1	119.9990	0.000	1	118.8053	3.507	20	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	P-4:C[6]-3:C[6]-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](PC[6a]ReO)(C[6]C[6]H)(C[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<3>,1|H<1>}	C[6](PC[6a]ReO)(C[6]C[6]H)(C[6]C[6]){1|C<3>,2|H<1>}	H(C[6]C[6]2)	118.7480	0.000	1	118.7480	0.000	1	118.8053	3.507	20	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	P-4:C[6]-3:C[6]-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](PC[6a]RuC)(C[6]C[6]H)(C[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<2>,1|H<1>}	C[6](PC[6a]RuC)(C[6]C[6]H)(C[6]C[6]){1|C<3>,1|H<1>}	H(C[6]C[6]2)	118.0110	0.000	1	118.3060	0.174	2	118.8053	3.507	20	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	P-4:C[6]-3:C[6]-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](PC[6a]RuC)(C[6]C[6]H)(C[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<3>,1|H<1>}	C[6](PC[6a]RuC)(C[6]C[6]H)(C[6]C[6]){1|C<3>,2|H<1>}	H(C[6]C[6]2)	118.6010	0.000	1	118.3060	0.174	2	118.8053	3.507	20	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	P-4:C[6]-3:C[6]-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](PC[6a]SeN)(C[6]C[6]H)(C[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<3>,1|H<1>}	C[6](PC[6a]SeN)(C[6]C[6]H)(C[6]C[6]){1|C<3>,2|H<1>}	H(C[6]C[6]2)	116.5710	0.000	1	116.5710	0.000	1	118.8053	3.507	20	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	P[6]-4:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6,6a]C[6a])(C[6]P[6]C)(H)	C[6](P[6]C[6,6a]C[6a]2)(C[6]C[6]H)(CN)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C[6a])(C[6]P[6]C)(H){6|C<3>}	C[6](P[6]C[6,6a]C[6a]2)(C[6]C[6]H)(CN){7|C<3>}	H(C[6]C[6]2)	117.5020	0.000	1	117.5020	0.000	1	117.2193	0.163	7	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	P[6]-4:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)(C[6]P[6]C)(H)	C[6](P[6]C[6a]2C[6])(C[6]C[6]H)(CN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]P[6]C)(H){1|H<1>,3|C<3>}	C[6](P[6]C[6a]2C[6])(C[6]C[6]H)(CN){1|C<2>,6|C<3>}	H(C[6]C[6]2)	116.6995	0.135	2	116.6995	0.018	2	117.2193	0.163	7	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	P[6]-4:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]P[6]C)(H)	C[6](P[6]C[6a]2C[6])(C[6]C[6]H)(CN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]P[6]C)(H){1|H<1>,3|C<3>}	C[6](P[6]C[6a]2C[6])(C[6]C[6]H)(CN){1|C<2>,1|H<1>,5|C<3>}	H(C[6]C[6]2)	117.4085	0.256	4	117.4085	0.066	4	117.2193	0.163	7	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	P[6]-4:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]H)(C[6]P[6]O)(H)	C[6](P[6]C[6]Cu2)(C[6]C[6]H)(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]P[6]O)(H){2|Cu<4>,1|C<3>,1|H<1>}	C[6](P[6]C[6]Cu2)(C[6]C[6]H)(OH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	118.4170	0.000	1	118.4170	0.000	1	118.4170	0.000	1	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:C[6]-3:H-1:	Si-4:C[6]-3:C[6]-2:	C[6]-3:	C[6](C[6]C[6]Si)(C[6]C[6]H)(H)	C[6](SiC[6a]2C)(C[6]C[6]H)(C[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6]Si)(C[6]C[6]H)(H){1|C<3>}	C[6](SiC[6a]2C)(C[6]C[6]H)(C[6]C[6]){1|C<2>,2|H<1>}	H(C[6]C[6]2)	119.8890	0.000	1	119.8890	0.000	1	119.8890	0.000	1	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:N[6]-3:H-1:	C[6]-4:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]C)(H)	C[6](C[6]C[5]C[6]H)(C[6]N[6]H)(CN)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]C)(H){1|C<3>,1|C<4>,2|H<1>}	C[6](C[6]C[5]C[6]H)(C[6]N[6]H)(CN){2|H<1>,4|C<3>}	H(C[6]C[6]N[6])	119.0600	0.000	1	119.0600	0.000	1	118.3656	0.329	5	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:N[6]-3:H-1:	C[6]-4:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]C)(H)	C[6](C[6]C[6]HH)(C[6]N[6]H)(CN)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]C)(H){1|C<3>,3|H<1>}	C[6](C[6]C[6]HH)(C[6]N[6]H)(CN){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	118.1765	0.240	2	117.9963	0.126	3	118.3656	0.329	5	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:N[6]-3:H-1:	C[6]-4:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]C)(H)	C[6](C[6]C[6]HH)(C[6]N[6]H)(CN)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]C)(H){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]N[6]H)(CN){2|C<4>,2|H<1>}	H(C[6]C[6]N[6])	117.6360	0.000	1	117.9963	0.126	3	118.3656	0.329	5	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:N[6]-3:H-1:	C[6]-4:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]H)(H)	C[6](C[6]C[6]DH)(C[6]N[6]H)(CN)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]H)(H){1|C<3>,1|D<1>,2|H<1>}	C[6](C[6]C[6]DH)(C[6]N[6]H)(CN){1|C<3>,2|H<1>}	H(C[6]C[6]N[6])	118.7790	0.000	1	118.7790	0.000	1	118.3656	0.329	5	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:N[6]-3:H-1:	C[6]-4:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]N)(N[6]C[6]C)(H)	C[6](C[6]C[6]HH)(C[6]N[6]H)(NN)	H(C[6]C[6]N[6])	C[6](C[6]C[6]N)(N[6]C[6]C)(H){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]N[6]H)(NN){2|C<4>,2|H<1>}	H(C[6]C[6]N[6])	117.7170	0.000	1	117.7170	0.000	1	117.7170	0.000	1	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:N[6]-3:H-1:	C[6]-4:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]S)(N[6]C[6]S)(H)	C[6](C[6]C[6]CH)(C[6]N[6]H)(SC[6a])	H(C[6]C[6]N[6])	C[6](C[6]C[6]S)(N[6]C[6]S)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[6]CH)(C[6]N[6]H)(SC[6a]){1|C<4>,1|S<4>,2|H<1>}	H(C[6]C[6]N[6])	118.2970	0.000	1	118.2970	0.000	1	118.2045	0.017	2	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	C[6]-3:N[6]-3:H-1:	C[6]-4:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6]S)(N[6]C[6]S)(H)	C[6](C[6]C[6]HH)(C[6]N[6]H)(SC[6a])	H(C[6]C[6]N[6])	C[6](C[6]C[6]S)(N[6]C[6]S)(H){1|C<3>,1|C<4>,1|S<2>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]N[6]H)(SC[6a]){1|C<4>,1|S<4>,2|H<1>}	H(C[6]C[6]N[6])	118.1120	0.000	1	118.1120	0.000	1	118.2045	0.017	2	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-2:	C[6]-3:	C[6](N[5,6]N[5,6]C[5])(C[6]C[6]O)(H)	C[6](C[6]C[6a]C[6]H)(C[6]N[5,6]H)(OC)	H(C[6]N[5,6]C[6])	C[6](N[5,6]N[5,6]C[5])(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|O<1>,3|C<4>}	C[6](C[6]C[6a]C[6]H)(C[6]N[5,6]H)(OC){1|H<1>,1|N<3>,4|C<3>}	H(C[6]N[5,6]C[6])	119.9660	0.000	1	119.9660	0.000	1	119.9660	0.000	1	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:2:	3:	N[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-2:	C[6]-3:	C[6](N[6]C[6a]C[6])(C[6]C[6]C)(H)	C[6](C[6]C[6a]C[6]H)(C[6]N[6]H)(CN)	H(C[6]C[6]N[6])	C[6](N[6]C[6a]C[6])(C[6]C[6]C)(H){2|H<1>,4|C<3>}	C[6](C[6]C[6a]C[6]H)(C[6]N[6]H)(CN){1|C<2>,4|C<3>}	H(C[6]C[6]N[6])	118.4250	0.116	2	118.4250	0.013	2	118.4250	0.013	2	119.3635	1.907	221	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:N-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[5,6]N)(H)	C[6](C[5,6]C[5,6]N[5]H)(C[6]C[6,6]H)(NOO)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[5,6]N)(H){1|C<4>,1|H<1>,1|N<3>,1|O<1>,2|C<3>}	C[6](C[5,6]C[5,6]N[5]H)(C[6]C[6,6]H)(NOO){2|C<4>,4|C<3>}	H(C[6]C[6,6]C[6])	120.3870	0.000	2	120.3870	0.000	2	120.3870	0.000	2	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]C)(H)	C[6](C[6]C[6a]C[6]H)(C[6]C[6,6]H)(CHO)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]C)(H){1|C<3>,1|O<2>,2|C<4>,3|H<1>}	C[6](C[6]C[6a]C[6]H)(C[6]C[6,6]H)(CHO){1|H<1>,2|C<4>,3|C<3>}	H(C[6]C[6,6]C[6])	119.1540	0.959	3	118.8618	0.955	4	118.9368	0.745	5	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]C)(H)	C[6](C[6]C[6a]C[6]H)(C[6]C[6,6]H)(CHO)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]C)(H){1|C<4>,1|O<2>,2|H<1>,3|C<3>}	C[6](C[6]C[6a]C[6]H)(C[6]C[6,6]H)(CHO){1|C<4>,1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6,6]C[6])	117.9850	0.000	1	118.8618	0.955	4	118.9368	0.745	5	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6,6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]C)(H)	C[6](C[6]C[6a]C[6]H)(C[6]C[6,6]H)(COO)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]C)(H){1|C<4>,1|H<1>,1|N<3>,1|O<1>,2|C<3>}	C[6](C[6]C[6a]C[6]H)(C[6]C[6,6]H)(COO){2|H<1>,4|C<3>}	H(C[6]C[6,6]C[6])	119.2370	0.000	1	119.2370	0.000	1	118.9368	0.745	5	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6,6a]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]C)(H)	C[6](C[5,6]C[5,5]C[5]O[6])(C[6]C[6,6a]H)(COO)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]C)(H){1|H<1>,1|O<2>,2|C<3>,2|C<4>}	C[6](C[5,6]C[5,5]C[5]O[6])(C[6]C[6,6a]H)(COO){2|C<3>,2|C<4>,2|H<1>,2|O<2>}	H(C[6]C[6,6a]C[6])	120.4930	0.000	1	120.4930	0.000	1	119.4243	0.870	3	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6,6a]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]C)(H)	C[6](C[5,6]N[5,6]C[5]H)(C[6]C[6,6a]H)(CHO)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]C)(H){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	C[6](C[5,6]N[5,6]C[5]H)(C[6]C[6,6a]H)(CHO){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6,6a]C[6])	118.8900	0.167	2	118.8900	0.028	2	119.4243	0.870	3	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]C)(H)	C[6](C[6,6]C[6,6]C[6]2)(C[6]C[6,6a]H)(COO)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]C)(H){1|C<3>,1|O<1>,1|O<2>,3|C<4>}	C[6](C[6,6]C[6,6]C[6]2)(C[6]C[6,6a]H)(COO){2|C<3>,4|C<4>,4|H<1>}	H(C[6]C[6,6a]C[6])	119.0320	0.000	1	119.0320	0.000	1	119.0320	0.000	1	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:N-3:	C[6]-3:	C[6](C[6,6a]C[6,6,6a]C[6a])(C[6]C[6,6]N)(H)	C[6](C[6,6]C[3x6]C[6]H)(C[6]C[6,6a]H)(NOO)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6,6a]C[6a])(C[6]C[6,6]N)(H){2|C<3>,2|C<4>,2|H<1>}	C[6](C[6,6]C[3x6]C[6]H)(C[6]C[6,6a]H)(NOO){1|C<4>,2|H<1>,4|C<3>}	H(C[6]C[6,6a]C[6])	119.4140	0.000	1	119.4140	0.000	1	119.4140	0.000	1	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6,6a]C[5a,6,6a]C[6a])(C[6]C[6]C)(H)	C[6](C[6]N[5a,6]C[6a]H)(C[6]C[6,6a]H)(CHO)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[5a,6,6a]C[6a])(C[6]C[6]C)(H){1|N<3>,2|H<1>,3|C<3>}	C[6](C[6]N[5a,6]C[6a]H)(C[6]C[6,6a]H)(CHO){1|N<2>,4|C<3>}	H(C[6]C[6,6a]C[6])	119.3050	0.000	1	119.3050	0.000	1	118.7726	1.063	5	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6,6a]C[6,6a,6a]C[6a])(C[6]C[6]C)(H)	C[6](C[6]C[6,6a]C[6a]H)(C[6]C[6,6a]H)(CHO)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a,6a]C[6a])(C[6]C[6]C)(H){1|H<1>,1|O<2>,4|C<3>}	C[6](C[6]C[6,6a]C[6a]H)(C[6]C[6,6a]H)(CHO){5|C<3>}	H(C[6]C[6,6a]C[6])	118.7240	0.000	1	118.7240	0.000	1	118.7726	1.063	5	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H)	C[6](C[6]C[6a]O[6]H)(C[6]C[6,6a]H)(CHN)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H){1|O<2>,2|H<1>,3|C<3>}	C[6](C[6]C[6a]O[6]H)(C[6]C[6,6a]H)(CHN){4|C<3>}	H(C[6]C[6,6a]C[6])	119.9570	0.000	1	119.9570	0.000	1	118.7726	1.063	5	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H)	C[6](C[6]C[6a]O[6]O)(C[6]C[6,6a]H)(COO)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H){1|H<1>,2|O<2>,3|C<3>}	C[6](C[6]C[6a]O[6]O)(C[6]C[6,6a]H)(COO){4|C<3>}	H(C[6]C[6,6a]C[6])	118.7040	0.000	1	118.7040	0.000	1	118.7726	1.063	5	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H)	C[6](C[6]C[6a]S[6]H)(C[6]C[6,6a]H)(CC[6a]O)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H){1|S<2>,2|H<1>,3|C<3>}	C[6](C[6]C[6a]S[6]H)(C[6]C[6,6a]H)(CC[6a]O){4|C<3>}	H(C[6]C[6,6a]C[6])	117.1730	0.000	1	117.1730	0.000	1	118.7726	1.063	5	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C[6a]-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]C[6])(H)	C[6](C[6]C[6a]C[6]H)(C[6]C[6,6a]H)(C[6a]C[6a]2)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]C[6])(H){1|C<4>,2|H<1>,5|C<3>}	C[6](C[6]C[6a]C[6]H)(C[6]C[6,6a]H)(C[6a]C[6a]2){1|O<2>,2|H<1>,7|C<3>}	H(C[6]C[6,6a]C[6])	118.7580	0.000	1	118.5896	0.034	5	118.7248	0.061	10	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C[6a]-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]C[6])(H)	C[6](C[6]C[6a]C[6]H)(C[6]C[6,6a]H)(C[6a]C[6a]2)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]C[6])(H){1|C<4>,2|H<1>,5|C<3>}	C[6](C[6]C[6a]C[6]H)(C[6]C[6,6a]H)(C[6a]C[6a]2){3|H<1>,7|C<3>}	H(C[6]C[6,6a]C[6])	118.5475	0.184	4	118.5896	0.034	5	118.7248	0.061	10	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C[6a]-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]C[6])(H)	C[6](C[6]C[6a]O[6]O)(C[6]C[6,6a]H)(C[6a]C[6a]2)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6a]C[6])(H){1|H<1>,2|O<2>,5|C<3>}	C[6](C[6]C[6a]O[6]O)(C[6]C[6,6a]H)(C[6a]C[6a]2){1|H<1>,1|N<3>,6|C<3>}	H(C[6]C[6,6a]C[6])	118.8282	0.264	4	118.8282	0.070	4	118.7248	0.061	10	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C[6a]-3:	C[6]-3:	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6a]C[6])(H)	C[6](C[6]C[6a]2O[6])(C[6]C[6,6a]H)(C[6a]C[6a]2)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6a]C[6])(H){1|O<2>,7|C<3>}	C[6](C[6]C[6a]2O[6])(C[6]C[6,6a]H)(C[6a]C[6a]2){2|H<1>,8|C<3>}	H(C[6]C[6,6a]C[6])	118.9870	0.000	1	118.9870	0.000	1	118.7248	0.061	10	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:N-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]N)(H)	C[6](C[6]C[5]O[6]H)(C[6]C[6,6a]H)(NOO)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]N)(H){1|C<4>,1|O<2>,2|C<3>,2|H<1>}	C[6](C[6]C[5]O[6]H)(C[6]C[6,6a]H)(NOO){1|Fe<10>,2|C<3>,2|C<4>}	H(C[6]C[6,6a]C[6])	120.5160	0.000	1	120.5160	0.000	1	119.1200	1.591	7	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:N-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]N)(H)	C[6](C[6]C[6a]N[6]H)(C[6]C[6,6a]H)(NOO)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]N)(H){1|N<3>,2|H<1>,3|C<3>}	C[6](C[6]C[6a]N[6]H)(C[6]C[6,6a]H)(NOO){1|S<4>,4|C<3>}	H(C[6]C[6,6a]C[6])	120.2740	0.000	1	120.2740	0.000	1	119.1200	1.591	7	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:N-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]N)(H)	C[6](C[6]C[6a]O[6]H)(C[6]C[6,6a]H)(NOO)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]N)(H){1|O<2>,2|H<1>,3|C<3>}	C[6](C[6]C[6a]O[6]H)(C[6]C[6,6a]H)(NOO){4|C<3>}	H(C[6]C[6,6a]C[6])	120.5510	0.000	1	120.5510	0.000	1	119.1200	1.591	7	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:N-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]N)(H)	C[6](C[6]C[6a]S[6]H)(C[6]C[6,6a]H)(NOO)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]N)(H){1|N<2>,1|S<2>,2|C<3>,2|H<1>}	C[6](C[6]C[6a]S[6]H)(C[6]C[6,6a]H)(NOO){4|C<3>}	H(C[6]C[6,6a]C[6])	118.2180	0.000	1	118.1248	0.086	4	119.1200	1.591	7	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:N-3:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]N)(H)	C[6](C[6]C[6a]S[6]H)(C[6]C[6,6a]H)(NOO)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]N)(H){1|S<2>,2|H<1>,3|C<3>}	C[6](C[6]C[6a]S[6]H)(C[6]C[6,6a]H)(NOO){4|C<3>}	H(C[6]C[6,6a]C[6])	118.0937	0.350	3	118.1248	0.086	4	119.1200	1.591	7	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	As-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]As)(C[6]C[6]H)(H)	C[6](AsC[6]2Pd)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]As)(C[6]C[6]H)(H){1|C<2>,2|H<1>}	C[6](AsC[6]2Pd)(C[6]C[6]H)2{1|C<3>,1|H<1>}	H(C[6]C[6]2)	115.1210	0.000	1	115.3083	4.796	3	115.3083	4.796	3	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	As-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]As)(C[6]C[6]H)(H)	C[6](AsC[6]2Pd)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]As)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](AsC[6]2Pd)(C[6]C[6]H)2{1|C<2>,2|H<1>}	H(C[6]C[6]2)	115.4020	3.089	2	115.3083	4.796	3	115.3083	4.796	3	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	As-4:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]N[6]As)(C[6]C[6]H)(H)	C[6](AsC[6a]2Rh)(C[6]C[6]H)(N[6]C[6]C)	H(C[6]C[6]2)	C[6](C[6]N[6]As)(C[6]C[6]H)(H){1|C<3>,2|C<4>}	C[6](AsC[6a]2Rh)(C[6]C[6]H)(N[6]C[6]C){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.5890	0.000	1	119.5890	0.000	1	119.5890	0.000	1	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	B-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]B)(C[6]C[6]H)(H)	C[6](BC[6a]2C[6])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]B)(C[6]C[6]H)(H){1|C<2>,2|H<1>}	C[6](BC[6a]2C[6])(C[6]C[6]H)2{1|C<3>,1|H<1>}	H(C[6]C[6]2)	112.5910	0.000	1	112.5910	0.000	1	112.5910	0.000	1	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	B-4:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]B)(H)	C[6](BC[6a]N[5]2)(C[6]C[6]H)(N[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]B)(H){1|C<3>,2|H<1>}	C[6](BC[6a]N[5]2)(C[6]C[6]H)(N[6]C[6]H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8820	0.033	2	119.8820	0.001	2	119.8820	0.001	2	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	B-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]B)(H)	C[6](BC[6a]C[6]2)(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]B)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](BC[6a]C[6]2)(N[6]C[6]Fe)(C[6]C[6]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.2059	0.215	17	119.2059	0.046	17	119.3617	0.109	63	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	B-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]B)(H)	C[6](BC[6a]C[6]2)(N[6]C[6]Mg)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]B)(H){1|Mg<6>,1|C<3>,1|H<1>}	C[6](BC[6a]C[6]2)(N[6]C[6]Mg)(C[6]C[6]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.1741	0.130	12	119.1741	0.017	12	119.3617	0.109	63	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	B-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]B)(H)	C[6](BC[6a]C[6]2)(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]B)(H){1|Pt<6>,1|C<3>,1|H<1>}	C[6](BC[6a]C[6]2)(N[6]C[6]Pt)(C[6]C[6]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.1915	0.466	2	119.1915	0.217	2	119.3617	0.109	63	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	B-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]B)(H)	C[6](BC[6a]C[6]2)(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]B)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](BC[6a]C[6]2)(N[6]C[6]Ru)(C[6]C[6]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.1568	0.300	9	119.1568	0.090	9	119.3617	0.109	63	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	B-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]B)(H)	C[6](BC[6a]C[6]O)(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]B)(H){1|Pt<6>,1|C<3>,1|H<1>}	C[6](BC[6a]C[6]O)(N[6]C[6]Pt)(C[6]C[6]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.6028	0.123	4	119.6028	0.015	4	119.3617	0.109	63	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	B-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]B)(H)	C[6](BC[6a]N[5]2)(N[6]C[6]Co)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]B)(H){1|Co<6>,1|C<3>,1|H<1>}	C[6](BC[6a]N[5]2)(N[6]C[6]Co)(C[6]C[6]H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.7945	0.177	2	119.7945	0.032	2	119.3617	0.109	63	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	B-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]B)(H)	C[6](BC[6a]N[5]2)(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]B)(H){1|Fe<5>,1|C<3>,1|H<1>}	C[6](BC[6a]N[5]2)(N[6]C[6]Fe)(C[6]C[6]H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.8915	0.035	2	119.7350	0.021	15	119.3617	0.109	63	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	B-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]B)(H)	C[6](BC[6a]N[5]2)(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]B)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](BC[6a]N[5]2)(N[6]C[6]Fe)(C[6]C[6]H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.7109	0.139	13	119.7350	0.021	15	119.3617	0.109	63	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	B-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]B)(H)	C[6](BC[6a]N[5]2)(N[6]C[6]Sc)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]B)(H){1|Sc<8>,1|C<3>,1|H<1>}	C[6](BC[6a]N[5]2)(N[6]C[6]Sc)(C[6]C[6]H){1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.1880	0.718	2	119.1880	0.516	2	119.3617	0.109	63	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	B[5]-4:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]B[5]N[6])(C[6]C[6]H)(H)	C[6](B[5]O[5]2N)(C[6]C[6]H)(N[6]C[6]V)	H(C[6]C[6]2)	C[6](C[6]B[5]N[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<4>,1|V<7>,2|O<2>}	C[6](B[5]O[5]2N)(C[6]C[6]H)(N[6]C[6]V){1|H<1>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	119.6270	0.000	1	119.6270	0.000	1	119.6270	0.000	1	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	B[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]B[6,6]C[6])(C[6]N[6]H)(H)	C[6](B[6,6]N[5a,6,6]N[5a,6]O[6])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]B[6,6]C[6])(C[6]N[6]H)(H){1|C<3>,1|O<2>,2|H<1>,2|N<3>}	C[6](B[6,6]N[5a,6,6]N[5a,6]O[6])(C[6]C[6]H)2{1|N<3>,2|H<1>,5|C<3>}	H(C[6]C[6]2)	119.2955	0.428	2	119.2955	0.183	2	119.2955	0.183	2	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	B[6]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]B[6]N[6])(C[6]C[6]H)(H)	C[6](B[6]O[6]2O)(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]B[6]N[6])(C[6]C[6]H)(H){1|Ir<8>,1|C<3>,1|H<1>,1|O<3>,2|O<2>}	C[6](B[6]O[6]2O)(N[6]C[6]Ir)(C[6]C[6]H){1|B<3>,1|B<4>,1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.4215	0.103	2	119.4215	0.011	2	119.4215	0.011	2	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	B[6a]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]B[6a]C[6])(C[6]C[6]H)(H)	C[6](B[6a]O[6a]2O)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]2)	C[6](C[6]B[6a]C[6])(C[6]C[6]H)(H){1|N<3>,2|H<1>,3|O<2>}	C[6](B[6a]O[6a]2O)(C[6]C[6]H)(C[6]N[6]H){2|H<1>,3|C<3>}	H(C[6]C[6]2)	118.8943	0.129	3	118.8943	0.017	3	118.8943	0.017	3	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](CC[5x3,5x5,20x6]HH)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](CC[5x3,5x5,20x6]HH)(C[6]C[6]H)2{1|C<2>,2|H<1>}	H(C[6]C[6]2)	120.6180	5.991	2	120.6180	35.887	2	119.7743	2.406	20	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](CC[5x3,5x5,20x6]HO)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](CC[5x3,5x5,20x6]HO)(C[6]C[6]H)(C[6]N[6]H){1|Co<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4230	0.000	1	120.4230	0.000	1	119.7743	2.406	20	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](CC[6a]2C[6])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](CC[6a]2C[6])(C[6]C[6]H)2{1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.0385	0.173	12	120.0385	0.030	12	119.7743	2.406	20	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](CC[6a]C[6]O)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Pd<4>,1|C<2>,1|H<1>}	C[6](CC[6a]C[6]O)(C[6]C[6]H)2{1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.3680	0.000	1	119.3680	0.000	1	119.7743	2.406	20	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](CC[6a]SiH)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|H<1>,1|O<1>}	C[6](CC[6a]SiH)(C[6]C[6]H)2{1|C<3>,2|C<4>}	H(C[6]C[6]2)	118.4990	0.222	4	118.4990	0.049	4	119.7743	2.406	20	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C-4:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](CC[5x3,3x5,11x6]HH)(C[6]C[6]H)(N[6]C[6]C)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](CC[5x3,3x5,11x6]HH)(C[6]C[6]H)(N[6]C[6]C){1|C<3>,2|H<1>}	H(C[6]C[6]2)	115.8090	0.000	1	115.8090	0.000	1	118.4937	5.406	3	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C-4:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](CC[5x3,3x5,11x6]HH)(C[6]C[6]H)(N[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](CC[5x3,3x5,11x6]HH)(C[6]C[6]H)(N[6]C[6]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8190	0.000	1	119.8190	0.000	1	118.4937	5.406	3	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C-4:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](CC[5x3,5x5,20x6]HH)(C[6]C[6]H)(N[6]C[6]C)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](CC[5x3,5x5,20x6]HH)(C[6]C[6]H)(N[6]C[6]C){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8530	0.000	1	119.8530	0.000	1	118.4937	5.406	3	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](CC[3x3,3x5,12x6]HO)(N[6]C[6]Co)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<8>,1|C<3>,1|H<1>}	C[6](CC[3x3,3x5,12x6]HO)(N[6]C[6]Co)(C[6]C[6]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6950	0.000	1	120.6950	0.000	1	120.4114	0.390	101	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](CC[3x3,4,3x5,14x6]HN)(N[6]C[6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](CC[3x3,4,3x5,14x6]HN)(N[6]C[6]Pd)(C[6]C[6]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6380	0.000	1	120.6380	0.000	1	120.4114	0.390	101	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](CC[3x3,4,3x5,14x6]HO)(N[6]C[6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](CC[3x3,4,3x5,14x6]HO)(N[6]C[6]Pd)(C[6]C[6]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5115	0.111	2	120.5115	0.012	2	120.4114	0.390	101	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](CC[5x3,5x5,20x6]HO)(N[6]C[6]Co)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Co<4>,1|C<3>,1|H<1>}	C[6](CC[5x3,5x5,20x6]HO)(N[6]C[6]Co)(C[6]C[6]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6910	0.000	1	120.6910	0.000	1	120.4114	0.390	101	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](CC[6]N[5]C)(N[6]C[6]Rh)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Rh<7>,1|C<3>,1|H<1>}	C[6](CC[6]N[5]C)(N[6]C[6]Rh)(C[6]C[6]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3450	0.133	2	120.3450	0.018	2	120.4114	0.390	101	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](CC[6]N[5]H)(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](CC[6]N[5]H)(N[6]C[6]Fe)(C[6]C[6]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3863	0.044	4	120.3863	0.002	4	120.4114	0.390	101	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](CC[6]N[5]H)(N[6]C[6]Mn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<6>,1|C<3>,1|H<1>}	C[6](CC[6]N[5]H)(N[6]C[6]Mn)(C[6]C[6]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6100	0.173	2	120.6100	0.030	2	120.4114	0.390	101	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](CC[6]N[5]H)(N[6]C[6]Ni)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<6>,1|C<3>,1|H<1>}	C[6](CC[6]N[5]H)(N[6]C[6]Ni)(C[6]C[6]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3650	0.246	3	120.3650	0.061	3	120.4114	0.390	101	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](CC[6]N[6]H)(N[6]C[6]Mn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mn<7>,1|C<3>,1|H<1>}	C[6](CC[6]N[6]H)(N[6]C[6]Mn)(C[6]C[6]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6140	0.406	2	120.6140	0.165	2	120.4114	0.390	101	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](CC[6a]C[6]C)(N[6]C[6]Ag)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ag<4>,1|C<3>,1|H<1>}	C[6](CC[6a]C[6]C)(N[6]C[6]Ag)(C[6]C[6]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3737	0.154	3	120.3737	0.024	3	120.4114	0.390	101	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](CC[6a]C[6]C)(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](CC[6a]C[6]C)(N[6]C[6]Cu)(C[6]C[6]H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.5438	0.221	4	120.3660	0.062	10	120.4114	0.390	101	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](CC[6a]C[6]C)(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](CC[6a]C[6]C)(N[6]C[6]Cu)(C[6]C[6]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2475	0.199	6	120.3660	0.062	10	120.4114	0.390	101	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](CC[6a]C[6]C)(N[6]C[6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](CC[6a]C[6]C)(N[6]C[6]Pd)(C[6]C[6]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7825	0.101	2	119.8328	0.076	4	120.4114	0.390	101	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](CC[6a]C[6]C)(N[6]C[6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<6>,1|C<3>,1|H<1>}	C[6](CC[6a]C[6]C)(N[6]C[6]Pd)(C[6]C[6]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8830	0.457	2	119.8328	0.076	4	120.4114	0.390	101	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](CC[6a]C[6]F)(N[6]C[6]Ni)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ni<4>,1|C<3>,1|H<1>}	C[6](CC[6a]C[6]F)(N[6]C[6]Ni)(C[6]C[6]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.7670	0.000	1	120.7670	0.000	1	120.4114	0.390	101	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](CC[6a]C[6]H)(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ir<6>,1|C<3>,1|H<1>}	C[6](CC[6a]C[6]H)(N[6]C[6]Ir)(C[6]C[6]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7260	0.133	2	119.7260	0.018	2	120.4114	0.390	101	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](CC[6a]C[6]N)(N[6]C[6]Re)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Re<6>,1|C<3>,1|H<1>}	C[6](CC[6a]C[6]N)(N[6]C[6]Re)(C[6]C[6]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.9843	0.677	4	120.9843	0.458	4	120.4114	0.390	101	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](CC[6a]C[6]O)(N[6]C[6]Ag)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ag<4>,1|C<3>,1|H<1>}	C[6](CC[6a]C[6]O)(N[6]C[6]Ag)(C[6]C[6]H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.4690	0.245	2	120.3123	0.120	12	120.4114	0.390	101	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](CC[6a]C[6]O)(N[6]C[6]Ag)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Ag<4>,1|C<3>,1|H<1>}	C[6](CC[6a]C[6]O)(N[6]C[6]Ag)(C[6]C[6]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2810	0.365	10	120.3123	0.120	12	120.4114	0.390	101	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](CC[6a]C[6]O)(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](CC[6a]C[6]O)(N[6]C[6]Cu)(C[6]C[6]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3358	0.372	4	120.3532	0.087	6	120.4114	0.390	101	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](CC[6a]C[6]O)(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](CC[6a]C[6]O)(N[6]C[6]Cu)(C[6]C[6]H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.3880	0.120	2	120.3532	0.087	6	120.4114	0.390	101	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](CC[6a]C[6]O)(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](CC[6a]C[6]O)(N[6]C[6]Fe)(C[6]C[6]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4553	0.167	11	120.4553	0.028	11	120.4114	0.390	101	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](CC[6a]C[6]O)(N[6]C[6]Mo)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mo<8>,1|C<3>,1|H<1>}	C[6](CC[6a]C[6]O)(N[6]C[6]Mo)(C[6]C[6]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4214	1.433	14	120.4214	2.055	14	120.4114	0.390	101	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](CC[6a]C[6]O)(N[6]C[6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pd<4>,1|C<3>,1|H<1>}	C[6](CC[6a]C[6]O)(N[6]C[6]Pd)(C[6]C[6]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2435	0.489	4	120.2435	0.239	4	120.4114	0.390	101	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](CC[6a]C[6]O)(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Pt<4>,1|C<3>,1|H<1>}	C[6](CC[6a]C[6]O)(N[6]C[6]Pt)(C[6]C[6]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1365	0.551	2	120.1365	0.303	2	120.4114	0.390	101	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](CC[6a]C[6]O)(N[6]C[6]Zn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zn<5>,1|C<3>,1|H<1>}	C[6](CC[6a]C[6]O)(N[6]C[6]Zn)(C[6]C[6]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.5948	0.527	6	120.5948	0.278	6	120.4114	0.390	101	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](CC[6a]N[5]2)(N[6]C[6]Cr)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cr<6>,1|C<3>,1|H<1>}	C[6](CC[6a]N[5]2)(N[6]C[6]Cr)(C[6]C[6]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.7700	0.000	1	120.7700	0.000	1	120.4114	0.390	101	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](CC[6a]N[6]H)(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Fe<6>,1|C<3>,1|H<1>}	C[6](CC[6a]N[6]H)(N[6]C[6]Fe)(C[6]C[6]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.8280	0.000	1	120.8280	0.000	1	120.4114	0.390	101	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](CN[5a]C[6]N[5])(N[6]C[6]Cr)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Cr<6>,1|C<3>,1|H<1>}	C[6](CN[5a]C[6]N[5])(N[6]C[6]Cr)(C[6]C[6]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6330	0.358	2	120.6330	0.128	2	120.4114	0.390	101	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[3,4,4,6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[3,4,4,6]C)(C[6]C[4,4,3x6]H)(H)	C[6](C[3,4,4,6]C[4,4,3x6]H[3,3,4]2)(C[6]C[6]H)(CC[5]C)	H(C[6]C[6]2)	C[6](C[6]C[3,4,4,6]C)(C[6]C[4,4,3x6]H)(H){1|C<3>,2|C<4>,2|H<3>}	C[6](C[3,4,4,6]C[4,4,3x6]H[3,3,4]2)(C[6]C[6]H)(CC[5]C){1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	116.6310	0.000	1	116.6310	0.000	1	116.6310	0.000	1	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[3,5]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[3,5]C[6])(C[6]N[6]H)(H)	C[6](C[3,5]C[3,5,6]C[3]C[5])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[3,5]C[6])(C[6]N[6]H)(H){1|H<1>,1|O<1>,2|C<3>,2|C<4>}	C[6](C[3,5]C[3,5,6]C[3]C[5])(C[6]C[6]H)2{1|C<3>,1|N<3>,1|O<1>,2|C<4>,4|H<1>}	H(C[6]C[6]2)	119.6335	0.251	2	119.6335	0.063	2	119.6335	0.063	2	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[3,6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[3,6]C)(C[6]C[6]H)(H)	C[6](C[3,6]C[3,6]C[3]H)(C[6]C[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[3,6]C)(C[6]C[6]H)(H){1|H<1>,1|O<2>,2|C<4>}	C[6](C[3,6]C[3,6]C[3]H)(C[6]C[6]H)(CNO){2|C<3>,3|H<1>}	H(C[6]C[6]2)	118.5340	0.000	1	118.5340	0.000	1	118.5340	0.000	1	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[3,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[3,6]C[6])(C[6]C[6]H)(H)	C[6](C[3,6]C[3,6]C[3]C[6])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[3,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,3|C<4>}	C[6](C[3,6]C[3,6]C[3]C[6])(C[6]C[6]H)2{1|C<2>,2|C<4>,7|H<1>}	H(C[6]C[6]2)	119.5765	0.046	2	119.5765	0.002	2	119.5765	0.002	2	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[3]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[3]C[6])(C[6]C[6]H)(H)	C[6](C[3]C[3]2H)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[3]C[6])(C[6]C[6]H)(H){1|C<2>,2|C<4>,3|H<1>}	C[6](C[3]C[3]2H)(C[6]C[6]H)2{3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.3530	0.000	1	119.3530	0.000	1	119.3530	0.000	1	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[3x6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[3x6]C[6])(C[6]C[5,6]H)(H)	C[6](C[3x6]C[6,6]3)(C[6]C[5,6]H)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[3x6]C[6])(C[6]C[5,6]H)(H){1|H<1>,6|C<4>}	C[6](C[3x6]C[6,6]3)(C[6]C[5,6]H)(C[6]C[6]H){6|C<4>,7|H<1>}	H(C[6]C[6]2)	119.0510	0.000	1	119.0510	0.000	1	119.0510	0.000	1	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[3x6]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[3x6]N[6])(C[6]C[6,6a]C)(H)	C[6](C[3x6]C[6,6]3)(N[6]C[6,6a]O)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[3x6]N[6])(C[6]C[6,6a]C)(H){1|O<1>,2|C<3>,3|C<4>}	C[6](C[3x6]C[6,6]3)(N[6]C[6,6a]O)(C[6]C[6]H){2|C<3>,4|C<4>,6|H<1>}	H(C[6]C[6]2)	117.6310	0.000	1	117.6310	0.000	1	117.6310	0.000	1	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[4,5]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[4,5]C[6])(C[6]C[6]H)(H)	C[6](C[4,5]C[4,5]O[4]O[5])(C[6]C[5a]C[6])(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[4,5]C[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,2|C<3>,2|O<2>}	C[6](C[4,5]C[4,5]O[4]O[5])(C[6]C[5a]C[6])(C[6]C[6]H){1|C<3>,1|H<1>,1|N<2>,1|O<1>,1|O<2>,1|S<2>,3|C<4>}	H(C[6]C[6]2)	119.6380	0.000	1	119.6380	0.000	1	119.6380	0.000	1	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[4,6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[4,6]C)(C[6]C[6]H)(H)	C[6](C[4,6]C[4,6]2H)(C[6]C[6]H)(CCC)	H(C[6]C[6]2)	C[6](C[6]C[4,6]C)(C[6]C[6]H)(H){1|H<1>,1|O<1>,2|C<4>}	C[6](C[4,6]C[4,6]2H)(C[6]C[6]H)(CCC){1|C<4>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	118.0535	0.865	2	118.0535	0.748	2	118.0535	0.748	2	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[4]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[4]C[6])(C[6]C[6]H)(H)	C[6](C[4]C[4]2H)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]2)	C[6](C[6]C[4]C[6])(C[6]C[6]H)(H){1|N<3>,2|C<4>,3|H<1>}	C[6](C[4]C[4]2H)(C[6]C[6]H)(C[6]N[6]H){1|C<4>,3|C<3>,4|H<1>}	H(C[6]C[6]2)	119.4305	0.269	2	119.4305	0.073	2	120.0288	0.440	24	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[4]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[4]C[6])(C[6]C[6]H)(H)	C[6](C[4]C[6a]C[4]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[4]C[6])(C[6]C[6]H)(H){1|C<2>,1|C<3>,2|C<4>,2|H<1>}	C[6](C[4]C[6a]C[4]2)(C[6]C[6]H)2{2|O<2>,3|H<1>,4|C<3>}	H(C[6]C[6]2)	121.2230	0.000	1	121.2230	0.000	1	120.0288	0.440	24	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[4]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[4]C[6])(C[6]N[6]H)(H)	C[6](C[4]C[4]2H)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[4]C[6])(C[6]N[6]H)(H){1|C<3>,2|C<4>,3|H<1>}	C[6](C[4]C[4]2H)(C[6]C[6]H)2{1|C<4>,1|N<3>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	119.9446	0.388	19	120.0289	0.395	21	120.0288	0.440	24	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[4]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[4]C[6])(C[6]N[6]H)(H)	C[6](C[4]C[4]2H)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[4]C[6])(C[6]N[6]H)(H){1|C<3>,2|H<1>,3|C<4>}	C[6](C[4]C[4]2H)(C[6]C[6]H)2{1|C<4>,1|N<3>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	120.8290	1.943	2	120.0289	0.395	21	120.0288	0.440	24	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[4]-4:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[4]N[6])(C[6]C[6]H)(H)	C[6](C[4]C[4]2H)(C[6]C[6]H)(N[6]C[6]C)	H(C[6]C[6]2)	C[6](C[6]C[4]N[6])(C[6]C[6]H)(H){1|C<3>,2|H<1>,3|C<4>}	C[6](C[4]C[4]2H)(C[6]C[6]H)(N[6]C[6]C){1|C<4>,3|C<3>,4|H<1>}	H(C[6]C[6]2)	118.7450	1.441	2	119.1913	1.636	3	119.6552	0.916	6	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[4]-4:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[4]N[6])(C[6]C[6]H)(H)	C[6](C[4]C[4]2H)(C[6]C[6]H)(N[6]C[6]C)	H(C[6]C[6]2)	C[6](C[6]C[4]N[6])(C[6]C[6]H)(H){1|C<4>,2|H<1>,3|C<3>}	C[6](C[4]C[4]2H)(C[6]C[6]H)(N[6]C[6]C){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.0840	0.000	1	119.1913	1.636	3	119.6552	0.916	6	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[4]-4:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[4]N[6])(C[6]C[6]H)(H)	C[6](C[4]C[4]2H)(C[6]C[6]H)(N[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[4]N[6])(C[6]C[6]H)(H){1|C<3>,2|C<4>,3|H<1>}	C[6](C[4]C[4]2H)(C[6]C[6]H)(N[6]C[6]H){1|C<4>,3|C<3>,4|H<1>}	H(C[6]C[6]2)	120.1190	0.096	3	120.1190	0.009	3	119.6552	0.916	6	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[4]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[4]N[6])(C[6]C[6]H)(H)	C[6](C[4]C[4]2C)(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[4]N[6])(C[6]C[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>,3|C<4>}	C[6](C[4]C[4]2C)(N[6]C[6]Cu)(C[6]C[6]H){1|C<3>,1|N<4>,6|H<1>}	H(C[6]C[6]2)	119.8352	0.290	12	119.8352	0.084	12	119.7994	0.242	17	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[4]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[4]N[6])(C[6]C[6]H)(H)	C[6](C[4]C[4]2C)(N[6]C[6]Ni)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[4]N[6])(C[6]C[6]H)(H){1|Ni<4>,1|C<3>,1|H<1>,3|C<4>}	C[6](C[4]C[4]2C)(N[6]C[6]Ni)(C[6]C[6]H){1|C<3>,1|N<4>,6|H<1>}	H(C[6]C[6]2)	118.2270	0.000	1	118.2270	0.000	1	119.7994	0.242	17	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[4]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[4]N[6])(C[6]C[6]H)(H)	C[6](C[4]C[4]2H)(N[6]C[6]Os)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[4]N[6])(C[6]C[6]H)(H){1|Os<8>,1|C<4>,2|C<3>,2|H<1>}	C[6](C[4]C[4]2H)(N[6]C[6]Os)(C[6]C[6]H){1|C<3>,1|C<4>,4|H<1>}	H(C[6]C[6]2)	119.9750	0.000	1	119.9750	0.000	1	119.7994	0.242	17	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[4]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[4]N[6])(C[6]C[6]H)(H)	C[6](C[4]C[4]N[4]H)(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[4]N[6])(C[6]C[6]H)(H){1|Ir<4>,1|C<3>,1|C<4>,1|N<3>,2|H<1>}	C[6](C[4]C[4]N[4]H)(N[6]C[6]Ir)(C[6]C[6]H){1|O<2>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	119.8410	0.000	1	119.8410	0.000	1	119.7994	0.242	17	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[4]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[4]N[6])(C[6]C[6]H)(H)	C[6](C[4]C[4]N[4]H)(N[6]C[6]Os)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[4]N[6])(C[6]C[6]H)(H){1|Os<7>,1|C<3>,1|C<4>,1|N<3>,2|H<1>}	C[6](C[4]C[4]N[4]H)(N[6]C[6]Os)(C[6]C[6]H){1|O<2>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	120.2900	0.000	1	120.2900	0.000	1	119.7994	0.242	17	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[4]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[4]N[6])(C[6]C[6]H)(H)	C[6](C[4]C[4]N[4]H)(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[4]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|C<3>,1|C<4>,1|N<3>,2|H<1>}	C[6](C[4]C[4]N[4]H)(N[6]C[6]Ru)(C[6]C[6]H){1|O<2>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	120.2340	0.000	1	120.2340	0.000	1	119.7994	0.242	17	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5,6]C[5])(C[6]C[6,6a]H)(H)	C[6](C[5,6]C[5,6a]C[6,6a]N[5,5a])(C[5]N[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C[5])(C[6]C[6,6a]H)(H){1|N<3>,2|N<2>,3|C<3>}	C[6](C[5,6]C[5,6a]C[6,6a]N[5,5a])(C[5]N[5]2)(C[6]C[6]H){1|H<1>,8|C<3>}	H(C[6]C[6]2)	119.0130	0.000	1	119.0130	0.000	1	119.0130	0.000	1	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[5,6]O)(H)	C[6](C[5,6]C[5,5]O[5,6]H)(C[6]C[6]H)(CCH)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[5,6]O)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[5,6]C[5,5]O[5,6]H)(C[6]C[6]H)(CCH){1|O<1>,4|C<4>}	H(C[6]C[6]2)	120.2070	0.000	1	120.2070	0.000	1	118.9043	0.710	7	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]C)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,2|C<3>}	C[6](C[5,6]C[5,6]C[5]C)(C[6]C[6]H)(COO){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	118.9870	0.000	1	118.9870	0.000	1	118.9043	0.710	7	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(CHH)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H){1|H<1>,1|O<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(CHH){2|C<3>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	118.3795	0.103	2	118.3795	0.011	2	118.9043	0.710	7	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6a]C[5]C[6])(C[6]C[6]H)(CHH)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H){1|C<4>,4|C<3>}	C[6](C[5,6]C[5,6a]C[5]C[6])(C[6]C[6]H)(CHH){1|C<4>,1|N<3>,1|O<1>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	117.7250	0.000	1	117.7250	0.000	1	118.9043	0.710	7	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[6]O)(H)	C[6](C[5,6]C[5]C[6]O[5])(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[6]O)(H){1|H<1>,1|O<2>,2|C<3>}	C[6](C[5,6]C[5]C[6]O[5])(C[6]C[6]H)(COO){1|O<2>,2|O<1>,3|C<3>}	H(C[6]C[6]2)	119.3260	0.501	2	119.3260	0.251	2	118.9043	0.710	7	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5,6]C[6])(C[6]C[6,6a]H)(H)	C[6](C[5,6]C[5,6a]C[6,6a]N[5,5a])(C[6]C[6]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C[6])(C[6]C[6,6a]H)(H){1|N<3>,5|C<3>}	C[6](C[5,6]C[5,6a]C[6,6a]N[5,5a])(C[6]C[6]2)(C[6]C[6]H){3|H<1>,8|C<3>}	H(C[6]C[6]2)	117.9090	0.000	1	117.9090	0.000	1	119.2800	3.759	2	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5,6]C[6])(C[6]C[6]H)(H)	C[6](C[5,6]C[5,5,6]C[5,6]H)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C[6])(C[6]C[6]H)(H){1|N<2>,2|C<4>,2|H<1>}	C[6](C[5,6]C[5,5,6]C[5,6]H)(C[6]C[6]H)(C[6]N[6]H){1|C<2>,1|N<3>,2|C<4>,4|H<1>}	H(C[6]C[6]2)	120.6510	0.000	1	120.6510	0.000	1	119.2800	3.759	2	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[5,6]N)(C[6]C[6]N)(H)	C[6](C[5,6]C[6]O[5]2)(C[6]C[6]H)(NOO)	H(C[6]C[6]2)	C[6](C[6]C[5,6]N)(C[6]C[6]N)(H){1|C<3>,1|H<1>,2|O<2>}	C[6](C[5,6]C[6]O[5]2)(C[6]C[6]H)(NOO){1|C<3>,2|C<4>,2|N<3>}	H(C[6]C[6]2)	120.6420	1.349	2	120.6420	1.820	2	119.6143	4.078	3	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[5,6]N)(C[6]N[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Fe)(C[6]C[6]H)(NCC)	H(C[6]C[6]2)	C[6](C[6]C[5,6]N)(C[6]N[6]H)(H){1|Fe<10>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Fe)(C[6]C[6]H)(NCC){1|N<2>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	117.5590	0.000	1	117.5590	0.000	1	119.6143	4.078	3	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:N[5]-3:	C[6]-3:	C[6](C[6]C[5,6]N[5])(C[6]N[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Fe)(C[6]C[6]H)(N[5]C[5]2)	H(C[6]C[6]2)	C[6](C[6]C[5,6]N[5])(C[6]N[6]H)(H){1|Fe<10>,1|C<3>,4|C<4>}	C[6](C[5,6]C[5,6]C[5]Fe)(C[6]C[6]H)(N[5]C[5]2){1|N<3>,4|C<4>,6|H<1>}	H(C[6]C[6]2)	118.6750	0.000	1	118.6750	0.000	1	118.6750	0.000	1	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[5,6]N[6])(C[6]C[6]H)(H)	C[6](C[5,6]C[5,5,6]C[5,6]H)(C[6]C[6]H)(N[6]C[6]O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]N[6])(C[6]C[6]H)(H){1|C<3>,1|O<1>,2|C<4>,2|H<1>}	C[6](C[5,6]C[5,5,6]C[5,6]H)(C[6]C[6]H)(N[6]C[6]O){2|C<3>,3|C<4>,4|H<1>}	H(C[6]C[6]2)	119.2600	0.000	1	119.2600	0.000	1	119.2600	0.000	1	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5,6]C[6a])(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,5,6]C[5]O)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C[6a])(C[6]C[5,6]H)(H){1|O<2>,2|C<4>,3|C<3>}	C[6](C[5,6]C[5,5,6]C[5]O)(C[6a]C[6a]2)(C[6]C[6]H){2|C<4>,4|C<3>,5|H<1>}	H(C[6]C[6]2)	118.6065	0.367	2	118.6065	0.135	2	118.7081	1.287	19	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5,6]C[6a])(C[6]C[5,6]O)(H)	C[6](C[5,6]C[5,6]C[5]H)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C[6a])(C[6]C[5,6]O)(H){2|C<4>,2|H<1>,3|C<3>}	C[6](C[5,6]C[5,6]C[5]H)(C[6a]C[6a]2)(C[6]C[6]H){2|C<3>,2|C<4>,2|O<1>,4|H<1>}	H(C[6]C[6]2)	120.0470	0.000	1	120.0470	0.000	1	118.7081	1.287	19	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5,6]C[6a])(C[6]C[5a,6]O)(H)	C[6](C[5,6]C[5a,6]C[5]2)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C[6a])(C[6]C[5a,6]O)(H){6|C<3>}	C[6](C[5,6]C[5a,6]C[5]2)(C[6a]C[6a]2)(C[6]C[6]H){1|C<4>,1|N<2>,2|H<1>,2|N<3>,2|O<1>,3|C<3>}	H(C[6]C[6]2)	117.4800	0.000	1	117.4800	0.000	1	118.7081	1.287	19	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5,6]C[6a])(C[6]C[6,6a]O)(H)	C[6](C[5,6]C[6,6a]C[5]2)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C[6a])(C[6]C[6,6a]O)(H){6|C<3>}	C[6](C[5,6]C[6,6a]C[5]2)(C[6a]C[6a]2)(C[6]C[6]H){1|C<4>,1|N<2>,1|N<3>,2|H<1>,2|O<1>,4|C<3>}	H(C[6]C[6]2)	117.8790	0.194	2	117.8790	0.038	2	118.7081	1.287	19	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5,6]C[6a])(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]C)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C[6a])(C[6]C[6]H)(H){2|C<4>,4|C<3>}	C[6](C[5,6]C[5,6]C[5]C)(C[6a]C[6a]2)(C[6]C[6]H){1|O<2>,5|C<3>,5|H<1>}	H(C[6]C[6]2)	118.3600	0.000	1	118.3600	0.000	1	118.7081	1.287	19	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5,6]C[6a])(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Ti)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C[6a])(C[6]C[6]H)(H){1|Ti<13>,1|O<2>,2|C<3>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Ti)(C[6a]C[6a]2)(C[6]C[6]H){2|C<4>,3|C<3>,4|H<1>}	H(C[6]C[6]2)	118.5420	0.159	5	118.5420	0.025	5	118.7081	1.287	19	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5,6]C[6a])(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Zr)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C[6a])(C[6]C[6]H)(H){1|Zr<12>,1|H<1>,2|C<3>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Zr)(C[6a]C[6a]2)(C[6]C[6]H){2|C<4>,3|C<3>,4|H<1>}	H(C[6]C[6]2)	118.6020	0.000	1	118.8200	0.100	3	118.7081	1.287	19	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5,6]C[6a])(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Zr)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C[6a])(C[6]C[6]H)(H){1|Zr<13>,1|H<1>,2|C<3>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Zr)(C[6a]C[6a]2)(C[6]C[6]H){2|C<4>,3|C<3>,4|H<1>}	H(C[6]C[6]2)	118.9290	0.358	2	118.8200	0.100	3	118.7081	1.287	19	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5,6]C[6a])(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6a]C[5,6]O)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C[6a])(C[6]C[6]H)(H){1|C<4>,1|O<2>,4|C<3>}	C[6](C[5,6]C[5,6a]C[5,6]O)(C[6a]C[6a]2)(C[6]C[6]H){1|C<4>,3|H<1>,6|C<3>}	H(C[6]C[6]2)	118.7920	0.000	1	118.7920	0.000	1	118.7081	1.287	19	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5,6]C[6a])(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6a]C[5]C[6])(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,4|C<3>}	C[6](C[5,6]C[5,6a]C[5]C[6])(C[6a]C[6a]2)(C[6]C[6]H){1|C<4>,5|H<1>,6|C<3>}	H(C[6]C[6]2)	122.7680	0.000	1	122.7680	0.000	1	118.7081	1.287	19	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5,6]C[6a])(C[6]C[6]O)(H)	C[6](C[5,6]C[5]2C[6])(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C[6a])(C[6]C[6]O)(H){1|C<4>,2|H<1>,4|C<3>}	C[6](C[5,6]C[5]2C[6])(C[6a]C[6a]2)(C[6]C[6]H){1|C<4>,3|H<1>,3|O<1>,5|C<3>}	H(C[6]C[6]2)	117.8900	0.000	1	117.9325	0.004	2	118.7081	1.287	19	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5,6]C[6a])(C[6]C[6]O)(H)	C[6](C[5,6]C[5]2C[6])(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C[6a])(C[6]C[6]O)(H){1|H<1>,2|C<4>,4|C<3>}	C[6](C[5,6]C[5]2C[6])(C[6a]C[6a]2)(C[6]C[6]H){1|C<4>,3|H<1>,3|O<1>,5|C<3>}	H(C[6]C[6]2)	117.9750	0.000	1	117.9325	0.004	2	118.7081	1.287	19	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:N[5a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5,6]N[5a])(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Zr)(N[5a]C[5a,6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]N[5a])(C[6]C[6]H)(H){1|Zr<13>,1|H<1>,2|C<3>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Zr)(N[5a]C[5a,6a]2)(C[6]C[6]H){2|C<4>,2|H<1>,5|C<3>}	H(C[6]C[6]2)	119.7000	0.107	2	119.7000	0.012	2	119.7000	0.012	2	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6,6a]O)(H)	C[6](C[5]C[5,6a]C[5]C)(C[6]C[6,6a]O)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6,6a]O)(H){1|C<4>,1|O<1>,4|C<3>}	C[6](C[5]C[5,6a]C[5]C)(C[6]C[6,6a]O)(C[6]C[6]H){1|O<2>,2|O<1>,4|C<3>}	H(C[6]C[6]2)	118.6223	0.292	3	118.6223	0.085	3	119.4783	0.755	43	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6]C)(H)	C[6](C[5]C[6a]Si[5]C[5])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6]C)(H){1|Si<4>,1|C<4>,1|H<1>,1|O<1>,2|C<3>}	C[6](C[5]C[6a]Si[5]C[5])(C[6]C[6]H)2{1|N<3>,1|O<1>,2|H<1>,3|C<3>,4|C<4>}	H(C[6]C[6]2)	118.6360	0.253	2	118.6360	0.064	2	119.4783	0.755	43	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H)	C[6](C[5]C[5,6]C[5]Rh)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H){1|Rh<8>,2|H<1>,3|C<4>}	C[6](C[5]C[5,6]C[5]Rh)(C[6]C[6]H)2{1|C<3>,3|C<4>,4|H<1>}	H(C[6]C[6]2)	119.8930	0.000	1	119.8930	0.000	1	119.4783	0.755	43	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H)	C[6](C[5]C[5,6a]N[5a]C[5])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H){1|C<2>,1|F<1>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5]C[5,6a]N[5a]C[5])(C[6]C[6]H)2{1|H<1>,1|N<2>,1|N<3>,1|O<1>,4|C<3>}	H(C[6]C[6]2)	116.5920	0.000	1	116.5920	0.000	1	119.4783	0.755	43	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]2Fe)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H){1|Fe<10>,1|C<3>,1|H<1>,1|N<3>,2|C<4>}	C[6](C[5]C[5]2Fe)(C[6]C[6]H)(C[6]N[6]H){1|Cu<4>,1|C<3>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	119.9423	0.039	3	119.9583	0.009	6	119.4783	0.755	43	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]2Fe)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H){1|Fe<10>,1|C<3>,1|H<1>,1|N<3>,2|C<4>}	C[6](C[5]C[5]2Fe)(C[6]C[6]H)(C[6]N[6]H){1|Pd<4>,1|C<3>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	119.9743	0.146	3	119.9583	0.009	6	119.4783	0.755	43	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]2Fe)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H){1|Fe<10>,1|H<1>,2|C<2>,2|C<4>}	C[6](C[5]C[5]2Fe)(C[6]C[6]H)2{1|C<3>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	119.0950	0.000	1	119.0950	0.000	1	119.4783	0.755	43	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]2H)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H){1|N<3>,1|O<2>,2|C<4>,2|H<1>}	C[6](C[5]C[5]2H)(C[6]C[6]H)(C[6]N[6]H){1|C<3>,2|C<4>,6|H<1>}	H(C[6]C[6]2)	117.0660	0.000	1	117.0660	0.000	1	119.4783	0.755	43	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]N[5]H)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H){1|C<4>,1|N<3>,1|N<4>,3|H<1>}	C[6](C[5]C[5]N[5]H)(C[6]C[6]H)(C[6]N[6]H){1|C<3>,3|C<4>,5|H<1>}	H(C[6]C[6]2)	119.5710	0.684	2	119.9440	0.335	5	119.4783	0.755	43	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]N[5]H)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H){1|C<4>,2|N<3>,3|H<1>}	C[6](C[5]C[5]N[5]H)(C[6]C[6]H)(C[6]N[6]H){1|C<3>,1|W<6>,3|C<4>,3|H<1>}	H(C[6]C[6]2)	120.6500	0.000	1	119.9440	0.335	5	119.4783	0.755	43	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]N[5]H)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H){1|C<4>,2|N<3>,3|H<1>}	C[6](C[5]C[5]N[5]H)(C[6]C[6]H)(C[6]N[6]H){1|Cu<5>,1|C<3>,3|C<4>,3|H<1>}	H(C[6]C[6]2)	119.9640	0.304	2	119.9440	0.335	5	119.4783	0.755	43	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6]N[6])(H)	C[6](C[5]C[5]2Fe)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6]N[6])(H){1|Fe<10>,1|Cu<5>,1|H<1>,1|N<3>,2|C<3>,2|C<4>}	C[6](C[5]C[5]2Fe)(C[6]C[6]H)2{1|N<3>,2|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.9825	0.194	2	120.0783	0.054	10	119.4783	0.755	43	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6]N[6])(H)	C[6](C[5]C[5]2Fe)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6]N[6])(H){1|Fe<10>,1|Cu<6>,1|H<1>,1|N<3>,2|C<3>,2|C<4>}	C[6](C[5]C[5]2Fe)(C[6]C[6]H)2{1|N<3>,2|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	120.0250	0.091	2	120.0783	0.054	10	119.4783	0.755	43	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6]N[6])(H)	C[6](C[5]C[5]2Fe)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6]N[6])(H){1|Fe<10>,1|Ir<6>,1|H<1>,1|N<3>,2|C<3>,2|C<4>}	C[6](C[5]C[5]2Fe)(C[6]C[6]H)2{1|N<3>,2|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	120.2685	0.327	2	120.0783	0.054	10	119.4783	0.755	43	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6]N[6])(H)	C[6](C[5]C[5]2Fe)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6]N[6])(H){1|Fe<10>,1|Pt<4>,1|H<1>,1|N<3>,2|C<3>,2|C<4>}	C[6](C[5]C[5]2Fe)(C[6]C[6]H)2{1|N<3>,2|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.8215	0.069	2	120.0783	0.054	10	119.4783	0.755	43	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6]N[6])(H)	C[6](C[5]C[5]2Fe)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6]N[6])(H){1|Fe<10>,1|Zn<5>,1|H<1>,1|N<3>,2|C<3>,2|C<4>}	C[6](C[5]C[5]2Fe)(C[6]C[6]H)2{1|N<3>,2|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	120.2940	0.079	2	120.0783	0.054	10	119.4783	0.755	43	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]N[6]C)(H)	C[6](C[5]C[5]2Fe)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]N[6]C)(H){1|Fe<10>,1|Mo<6>,1|C<3>,1|H<1>,2|C<4>}	C[6](C[5]C[5]2Fe)(C[6]C[6]H)2{1|N<3>,2|H<1>,4|C<4>}	H(C[6]C[6]2)	119.1568	0.669	4	119.1568	0.447	4	119.4783	0.755	43	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]N[6]C)(H)	C[6](C[5]C[5]2Ru)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]N[6]C)(H){1|Ru<10>,1|Mo<6>,1|C<3>,1|H<1>,2|C<4>}	C[6](C[5]C[5]2Ru)(C[6]C[6]H)2{1|N<3>,2|H<1>,4|C<4>}	H(C[6]C[6]2)	118.8975	0.725	4	118.8975	0.526	4	119.4783	0.755	43	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H)	C[6](C[5]C[5]2Fe)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H){1|Fe<10>,1|C<3>,2|C<4>,2|H<1>}	C[6](C[5]C[5]2Fe)(C[6]C[6]H)2{1|N<3>,2|C<4>,4|H<1>}	H(C[6]C[6]2)	119.8620	0.091	5	119.8620	0.008	5	119.4783	0.755	43	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-4:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]2Fe)(C[6]C[6]H)(N[6]C[6]W)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<10>,1|C<3>,1|H<1>,1|W<6>,2|C<4>}	C[6](C[5]C[5]2Fe)(C[6]C[6]H)(N[6]C[6]W){2|C<3>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	119.9200	0.000	1	119.9200	0.000	1	119.9170	0.000	2	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-4:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]2H)(C[6]C[6]H)(N[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|C<3>,2|C<4>,3|H<1>}	C[6](C[5]C[5]2H)(C[6]C[6]H)(N[6]C[6]H){1|C<3>,4|C<4>,4|H<1>}	H(C[6]C[6]2)	119.9140	0.000	1	119.9140	0.000	1	119.9170	0.000	2	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H)	C[6](C[5]N[5]O[5]H)(N[6]C[6,6a]Co)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H){1|Co<6>,1|H<1>,1|N<4>,1|O<2>,2|C<3>}	C[6](C[5]N[5]O[5]H)(N[6]C[6,6a]Co)(C[6]C[6]H){2|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	120.6810	0.000	1	120.6810	0.000	1	120.3219	0.325	118	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H)	C[6](C[5]N[5]O[5]H)(N[6]C[6,6a]Ni)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H){1|Ni<6>,1|H<1>,1|N<4>,1|O<2>,2|C<3>}	C[6](C[5]N[5]O[5]H)(N[6]C[6,6a]Ni)(C[6]C[6]H){2|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	120.4900	0.000	1	120.4900	0.000	1	120.3219	0.325	118	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H)	C[6](C[5]N[5]O[5]H)(N[6]C[6,6a]Zn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6,6a]H)(H){1|Zn<5>,1|H<1>,1|N<4>,1|O<2>,2|C<3>}	C[6](C[5]N[5]O[5]H)(N[6]C[6,6a]Zn)(C[6]C[6]H){2|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	120.4990	0.000	1	120.4990	0.000	1	120.3219	0.325	118	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]C)(H)	C[6](C[5]C[5]2H)(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]C)(H){1|Pt<4>,1|C<3>,2|C<4>,2|H<1>}	C[6](C[5]C[5]2H)(N[6]C[6]Pt)(C[6]C[6]H){2|C<3>,3|C<4>,4|H<1>}	H(C[6]C[6]2)	118.9400	0.000	1	118.9400	0.000	1	120.3219	0.325	118	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5,6]2Ru)(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|Ru<7>,1|C<3>,1|C<4>,1|C<5>,1|H<1>}	C[6](C[5]C[5,6]2Ru)(N[6]C[6]Ru)(C[6]C[6]H){2|C<3>,2|H<1>,3|C<4>}	H(C[6]C[6]2)	120.1965	0.305	2	120.1965	0.093	2	120.3219	0.325	118	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5,6]C[5]Ru)(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ru<5>,1|Ru<7>,1|C<3>,1|H<1>,2|C<4>}	C[6](C[5]C[5,6]C[5]Ru)(N[6]C[6]Ru)(C[6]C[6]H){1|Br<1>,1|H<1>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	119.9130	0.000	1	119.9748	0.053	19	120.3219	0.325	118	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5,6]C[5]Ru)(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ru<5>,1|Ru<7>,1|C<3>,1|H<1>,2|C<4>}	C[6](C[5]C[5,6]C[5]Ru)(N[6]C[6]Ru)(C[6]C[6]H){2|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.9475	0.091	2	119.9748	0.053	19	120.3219	0.325	118	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5,6]C[5]Ru)(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ru<5>,1|Ru<7>,1|C<3>,1|H<1>,2|C<4>}	C[6](C[5]C[5,6]C[5]Ru)(N[6]C[6]Ru)(C[6]C[6]H){2|C<3>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	119.4720	0.000	1	119.9748	0.053	19	120.3219	0.325	118	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5,6]C[5]Ru)(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|Ru<7>,1|C<3>,1|C<4>,1|C<5>,1|H<1>}	C[6](C[5]C[5,6]C[5]Ru)(N[6]C[6]Ru)(C[6]C[6]H){1|Br<1>,1|H<1>,2|C<3>,3|C<4>}	H(C[6]C[6]2)	119.6180	0.000	1	119.9748	0.053	19	120.3219	0.325	118	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5,6]C[5]Ru)(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|Ru<7>,1|C<3>,1|C<4>,1|C<5>,1|H<1>}	C[6](C[5]C[5,6]C[5]Ru)(N[6]C[6]Ru)(C[6]C[6]H){2|C<3>,2|H<1>,3|C<4>}	H(C[6]C[6]2)	120.0831	0.174	8	119.9748	0.053	19	120.3219	0.325	118	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5,6]C[5]Ru)(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|Ru<7>,1|C<3>,1|H<1>,2|C<4>}	C[6](C[5]C[5,6]C[5]Ru)(N[6]C[6]Ru)(C[6]C[6]H){2|C<3>,2|H<1>,3|C<4>}	H(C[6]C[6]2)	119.7710	0.000	1	119.9748	0.053	19	120.3219	0.325	118	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5,6]C[5]Ru)(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|Ru<8>,1|C<3>,1|H<1>,2|C<4>}	C[6](C[5]C[5,6]C[5]Ru)(N[6]C[6]Ru)(C[6]C[6]H){1|Br<1>,1|H<1>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	120.2180	0.000	1	119.9748	0.053	19	120.3219	0.325	118	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5,6]C[5]Ru)(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){2|Ru<7>,1|C<3>,1|C<4>,1|C<5>,1|H<1>}	C[6](C[5]C[5,6]C[5]Ru)(N[6]C[6]Ru)(C[6]C[6]H){2|C<3>,2|H<1>,3|C<4>}	H(C[6]C[6]2)	119.9925	0.228	4	119.9748	0.053	19	120.3219	0.325	118	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5,6]P[5]H)(N[6]C[6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|P<4>,2|C<3>,2|H<1>}	C[6](C[5]C[5,6]P[5]H)(N[6]C[6]Pd)(C[6]C[6]H){1|C<4>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.8600	0.000	1	119.9585	0.019	2	120.3219	0.325	118	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5,6]P[5]H)(N[6]C[6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|P<4>,2|C<3>,2|H<1>}	C[6](C[5]C[5,6]P[5]H)(N[6]C[6]Pd)(C[6]C[6]H){2|H<1>,5|C<3>}	H(C[6]C[6]2)	120.0570	0.000	1	119.9585	0.019	2	120.3219	0.325	118	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5,6a]2C[6])(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,4|C<3>}	C[6](C[5]C[5,6a]2C[6])(N[6]C[6]Pt)(C[6]C[6]H){1|H<1>,1|N<3>,7|C<3>}	H(C[6]C[6]2)	119.5330	0.000	1	119.5330	0.000	1	120.3219	0.325	118	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5,6a]2C[6a])(N[6]C[6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|H<1>,4|C<3>}	C[6](C[5]C[5,6a]2C[6a])(N[6]C[6]Pd)(C[6]C[6]H){2|H<1>,7|C<3>}	H(C[6]C[6]2)	119.6370	0.000	1	119.6370	0.000	1	120.3219	0.325	118	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5,6a]C[5]C)(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|C<4>,1|H<1>,3|C<3>}	C[6](C[5]C[5,6a]C[5]C)(N[6]C[6]Pt)(C[6]C[6]H){1|C<4>,1|H<1>,4|C<3>}	H(C[6]C[6]2)	120.6620	0.000	1	120.6620	0.000	1	120.3219	0.325	118	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5,6a]C[5]O)(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ir<8>,1|H<1>,1|O<2>,3|C<3>}	C[6](C[5]C[5,6a]C[5]O)(N[6]C[6]Ir)(C[6]C[6]H){2|H<1>,5|C<3>}	H(C[6]C[6]2)	120.0880	0.000	1	120.0880	0.000	1	120.3219	0.325	118	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]2C[6])(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|H<1>,2|C<3>,2|C<4>}	C[6](C[5]C[5]2C[6])(N[6]C[6]Ru)(C[6]C[6]H){1|N<3>,2|C<3>,2|C<4>,6|H<1>}	H(C[6]C[6]2)	119.4600	0.000	1	119.6785	0.095	2	120.3219	0.325	118	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]2C[6])(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ru<6>,1|H<1>,2|C<3>,2|C<4>}	C[6](C[5]C[5]2C[6])(N[6]C[6]Ru)(C[6]C[6]H){1|N<3>,2|C<3>,3|C<4>,5|H<1>}	H(C[6]C[6]2)	119.8970	0.000	1	119.6785	0.095	2	120.3219	0.325	118	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]2Fe)(N[6]C[6]Cd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<10>,1|Cd<4>,1|C<3>,1|H<1>,2|C<4>}	C[6](C[5]C[5]2Fe)(N[6]C[6]Cd)(C[6]C[6]H){1|C<3>,2|C<4>,4|H<1>}	H(C[6]C[6]2)	119.8240	0.444	2	119.8240	0.197	2	120.3219	0.325	118	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]2Fe)(N[6]C[6]Cr)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<10>,1|Cr<6>,1|C<3>,1|H<1>,2|C<4>}	C[6](C[5]C[5]2Fe)(N[6]C[6]Cr)(C[6]C[6]H){2|C<3>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	119.7600	0.000	1	119.7600	0.000	1	120.3219	0.325	118	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]2Fe)(N[6]C[6]Mo)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<10>,1|Mo<6>,1|C<3>,1|H<1>,2|C<4>}	C[6](C[5]C[5]2Fe)(N[6]C[6]Mo)(C[6]C[6]H){2|C<3>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	120.1200	0.000	1	120.1200	0.000	1	120.3219	0.325	118	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]2Fe)(N[6]C[6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<10>,1|Pd<4>,1|C<3>,1|H<1>,2|C<4>}	C[6](C[5]C[5]2Fe)(N[6]C[6]Pd)(C[6]C[6]H){1|C<3>,2|C<4>,4|H<1>}	H(C[6]C[6]2)	119.8205	0.223	2	119.8205	0.050	2	120.3219	0.325	118	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]2Fe)(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<10>,1|Pt<4>,1|C<3>,1|H<1>,2|C<4>}	C[6](C[5]C[5]2Fe)(N[6]C[6]Pt)(C[6]C[6]H){1|C<3>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	120.2190	0.000	1	120.0925	0.032	2	120.3219	0.325	118	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]2Fe)(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<10>,1|Pt<4>,1|C<3>,1|H<1>,2|C<4>}	C[6](C[5]C[5]2Fe)(N[6]C[6]Pt)(C[6]C[6]H){1|C<3>,2|H<1>,3|C<4>}	H(C[6]C[6]2)	119.9660	0.000	1	120.0925	0.032	2	120.3219	0.325	118	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]2Fe)(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<10>,1|Ru<6>,1|C<3>,1|H<1>,2|C<4>}	C[6](C[5]C[5]2Fe)(N[6]C[6]Ru)(C[6]C[6]H){1|C<3>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	120.2947	0.106	3	120.2947	0.011	3	120.3219	0.325	118	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]2Fe)(N[6]C[6]Zn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<10>,1|Zn<4>,1|C<3>,1|H<1>,2|C<4>}	C[6](C[5]C[5]2Fe)(N[6]C[6]Zn)(C[6]C[6]H){1|C<3>,2|C<4>,4|H<1>}	H(C[6]C[6]2)	119.9663	0.240	4	119.9663	0.057	4	120.3219	0.325	118	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]2O)(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ru<4>,1|C<3>,1|H<1>,1|O<3>,2|C<4>}	C[6](C[5]C[5]2O)(N[6]C[6]Ru)(C[6]C[6]H){1|Br<1>,1|C<3>,2|C<4>,5|H<1>}	H(C[6]C[6]2)	119.8480	0.000	1	119.7155	0.035	2	120.3219	0.325	118	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]2O)(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ru<5>,1|C<3>,1|H<1>,1|O<3>,2|C<4>}	C[6](C[5]C[5]2O)(N[6]C[6]Ru)(C[6]C[6]H){1|C<3>,2|C<4>,6|H<1>}	H(C[6]C[6]2)	119.5830	0.000	1	119.7155	0.035	2	120.3219	0.325	118	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]2Re)(N[6]C[6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|Re<8>,1|C<3>,1|H<1>,2|C<4>}	C[6](C[5]C[5]2Re)(N[6]C[6]Pd)(C[6]C[6]H){1|C<3>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	120.6430	0.129	2	120.6430	0.017	2	120.3219	0.325	118	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]2Re)(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|Re<8>,1|C<3>,1|H<1>,2|C<4>}	C[6](C[5]C[5]2Re)(N[6]C[6]Pt)(C[6]C[6]H){1|C<3>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	120.3560	0.000	1	120.3560	0.000	1	120.3219	0.325	118	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]2Ru)(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ru<10>,1|Pt<4>,1|C<3>,1|H<1>,2|C<4>}	C[6](C[5]C[5]2Ru)(N[6]C[6]Pt)(C[6]C[6]H){1|C<3>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	119.3270	0.000	1	119.3270	0.000	1	120.3219	0.325	118	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]2Ru)(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ru<5>,1|Ru<7>,1|C<3>,1|H<1>,2|C<4>}	C[6](C[5]C[5]2Ru)(N[6]C[6]Ru)(C[6]C[6]H){1|C<3>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	120.2050	0.000	1	120.2050	0.000	1	120.3219	0.325	118	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]N[5]C)(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Pt<4>,1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[5]C[5]N[5]C)(N[6]C[6]Pt)(C[6]C[6]H){1|N<3>,1|O<1>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.8160	0.191	2	120.8160	0.036	2	120.3219	0.325	118	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]N[5]H)(N[6]C[6]Cd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cd<6>,1|C<3>,1|C<4>,1|N<3>,2|H<1>}	C[6](C[5]C[5]N[5]H)(N[6]C[6]Cd)(C[6]C[6]H){1|C<4>,1|N<4>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	119.9280	0.000	1	119.9080	0.001	2	120.3219	0.325	118	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]N[5]H)(N[6]C[6]Cd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cd<6>,1|C<3>,1|C<4>,1|N<4>,2|H<1>}	C[6](C[5]C[5]N[5]H)(N[6]C[6]Cd)(C[6]C[6]H){1|N<3>,2|C<3>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	119.8880	0.000	1	119.9080	0.001	2	120.3219	0.325	118	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]N[5]H)(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|C<3>,1|C<4>,1|N<3>,2|H<1>}	C[6](C[5]C[5]N[5]H)(N[6]C[6]Fe)(C[6]C[6]H){1|C<4>,1|N<4>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.5320	0.000	1	119.5320	0.000	1	120.3219	0.325	118	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]N[5]H)(N[6]C[6]Ni)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|C<3>,1|C<4>,1|N<4>,2|H<1>}	C[6](C[5]C[5]N[5]H)(N[6]C[6]Ni)(C[6]C[6]H){1|N<2>,1|N<3>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.4350	0.000	1	120.4350	0.000	1	120.3219	0.325	118	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]N[5]O)(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Pt<6>,1|H<1>,1|N<3>,1|O<2>,2|C<3>}	C[6](C[5]C[5]N[5]O)(N[6]C[6]Pt)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.3315	0.190	2	120.3315	0.036	2	120.3219	0.325	118	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[6]N[5]O[5])(N[6]C[6]Co)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Co<6>,1|H<1>,1|N<3>,1|O<2>,2|C<3>}	C[6](C[5]C[6]N[5]O[5])(N[6]C[6]Co)(C[6]C[6]H){1|N<3>,1|O<2>,2|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	120.8145	0.221	16	120.8145	0.049	16	120.3219	0.325	118	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[6]N[5]O[5])(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|H<1>,1|N<3>,1|O<2>,2|C<3>}	C[6](C[5]C[6]N[5]O[5])(N[6]C[6]Fe)(C[6]C[6]H){1|N<3>,1|O<2>,2|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	120.6595	0.187	6	120.6595	0.035	6	120.3219	0.325	118	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]C[6]N[5]O[5])(N[6]C[6]Ni)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|H<1>,1|N<3>,1|O<2>,2|C<3>}	C[6](C[5]C[6]N[5]O[5])(N[6]C[6]Ni)(C[6]C[6]H){1|N<3>,1|O<2>,2|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	121.0913	0.434	4	121.0913	0.188	4	120.3219	0.325	118	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]N[5,5]O[5]H)(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|C<3>,1|N<4>,1|O<2>,2|H<1>}	C[6](C[5]N[5,5]O[5]H)(N[6]C[6]Fe)(C[6]C[6]H){1|C<3>,2|H<1>,3|C<4>}	H(C[6]C[6]2)	120.4982	0.306	4	120.4982	0.093	4	120.3219	0.325	118	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]N[5,6]O[5]H)(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<6>,1|C<3>,1|N<4>,1|O<2>,2|H<1>}	C[6](C[5]N[5,6]O[5]H)(N[6]C[6]Cu)(C[6]C[6]H){1|C<3>,1|H<1>,4|C<4>}	H(C[6]C[6]2)	120.8370	0.000	1	120.8370	0.000	1	120.3219	0.325	118	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]N[5]2H)(N[6]C[6]Cd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cd<5>,1|C<3>,1|N<3>,1|N<4>,2|H<1>}	C[6](C[5]N[5]2H)(N[6]C[6]Cd)(C[6]C[6]H){2|C<3>,2|H<1>,3|C<4>}	H(C[6]C[6]2)	120.3270	0.000	1	119.0910	3.055	2	120.3219	0.325	118	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]N[5]2H)(N[6]C[6]Cd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cd<6>,1|C<3>,1|N<3>,1|N<4>,2|H<1>}	C[6](C[5]N[5]2H)(N[6]C[6]Cd)(C[6]C[6]H){1|C<3>,3|C<4>,3|H<1>}	H(C[6]C[6]2)	117.8550	0.000	1	119.0910	3.055	2	120.3219	0.325	118	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]N[5]2H)(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<5>,1|C<3>,1|N<3>,1|N<4>,2|H<1>}	C[6](C[5]N[5]2H)(N[6]C[6]Cu)(C[6]C[6]H){1|C<3>,3|C<4>,3|H<1>}	H(C[6]C[6]2)	120.2100	0.165	2	120.2100	0.027	2	120.3219	0.325	118	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]N[5]2H)(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|C<3>,1|N<3>,1|N<4>,2|H<1>}	C[6](C[5]N[5]2H)(N[6]C[6]Fe)(C[6]C[6]H){2|C<3>,2|H<1>,3|C<4>}	H(C[6]C[6]2)	120.6150	0.000	1	120.8625	0.123	2	120.3219	0.325	118	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]N[5]2H)(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|C<3>,2|H<1>,2|N<4>}	C[6](C[5]N[5]2H)(N[6]C[6]Fe)(C[6]C[6]H){1|C<3>,1|S<4>,3|C<4>,3|H<1>}	H(C[6]C[6]2)	121.1100	0.000	1	120.8625	0.123	2	120.3219	0.325	118	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]N[5]2H)(N[6]C[6]Mn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Mn<6>,1|C<3>,1|N<3>,1|N<4>,2|H<1>}	C[6](C[5]N[5]2H)(N[6]C[6]Mn)(C[6]C[6]H){1|C<3>,3|C<4>,3|H<1>}	H(C[6]C[6]2)	120.2525	0.077	2	120.2525	0.006	2	120.3219	0.325	118	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]N[5]2H)(N[6]C[6]Zn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Zn<5>,1|C<3>,1|N<3>,1|N<4>,2|H<1>}	C[6](C[5]N[5]2H)(N[6]C[6]Zn)(C[6]C[6]H){2|C<3>,2|H<1>,3|C<4>}	H(C[6]C[6]2)	120.4820	0.000	1	120.4820	0.000	1	120.3219	0.325	118	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]N[5]O[5]H)(N[6]C[6]Cd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cd<6>,1|C<3>,1|N<4>,1|O<2>,2|H<1>}	C[6](C[5]N[5]O[5]H)(N[6]C[6]Cd)(C[6]C[6]H){1|C<3>,2|H<1>,3|C<4>}	H(C[6]C[6]2)	120.2990	0.000	1	120.2990	0.000	1	120.3219	0.325	118	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]N[5]O[5]H)(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Cu<6>,1|C<3>,1|N<4>,1|O<2>,2|H<1>}	C[6](C[5]N[5]O[5]H)(N[6]C[6]Cu)(C[6]C[6]H){1|C<3>,2|H<1>,3|C<4>}	H(C[6]C[6]2)	120.5410	0.000	1	120.5410	0.000	1	120.3219	0.325	118	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]N[5]O[5]H)(N[6]C[6]Ni)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|C<3>,1|N<4>,1|O<2>,2|H<1>}	C[6](C[5]N[5]O[5]H)(N[6]C[6]Ni)(C[6]C[6]H){1|C<3>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	120.8460	0.000	1	120.8460	0.000	1	120.3219	0.325	118	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]N[5]O[5]H)(N[6]C[6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|C<3>,1|N<4>,1|O<2>,2|H<1>}	C[6](C[5]N[5]O[5]H)(N[6]C[6]Pd)(C[6]C[6]H){1|C<3>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	121.0560	0.000	1	120.7665	0.072	4	120.3219	0.325	118	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]N[5]O[5]H)(N[6]C[6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|C<3>,1|N<4>,1|O<2>,2|H<1>}	C[6](C[5]N[5]O[5]H)(N[6]C[6]Pd)(C[6]C[6]H){1|C<3>,2|H<1>,3|C<4>}	H(C[6]C[6]2)	120.7690	0.212	2	120.7665	0.072	4	120.3219	0.325	118	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]N[5]O[5]H)(N[6]C[6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|C<3>,1|N<4>,1|O<2>,2|H<1>}	C[6](C[5]N[5]O[5]H)(N[6]C[6]Pd)(C[6]C[6]H){2|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	120.4720	0.000	1	120.7665	0.072	4	120.3219	0.325	118	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]N[5]O[5]H)(N[6]C[6]Zn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Zn<5>,1|C<3>,1|N<4>,1|O<2>,2|H<1>}	C[6](C[5]N[5]O[5]H)(N[6]C[6]Zn)(C[6]C[6]H){1|C<3>,2|H<1>,3|C<4>}	H(C[6]C[6]2)	120.2215	0.457	2	120.2215	0.209	2	120.3219	0.325	118	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]N[5]S[5]H)(N[6]C[6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Pd<4>,1|C<3>,1|N<3>,1|S<3>,2|H<1>}	C[6](C[5]N[5]S[5]H)(N[6]C[6]Pd)(C[6]C[6]H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.0770	0.000	1	120.0770	0.000	1	120.3219	0.325	118	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]O[5]2H)(N[6]C[6]Re)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Re<6>,1|C<3>,1|O<2>,1|O<3>,2|H<1>}	C[6](C[5]O[5]2H)(N[6]C[6]Re)(C[6]C[6]H){1|C<3>,1|H<1>,3|C<4>}	H(C[6]C[6]2)	121.1110	0.000	1	121.4155	0.185	2	120.3219	0.325	118	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H)	C[6](C[5]O[5]2H)(N[6]C[6]Re)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]H)(H){1|Re<6>,1|C<3>,2|H<1>,2|O<2>}	C[6](C[5]O[5]2H)(N[6]C[6]Re)(C[6]C[6]H){1|C<3>,1|H<1>,3|C<4>}	H(C[6]C[6]2)	121.7200	0.000	1	121.4155	0.185	2	120.3219	0.325	118	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]N[6]2)(H)	C[6](C[5]C[5]2Fe)(N[6]C[6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]N[6]2)(H){1|Fe<10>,1|Pd<4>,1|C<3>,4|C<4>}	C[6](C[5]C[5]2Fe)(N[6]C[6]Pd)(C[6]C[6]H){1|N<2>,1|N<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	120.8660	0.000	1	120.8660	0.000	1	120.3219	0.325	118	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]N[6]Cl)(H)	C[6](C[5]C[5]2Fe)(N[6]C[6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]N[6]Cl)(H){1|Fe<10>,1|Pd<4>,1|C<3>,2|C<4>}	C[6](C[5]C[5]2Fe)(N[6]C[6]Pd)(C[6]C[6]H){1|Cl<1>,1|N<2>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	121.8540	0.000	1	121.8540	0.000	1	120.3219	0.325	118	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]N[6]O)(H)	C[6](C[5]C[5]2Fe)(N[6]C[6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]N[6]O)(H){1|Fe<10>,2|Pd<4>,1|C<3>,2|C<4>}	C[6](C[5]C[5]2Fe)(N[6]C[6]Pd)(C[6]C[6]H){1|N<3>,1|O<1>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.1560	0.000	1	119.1560	0.000	1	120.3219	0.325	118	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[5,6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5,6]C[6,6])(C[6]C[6]H)(H)	C[6](C[6,6]C[6,6a]C[6]P[6])(C[5,6]C[5,5,6]C[5,6])(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C[6,6])(C[6]C[6]H)(H){1|H<1>,1|P<4>,2|C<3>,2|C<4>}	C[6](C[6,6]C[6,6a]C[6]P[6])(C[5,6]C[5,5,6]C[5,6])(C[6]C[6]H){1|N<3>,1|O<1>,1|O<2>,2|H<1>,3|C<3>,6|C<4>}	H(C[6]C[6]2)	117.0360	0.000	1	117.0360	0.000	1	117.0360	0.000	1	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:B-3:	C[6]-3:	C[6](C[6]C[6,6]B)(C[6]C[6]H)(H)	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(BC[6a]2)	H(C[6]C[6]2)	C[6](C[6]C[6,6]B)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(BC[6a]2){3|C<3>,3|H<1>}	H(C[6]C[6]2)	117.6760	0.000	1	117.6760	0.000	1	117.6760	0.000	1	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6]C)(C[6]C[6,6]O)(H)	C[6](C[6,6]C[6,6]2C)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6,6]C)(C[6]C[6,6]O)(H){1|H<1>,4|C<4>}	C[6](C[6,6]C[6,6]2C)(C[6]C[6]H)(COO){1|O<1>,3|C<4>,3|H<1>}	H(C[6]C[6]2)	118.4910	0.000	1	118.4910	0.000	1	119.1303	0.630	6	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6]C)(C[6]C[6]H)(H)	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6,6]C)(C[6]C[6]H)(H){2|C<4>,2|H<1>}	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(COO){1|O<2>,2|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.3710	0.000	1	119.3710	0.000	1	119.1303	0.630	6	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6]C)(C[6]C[6]H)(H)	C[6](C[6,6]C[6,6]C[6]O)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6,6]C)(C[6]C[6]H)(H){1|O<2>,3|C<4>}	C[6](C[6,6]C[6,6]C[6]O)(C[6]C[6]H)(COO){2|C<3>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	119.2810	0.000	1	119.2810	0.000	1	119.1303	0.630	6	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6]C)(C[6]C[6]O)(H)	C[6](C[6,6]C[6]O[6]2)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6,6]C)(C[6]C[6]O)(H){1|C<3>,1|H<1>,2|O<2>}	C[6](C[6,6]C[6]O[6]2)(C[6]C[6]H)(COO){1|O<1>,1|O<2>,3|C<3>}	H(C[6]C[6]2)	120.5290	0.000	1	119.2130	1.321	3	119.1303	0.630	6	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6]C)(C[6]C[6]O)(H)	C[6](C[6,6]C[6]O[6]2)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6,6]C)(C[6]C[6]O)(H){1|Cl<1>,1|C<3>,2|O<2>}	C[6](C[6,6]C[6]O[6]2)(C[6]C[6]H)(COO){1|O<1>,1|O<2>,3|C<3>}	H(C[6]C[6]2)	118.5550	0.209	2	119.2130	1.321	3	119.1303	0.630	6	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6,6]C[6,6]N[3x6]H)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<4>,1|N<3>,1|N<4>,3|H<1>}	C[6](C[6,6]C[6,6]N[3x6]H)(C[6]C[6]H)(C[6]N[6]H){1|C<3>,3|C<4>,5|H<1>}	H(C[6]C[6]2)	119.5425	0.053	2	119.5425	0.003	2	119.5425	0.003	2	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[5a,6]N)(C[6]C[6,6]N)(H)	C[6](C[6,6]C[5a,6]N[6,6]C[6])(C[6]C[6]H)(NOO)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]N)(C[6]C[6,6]N)(H){1|N<2>,1|N<3>,2|C<3>}	C[6](C[6,6]C[5a,6]N[6,6]C[6])(C[6]C[6]H)(NOO){1|N<2>,1|N<3>,1|O<1>,4|C<3>}	H(C[6]C[6]2)	117.9770	0.000	1	117.9770	0.000	1	119.0220	2.184	2	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6,6]N)(C[6]C[6]H)(H)	C[6](C[6,6]C[6,6a]C[6,6]H)(C[6]C[6]H)(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6,6]N)(C[6]C[6]H)(H){1|B<3>,1|C<3>,1|C<4>,1|H<1>}	C[6](C[6,6]C[6,6a]C[6,6]H)(C[6]C[6]H)(NCC){2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.0670	0.000	1	120.0670	0.000	1	119.0220	2.184	2	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6]C[6a])(C[6]C[6,6]O)(H)	C[6](C[6,6]C[6,6]C[6]H)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]C[6a])(C[6]C[6,6]O)(H){2|C<4>,2|H<1>,3|C<3>}	C[6](C[6,6]C[6,6]C[6]H)(C[6a]C[6a]2)(C[6]C[6]H){2|C<3>,2|C<4>,2|O<1>,4|H<1>}	H(C[6]C[6]2)	118.3370	0.106	2	118.3370	0.011	2	118.3933	0.015	3	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6]C[6a])(C[6]C[6]H)(H)	C[6](C[6,6]C[6,6]C[6]Ru)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]C[6a])(C[6]C[6]H)(H){1|Ru<11>,1|H<1>,2|C<3>,2|C<4>}	C[6](C[6,6]C[6,6]C[6]Ru)(C[6a]C[6a]2)(C[6]C[6]H){2|C<4>,3|C<3>,4|H<1>}	H(C[6]C[6]2)	118.5060	0.000	1	118.5060	0.000	1	118.3933	0.015	3	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]FeH)(CC[5a]C[6a])(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Fe<5>,1|C<3>,2|H<1>}	C[6](C[6]C[6]FeH)(CC[5a]C[6a])(C[6]C[6]H){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.2410	0.127	2	119.2410	0.016	2	119.2410	0.016	2	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H)	C[6](C[6]C[6]CH)(C[5]C[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]N[6]H)(H){1|C<3>,1|H<1>,1|S<4>,3|C<4>}	C[6](C[6]C[6]CH)(C[5]C[5]2)(C[6]C[6]H){1|N<3>,4|C<4>,5|H<1>}	H(C[6]C[6]2)	117.4315	0.320	2	117.4315	0.103	2	117.4315	0.103	2	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[5a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]Br)(H)	C[6](C[6]C[6]TbO)(C[5a]N[5a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]Br)(H){1|Tb<12>,1|C<3>,1|H<1>,1|N<2>,1|N<3>,1|O<3>}	C[6](C[6]C[6]TbO)(C[5a]N[5a]2)(C[6]C[6]H){1|Br<1>,1|H<1>,1|O<3>,3|C<3>}	H(C[6]C[6]2)	120.5950	0.000	1	120.5950	0.000	1	120.5950	0.000	1	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]C[6a])(C[6]C[6]C)(H)	C[6](C[6]C[6,6a]C[6a]H)(C[6]C[6]H)(CCC)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C[6a])(C[6]C[6]C)(H){1|H<1>,5|C<3>}	C[6](C[6]C[6,6a]C[6a]H)(C[6]C[6]H)(CCC){5|C<3>}	H(C[6]C[6]2)	117.4700	0.000	1	117.4700	0.000	1	119.0572	0.716	191	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]C)(H)	C[6](C[6]C[6]ZrO)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]C)(H){1|Zr<7>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]ZrO)(C[6]C[6]H)(CHN){2|Br<1>,1|C<3>}	H(C[6]C[6]2)	120.2790	0.000	1	120.2790	0.000	1	119.0572	0.716	191	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[5a]C[6]H)(C[6]C[6]H)(CC[5a]H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,1|O<2>,2|C<3>}	C[6](C[6]C[5a]C[6]H)(C[6]C[6]H)(CC[5a]H){1|H<1>,1|S<2>,3|C<3>}	H(C[6]C[6]2)	118.8050	0.000	1	118.8050	0.000	1	119.0572	0.716	191	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]Al2)(C[6]C[6]H)(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){2|Al<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]Al2)(C[6]C[6]H)(CCH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7870	0.000	1	119.7870	0.000	1	119.0572	0.716	191	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(CCrO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|H<1>,1|O<2>,2|C<4>}	C[6](C[6]C[6]CH)(C[6]C[6]H)(CCrO){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	120.6400	0.000	1	120.6400	0.000	1	119.0572	0.716	191	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|C<4>,2|H<1>}	C[6](C[6]C[6]CH)(C[6]C[6]H)(CHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7700	0.000	1	119.7700	0.000	1	119.0572	0.716	191	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]CeO)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Ce<18>,1|C<3>,1|H<1>,1|O<3>}	C[6](C[6]C[6]CeO)(C[6]C[6]H)(CHN){1|C<3>,1|H<1>,1|O<3>}	H(C[6]C[6]2)	119.7320	0.192	4	119.7320	0.037	4	119.0572	0.716	191	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]DyO)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Dy<11>,1|C<4>,1|H<1>,1|O<2>}	C[6](C[6]C[6]DyO)(C[6]C[6]H)(CHN){1|C<3>,1|H<1>,1|O<3>}	H(C[6]C[6]2)	119.7920	0.387	2	119.7632	0.051	4	119.0572	0.716	191	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]DyO)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Dy<15>,1|C<3>,1|H<1>,1|O<3>}	C[6](C[6]C[6]DyO)(C[6]C[6]H)(CHN){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.7345	0.030	2	119.7632	0.051	4	119.0572	0.716	191	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]DyO)(C[6]C[6]H)(CHO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Dy<16>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]DyO)(C[6]C[6]H)(CHO){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	118.8335	0.257	2	118.8335	0.066	2	119.0572	0.716	191	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]ErO)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Er<14>,1|C<3>,1|H<1>,1|O<3>}	C[6](C[6]C[6]ErO)(C[6]C[6]H)(CHN){1|C<3>,1|H<1>,1|O<3>}	H(C[6]C[6]2)	119.0260	0.000	1	119.0260	0.000	1	119.0572	0.716	191	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]Fe2)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Fe<5>,1|Fe<6>,1|C<4>,1|H<1>}	C[6](C[6]C[6]Fe2)(C[6]C[6]H)(CHN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.6050	0.837	2	120.3050	0.318	5	119.0572	0.716	191	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]Fe2)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){2|Fe<6>,1|C<4>,1|H<1>}	C[6](C[6]C[6]Fe2)(C[6]C[6]H)(CHN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.1050	0.368	3	120.3050	0.318	5	119.0572	0.716	191	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]GdO)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Gd<15>,1|C<3>,1|H<1>,1|O<3>}	C[6](C[6]C[6]GdO)(C[6]C[6]H)(CHN){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.5735	0.059	2	119.4875	0.038	4	119.0572	0.716	191	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]GdO)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Gd<17>,1|C<4>,1|H<1>,1|O<3>}	C[6](C[6]C[6]GdO)(C[6]C[6]H)(CHN){1|C<3>,1|H<1>,1|O<3>}	H(C[6]C[6]2)	119.4015	0.284	2	119.4875	0.038	4	119.0572	0.716	191	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]GdO)(C[6]C[6]H)(CHO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Gd<16>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]GdO)(C[6]C[6]H)(CHO){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	118.8135	0.078	2	118.8135	0.006	2	119.0572	0.716	191	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(CCS)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|C<4>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(CCS){1|C<3>,2|H<1>}	H(C[6]C[6]2)	118.9160	0.000	1	118.9160	0.000	1	119.0572	0.716	191	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(CHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){2|C<4>,3|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(CHH){1|C<4>,3|H<1>}	H(C[6]C[6]2)	118.3220	0.000	1	118.3220	0.000	1	119.0572	0.716	191	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(CHO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(CHO){1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	114.7940	0.000	1	114.7940	0.000	1	119.0572	0.716	191	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){2|C<4>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(CNO){1|C<3>,3|H<1>}	H(C[6]C[6]2)	119.6360	0.000	1	119.6360	0.000	1	119.0572	0.716	191	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]HO)(C[6]C[6]H)(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,2|H<1>,2|O<2>}	C[6](C[6]C[6]HO)(C[6]C[6]H)(CCH){1|C<4>,1|O<2>,2|H<1>}	H(C[6]C[6]2)	117.3980	0.000	1	117.3980	0.000	1	119.0572	0.716	191	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]HO)(C[6]C[6]H)(CC[5a]2)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|O<1>,2|H<1>}	C[6](C[6]C[6]HO)(C[6]C[6]H)(CC[5a]2){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8820	0.000	1	119.8820	0.000	1	119.0572	0.716	191	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]HoO)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Ho<15>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]HoO)(C[6]C[6]H)(CHN){1|C<3>,1|H<1>,1|O<3>}	H(C[6]C[6]2)	119.6350	0.182	2	119.6350	0.033	2	119.0572	0.716	191	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]IrH)(C[6]C[6]H)(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Ir<7>,1|C<3>,1|C<4>,1|H<2>}	C[6](C[6]C[6]IrH)(C[6]C[6]H)(CCH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.3490	0.000	1	119.3490	0.000	1	119.0572	0.716	191	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]LaO)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|La<18>,1|C<3>,1|C<4>,1|O<3>}	C[6](C[6]C[6]LaO)(C[6]C[6]H)(CHN){1|C<3>,1|H<1>,1|O<3>}	H(C[6]C[6]2)	119.5840	0.229	6	119.7600	0.107	9	119.0572	0.716	191	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]LaO)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|La<18>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]LaO)(C[6]C[6]H)(CHN){1|C<3>,1|H<1>,1|O<3>}	H(C[6]C[6]2)	120.1120	0.131	3	119.7600	0.107	9	119.0572	0.716	191	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]NdO)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Nd<18>,1|C<3>,1|H<1>,1|O<3>}	C[6](C[6]C[6]NdO)(C[6]C[6]H)(CHN){1|C<3>,1|H<1>,1|O<3>}	H(C[6]C[6]2)	119.9960	0.047	2	119.9960	0.002	2	119.0572	0.716	191	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]OU)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|U<16>,1|C<4>,1|H<1>,1|O<3>}	C[6](C[6]C[6]OU)(C[6]C[6]H)(CHN){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.7100	0.473	19	119.7100	0.223	19	119.0572	0.716	191	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]OU)(C[6]C[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|U<14>,1|C<3>,1|C<4>,1|O<2>}	C[6](C[6]C[6]OU)(C[6]C[6]H)(CNO){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.4280	0.000	1	119.4280	0.000	1	119.0572	0.716	191	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]OV)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>,1|V<6>}	C[6](C[6]C[6]OV)(C[6]C[6]H)(CCN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.2740	0.000	1	119.2740	0.000	1	119.0572	0.716	191	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]TbO)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Tb<11>,1|C<4>,1|H<1>,1|O<2>}	C[6](C[6]C[6]TbO)(C[6]C[6]H)(CHN){1|C<3>,1|H<1>,1|O<3>}	H(C[6]C[6]2)	119.8670	0.000	1	119.5604	0.358	5	119.0572	0.716	191	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]TbO)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Tb<15>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]TbO)(C[6]C[6]H)(CHN){1|C<3>,1|H<1>,1|O<3>}	H(C[6]C[6]2)	119.8240	0.040	2	119.5604	0.358	5	119.0572	0.716	191	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]TbO)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Tb<16>,1|C<4>,1|H<1>,1|O<3>}	C[6](C[6]C[6]TbO)(C[6]C[6]H)(CHN){1|C<3>,1|H<1>,1|O<3>}	H(C[6]C[6]2)	119.1435	0.923	2	119.5604	0.358	5	119.0572	0.716	191	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]TiO)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Ti<12>,1|C<4>,1|H<1>,1|O<3>}	C[6](C[6]C[6]TiO)(C[6]C[6]H)(CHN){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.4657	0.205	3	119.8065	0.493	4	119.0572	0.716	191	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]TiO)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Ti<7>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]TiO)(C[6]C[6]H)(CHN){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.8290	0.000	1	119.8065	0.493	4	119.0572	0.716	191	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]TiO)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Ti<12>,1|C<4>,1|H<1>,1|O<3>}	C[6](C[6]C[6]TiO)(C[6]C[6]H)(COO){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.2312	0.185	5	119.2312	0.034	5	119.0572	0.716	191	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]YbO)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Yb<15>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]YbO)(C[6]C[6]H)(CHN){1|C<3>,1|H<1>,1|O<3>}	H(C[6]C[6]2)	119.8345	0.193	2	119.8345	0.037	2	119.0572	0.716	191	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]ZrH)(C[6]C[6]H)(CBC)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Zr<15>,1|C<3>,1|H<1>,1|H<2>}	C[6](C[6]C[6]ZrH)(C[6]C[6]H)(CBC){1|C<3>,2|H<1>}	H(C[6]C[6]2)	118.9500	0.000	1	118.9500	0.000	1	119.0572	0.716	191	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]N[6]HH)(C[6]C[6]H)(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,4|H<1>}	C[6](C[6]N[6]HH)(C[6]C[6]H)(CCH){1|C<4>,1|H<1>,1|S<4>}	H(C[6]C[6]2)	118.9250	0.000	1	118.9250	0.000	1	119.0572	0.716	191	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]O[6]CC)(C[6]C[6]H)(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|O<1>,1|O<2>,2|C<4>}	C[6](C[6]O[6]CC)(C[6]C[6]H)(CCH){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.7430	0.000	1	119.7430	0.000	1	119.0572	0.716	191	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]O[6]HH)(C[6]C[6]H)(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|O<2>,2|H<1>}	C[6](C[6]O[6]HH)(C[6]C[6]H)(CCH){1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.3143	0.176	3	120.3143	0.031	3	119.0572	0.716	191	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]CF)(C[6]C[6]H)(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|F<1>,2|H<1>}	C[6](C[6]C[6]CF)(C[6]C[6]H)(CCH){1|C<3>,1|C<4>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	117.8190	0.000	1	117.8190	0.000	1	119.0572	0.716	191	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(CCH){1|C<3>,1|C<4>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	118.4250	0.000	1	118.3443	0.003	4	119.0572	0.716	191	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(CCH){1|C<4>,1|O<1>,2|C<3>}	H(C[6]C[6]2)	118.2900	0.000	1	118.3443	0.003	4	119.0572	0.716	191	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(CCH){1|O<1>,3|C<4>}	H(C[6]C[6]2)	118.3310	0.023	2	118.3443	0.003	4	119.0572	0.716	191	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(CC[6a]O)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|C<3>,1|C<4>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(CC[6a]O){1|C<3>,1|O<2>,2|H<1>}	H(C[6]C[6]2)	119.9300	0.078	2	119.9300	0.006	2	119.0572	0.716	191	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(CNO){1|C<4>,1|O<1>,2|H<1>}	H(C[6]C[6]2)	119.0645	0.332	2	119.0645	0.110	2	119.0572	0.716	191	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]OU)(C[6]C[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|U<12>,1|O<2>,2|C<4>}	C[6](C[6]C[6]OU)(C[6]C[6]H)(CNO){1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	119.2458	0.483	4	119.3134	0.198	5	119.0572	0.716	191	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]OU)(C[6]C[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|U<14>,1|O<2>,2|C<4>}	C[6](C[6]C[6]OU)(C[6]C[6]H)(CNO){1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	119.5840	0.000	1	119.3134	0.198	5	119.0572	0.716	191	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	C[6](C[6]C[6]YbO)(C[6]C[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Yb<14>,1|O<2>,2|C<4>}	C[6](C[6]C[6]YbO)(C[6]C[6]H)(CNO){1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	119.5230	0.057	2	119.5230	0.003	2	119.0572	0.716	191	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(CCC)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(CCC){1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	118.0650	0.000	1	118.4093	0.249	31	119.0572	0.716	191	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(CCC)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(CCC){1|C<3>,3|C<4>}	H(C[6]C[6]2)	118.4207	0.503	30	118.4093	0.249	31	119.0572	0.716	191	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(CCH){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	118.6605	0.135	4	118.6059	0.165	35	119.0572	0.716	191	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(CCH){1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	118.2050	0.000	1	118.6059	0.165	35	119.0572	0.716	191	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(CCH){1|C<3>,3|C<4>}	H(C[6]C[6]2)	118.6120	0.431	30	118.6059	0.165	35	119.0572	0.716	191	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(CHO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|C<4>,3|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(CHO){1|C<2>,1|C<4>,2|C<3>}	H(C[6]C[6]2)	118.0990	0.000	1	118.0990	0.000	1	119.0572	0.716	191	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]OV)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|H<1>,1|O<2>,1|V<8>}	C[6](C[6]C[6]OV)(C[6]C[6]H)(CCN){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	118.7170	0.000	1	118.7170	0.000	1	119.0572	0.716	191	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]ZrO)(C[6]C[6]H)(CNN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Zr<7>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]ZrO)(C[6]C[6]H)(CNN){1|C<3>,2|C<4>}	H(C[6]C[6]2)	119.0170	0.000	1	119.0170	0.000	1	119.0572	0.716	191	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6a]C[6]H)(C[6]C[6]H)(CHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|C<4>,3|H<1>}	C[6](C[6]C[6a]C[6]H)(C[6]C[6]H)(CHH){1|C<2>,1|C<4>,4|C<3>}	H(C[6]C[6]2)	118.0880	0.000	1	118.0880	0.000	1	119.0572	0.716	191	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6a]N[6]H)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|N<3>,2|H<1>}	C[6](C[6]C[6a]N[6]H)(C[6]C[6]H)(COO){2|C<4>,3|C<3>}	H(C[6]C[6]2)	118.5105	0.040	2	118.5105	0.002	2	119.0572	0.716	191	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]N[6]CH)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]N[6]CH)(C[6]C[6]H)(COO){3|C<3>}	H(C[6]C[6]2)	118.9720	0.000	1	118.9720	0.000	1	119.0572	0.716	191	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]N[6]CO)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<4>,1|O<2>,2|N<3>}	C[6](C[6]N[6]CO)(C[6]C[6]H)(COO){1|C<4>,2|C<3>}	H(C[6]C[6]2)	118.1360	0.000	1	118.1360	0.000	1	119.0572	0.716	191	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]N[6]HH)(C[6]C[6]H)(CC[6a]H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|N<3>,4|H<1>}	C[6](C[6]N[6]HH)(C[6]C[6]H)(CC[6a]H){1|C<3>,1|C<4>,1|S<4>}	H(C[6]C[6]2)	118.4670	0.300	2	118.4670	0.090	2	119.0572	0.716	191	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]N[6]HH)(C[6]C[6]H)(CC[6a]O)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|N<3>,2|H<1>}	C[6](C[6]N[6]HH)(C[6]C[6]H)(CC[6a]O){1|S<4>,2|C<3>}	H(C[6]C[6]2)	119.9810	0.000	1	119.9810	0.000	1	119.0572	0.716	191	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]N[6]HH)(C[6]C[6]H)(CHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|N<3>,3|H<1>}	C[6](C[6]N[6]HH)(C[6]C[6]H)(CHH){1|S<4>,2|C<4>}	H(C[6]C[6]2)	116.9190	0.871	2	116.9190	0.759	2	119.0572	0.716	191	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]N[6]HH)(C[6]C[6]H)(CHO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|N<3>,4|H<1>}	C[6](C[6]N[6]HH)(C[6]C[6]H)(CHO){1|C<3>,1|C<4>,1|S<4>}	H(C[6]C[6]2)	118.4510	0.252	2	118.4510	0.063	2	119.0572	0.716	191	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]Cl)(C[6]C[6]C)(H)	C[6](C[6]C[6]ZrO)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]Cl)(C[6]C[6]C)(H){1|Zr<7>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]ZrO)(C[6]C[6]H)(CHN){2|Cl<1>,1|C<3>}	H(C[6]C[6]2)	120.1345	0.117	2	120.1345	0.014	2	119.0572	0.716	191	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]N[5])(C[6]C[6]C)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(CCC)	H(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]C[6]C)(H){3|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(CCC){1|C<4>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	118.7290	0.000	1	118.7290	0.000	1	119.0572	0.716	191	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6]C)(H)	C[6](C[6]C[5,6]N[6]H)(C[6]C[6]H)(C[6]C[6]O)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6]C)(H){1|N<3>,1|O<1>,2|C<3>,2|H<1>}	C[6](C[6]C[5,6]N[6]H)(C[6]C[6]H)(C[6]C[6]O){1|C<3>,1|H<1>,2|N<3>,3|C<4>}	H(C[6]C[6]2)	118.9630	0.000	1	118.9630	0.000	1	118.8803	1.620	37	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6]C)(H)	C[6](C[6]C[6]TiO)(C[6]C[6]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6]C)(H){1|Ti<12>,1|C<4>,1|H<1>,1|O<2>,2|C<3>}	C[6](C[6]C[6]TiO)(C[6]C[6]2)(C[6]C[6]H){1|H<1>,1|O<2>,2|C<4>,3|C<3>}	H(C[6]C[6]2)	118.3190	0.266	2	118.3190	0.071	2	118.8803	1.620	37	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6]C)(H)	C[6](C[6]C[6]ZrO)(C[6]C[6]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6]C)(H){1|Zr<14>,1|C<4>,1|H<1>,1|O<2>,2|C<3>}	C[6](C[6]C[6]ZrO)(C[6]C[6]2)(C[6]C[6]H){1|H<1>,1|O<2>,2|C<4>,3|C<3>}	H(C[6]C[6]2)	118.8395	0.186	2	118.5837	0.101	4	118.8803	1.620	37	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6]C)(H)	C[6](C[6]C[6]ZrO)(C[6]C[6]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6]C)(H){1|Zr<8>,1|C<4>,1|H<1>,1|O<2>,2|C<3>}	C[6](C[6]C[6]ZrO)(C[6]C[6]2)(C[6]C[6]H){1|H<1>,1|O<2>,2|C<4>,3|C<3>}	H(C[6]C[6]2)	118.3280	0.086	2	118.5837	0.101	4	118.8803	1.620	37	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]C[6]C)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6]H)(H){1|H<1>,1|O<1>,2|C<3>,2|C<4>}	C[6](C[6]C[6,6a]C[6]C)(C[6]C[6]H)2{1|C<4>,3|C<3>,4|H<1>}	H(C[6]C[6]2)	119.0435	0.218	4	119.0435	0.047	4	118.8803	1.620	37	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6]H)(H)	C[6](C[6]C[6]2H)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>,3|H<1>}	C[6](C[6]C[6]2H)(C[6]C[6]H)(C[6]N[6]H){1|Ir<8>,1|C<4>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.4080	0.000	1	120.4080	0.000	1	118.8803	1.620	37	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6]H)(H)	C[6](C[6]C[6]2Rh)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6]H)(H){1|Rh<6>,1|C<2>,1|C<3>,1|C<4>,2|H<1>}	C[6](C[6]C[6]2Rh)(C[6]C[6]H)2{1|C<3>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	118.2140	0.000	1	118.2140	0.000	1	118.8803	1.620	37	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6]H)(H)	C[6](C[6]C[6]Li2)(C[6]C[6]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6]H)(H){1|Li<3>,1|Li<4>,1|C<4>,1|H<1>,2|C<3>}	C[6](C[6]C[6]Li2)(C[6]C[6]2)(C[6]C[6]H){3|H<1>,4|C<3>}	H(C[6]C[6]2)	120.0620	0.000	1	120.0620	0.000	1	118.8803	1.620	37	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6]H)(H)	C[6](C[6]C[6]LiH)(C[6]C[6]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6]H)(H){1|Li<4>,1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]C[6]LiH)(C[6]C[6]2)(C[6]C[6]H){1|Li<3>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.5980	0.000	1	119.5980	0.000	1	118.8803	1.620	37	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6]H)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6]H)(H){1|C<2>,1|C<4>,1|N<3>,3|H<1>}	C[6](C[6]C[6]N[6]H)(C[6]C[6]H)2{1|S<4>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	113.3150	0.000	1	113.3150	0.000	1	118.8803	1.620	37	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6]H)(H)	C[6](C[6]C[6]PrH)(C[6]C[6]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6]H)(H){1|Pr<17>,1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]C[6]PrH)(C[6]C[6]2)(C[6]C[6]H){1|O<2>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.7200	0.000	1	119.7200	0.000	1	118.8803	1.620	37	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6]H)(H)	C[6](C[6]C[6]PrO)(C[6]C[6]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6]H)(H){1|Pr<17>,1|C<4>,1|H<1>,1|O<2>,2|C<3>}	C[6](C[6]C[6]PrO)(C[6]C[6]2)(C[6]C[6]H){3|H<1>,4|C<3>}	H(C[6]C[6]2)	119.3930	0.000	1	119.3930	0.000	1	118.8803	1.620	37	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6]H)(H)	C[6](C[6]C[6]TiO)(C[6]C[6]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6]H)(H){1|Ti<10>,1|C<4>,1|H<1>,1|O<2>,2|C<3>}	C[6](C[6]C[6]TiO)(C[6]C[6]2)(C[6]C[6]H){1|O<2>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.2224	0.287	7	119.2224	0.082	7	118.8803	1.620	37	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6]H)(H){1|C<2>,1|H<1>,3|C<3>}	C[6](C[6]C[6a]C[6]2)(C[6]C[6]H)2{1|C<2>,3|H<1>,4|C<3>}	H(C[6]C[6]2)	116.5285	0.592	2	116.5285	0.350	2	118.8803	1.620	37	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6]H)(H)	C[6](C[6]N[6]O[6]C)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6]H)(H){1|C<2>,1|C<4>,1|N<3>,1|O<2>,2|H<1>}	C[6](C[6]N[6]O[6]C)(C[6]C[6]H)2{1|H<1>,4|C<3>}	H(C[6]C[6]2)	119.8690	0.000	1	119.8690	0.000	1	118.8803	1.620	37	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6]N)(H)	C[6](C[6]C[5,6]N[6]H)(C[6]C[6]H)(C[6]C[6]O)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6]N)(H){1|N<3>,1|O<1>,2|C<3>,2|H<1>}	C[6](C[6]C[5,6]N[6]H)(C[6]C[6]H)(C[6]C[6]O){1|C<3>,1|C<4>,2|H<1>,3|N<3>}	H(C[6]C[6]2)	120.0120	0.000	1	120.0120	0.000	1	118.8803	1.620	37	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6]O)(H)	C[6](C[6]C[6,6a]C[6]C)(C[6]C[6]H)(C[6]C[6]O)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6]O)(H){1|C<4>,1|H<1>,1|O<1>,3|C<3>}	C[6](C[6]C[6,6a]C[6]C)(C[6]C[6]H)(C[6]C[6]O){1|H<1>,2|O<1>,4|C<3>}	H(C[6]C[6]2)	118.7930	0.109	2	118.7930	0.012	2	118.8803	1.620	37	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](C[6]C[6,6a]C[6]H)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){1|O<1>,2|H<1>,3|C<3>}	C[6](C[6]C[6,6a]C[6]H)(C[6]C[6]H)2{1|N<3>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.7165	0.749	4	119.7165	0.561	4	118.8803	1.620	37	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]H)(H)	C[6](C[6]C[6]2H)(C[6]C[6]C)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]H)(H){2|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[6]2H)(C[6]C[6]C)(C[6]C[6]H){1|C<4>,1|O<1>,2|N<3>,4|H<1>}	H(C[6]C[6]2)	119.4490	0.000	1	119.4490	0.000	1	118.8803	1.620	37	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]N[6]O)(H)	C[6](C[6]C[6]HH)(C[6]C[6]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]N[6]O)(H){2|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]2)(C[6]C[6]H){1|C<4>,1|O<2>,2|H<1>,2|N<3>,2|O<1>}	H(C[6]C[6]2)	118.3560	0.000	1	118.3560	0.000	1	118.8803	1.620	37	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[6]N)(H)	C[6](C[6]N[5,6]C[6a]H)(C[6]C[6]H)(NOO)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[6]N)(H){1|C<3>,1|H<1>,2|N<3>}	C[6](C[6]N[5,6]C[6a]H)(C[6]C[6]H)(NOO){1|C<4>,4|C<3>}	H(C[6]C[6]2)	118.7960	0.000	1	118.7960	0.000	1	119.6003	0.814	40	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]N)(H)	C[6](C[6]C[6]HO)(C[6]C[6]H)(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]N)(H){1|H<1>,1|O<2>,2|C<4>}	C[6](C[6]C[6]HO)(C[6]C[6]H)(NCH){2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.4960	0.000	1	119.4960	0.000	1	119.6003	0.814	40	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]CrH)(C[6]C[6]H)(NCP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|Cr<7>,1|C<3>,1|H<1>,1|H<2>}	C[6](C[6]C[6]CrH)(C[6]C[6]H)(NCP){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4955	0.021	2	120.4955	0.000	2	119.6003	0.814	40	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]MoH)(C[6]C[6]H)(NCP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|Mo<7>,1|C<3>,1|H<1>,1|H<2>}	C[6](C[6]C[6]MoH)(C[6]C[6]H)(NCP){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.5540	0.025	2	120.5540	0.001	2	119.6003	0.814	40	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]OW)(C[6]C[6]H)(NC[6a]2)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<2>,1|W<9>}	C[6](C[6]C[6]OW)(C[6]C[6]H)(NC[6a]2){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.9380	0.000	1	119.9380	0.000	1	119.6003	0.814	40	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6a]C[6]Pd)(C[6]C[6]H)(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|Pd<5>,1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6a]C[6]Pd)(C[6]C[6]H)(NCC){1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	119.5710	0.000	1	119.5710	0.000	1	119.6003	0.814	40	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6a]C[6]Rh)(C[6]C[6]H)(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|Rh<5>,1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6a]C[6]Rh)(C[6]C[6]H)(NCC){2|H<1>,3|C<3>}	H(C[6]C[6]2)	118.8210	0.000	1	118.8210	0.000	1	119.6003	0.814	40	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]C[6]O)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]C[6]O)(H){1|C<3>,1|C<4>,3|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(NCH){1|H<1>,1|O<1>,2|C<4>}	H(C[6]C[6]2)	120.5970	0.000	1	119.8198	1.222	6	119.6003	0.814	40	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]C[6]O)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]C[6]O)(H){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(NCH){1|C<4>,1|O<1>,2|H<1>}	H(C[6]C[6]2)	119.3010	0.000	1	119.8198	1.222	6	119.6003	0.814	40	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]C[6]O)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]C[6]O)(H){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(NCH){1|O<1>,1|O<2>,2|C<4>}	H(C[6]C[6]2)	119.7450	0.000	1	119.8198	1.222	6	119.6003	0.814	40	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]C[6]O)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]C[6]O)(H){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(NCH){1|O<1>,3|C<4>}	H(C[6]C[6]2)	119.7587	1.616	3	119.8198	1.222	6	119.6003	0.814	40	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]C[6]O)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(NC[5a]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]C[6]O)(H){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(NC[5a]H){1|O<1>,3|C<4>}	H(C[6]C[6]2)	119.2488	0.173	4	119.2488	0.030	4	119.6003	0.814	40	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]C[6]O)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(NC[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]C[6]O)(H){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(NC[6]H){1|C<4>,1|O<1>,2|H<1>}	H(C[6]C[6]2)	118.9920	0.144	2	118.9920	0.021	2	119.6003	0.814	40	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]C[6]O)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(NC[6a]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]C[6]O)(H){1|C<3>,1|C<4>,3|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(NC[6a]H){1|H<1>,1|O<1>,2|C<4>}	H(C[6]C[6]2)	118.8920	0.000	1	119.7014	1.078	16	119.6003	0.814	40	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]C[6]O)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(NC[6a]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]C[6]O)(H){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(NC[6a]H){1|C<4>,1|O<1>,2|H<1>}	H(C[6]C[6]2)	120.1352	1.819	4	119.7014	1.078	16	119.6003	0.814	40	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]C[6]O)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(NC[6a]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]C[6]O)(H){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(NC[6a]H){1|O<1>,3|C<4>}	H(C[6]C[6]2)	119.6062	0.726	10	119.7014	1.078	16	119.6003	0.814	40	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]C[6]O)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(NC[6a]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]C[6]O)(H){2|H<1>,3|C<4>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(NC[6a]H){1|C<4>,1|O<1>,2|H<1>}	H(C[6]C[6]2)	119.7280	0.000	1	119.7014	1.078	16	119.6003	0.814	40	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]C)(H)	C[6](C[6]P[6]HH)(C[6]C[6]H)(NC[6a]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]C)(H){1|C<3>,1|P<3>,2|H<1>}	C[6](C[6]P[6]HH)(C[6]C[6]H)(NC[6a]H){1|Cl<1>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	118.1390	0.000	1	118.1390	0.000	1	119.6003	0.814	40	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(C[6]N[6]O)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]N)(C[6]N[6]O)(H){2|C<4>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(NCH){1|N<3>,1|O<1>,2|H<1>}	H(C[6]C[6]2)	119.0150	0.187	2	119.0150	0.035	2	119.6003	0.814	40	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:N[5]-3:	C[6]-3:	C[6](C[6]C[6]N[5])(C[6]C[6]C)(H)	C[6](C[6]C[6]ErN)(C[6]C[6]H)(N[5]C[5]2)	H(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]C[6]C)(H){1|Er<10>,1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6]ErN)(C[6]C[6]H)(N[5]C[5]2){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	118.5173	0.331	4	118.5173	0.110	4	118.8402	0.230	14	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:N[5]-3:	C[6]-3:	C[6](C[6]C[6]N[5])(C[6]C[6]C)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(N[5]C[5]2)	H(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]C[6]C)(H){3|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(N[5]C[5]2){1|C<3>,3|C<4>,6|H<1>}	H(C[6]C[6]2)	118.7230	0.000	1	118.7230	0.000	1	118.8402	0.230	14	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:N[5]-3:	C[6]-3:	C[6](C[6]C[6]N[5])(C[6]C[6]C)(H)	C[6](C[6]C[6]TaO)(C[6]C[6]H)(N[5]N[5]2)	H(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]C[6]C)(H){1|Ta<7>,1|C<3>,1|H<1>,1|N<2>,1|N<3>,1|O<2>}	C[6](C[6]C[6]TaO)(C[6]C[6]H)(N[5]N[5]2){1|C<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.8210	0.000	1	119.8210	0.000	1	118.8402	0.230	14	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:N[5]-3:	C[6]-3:	C[6](C[6]C[6]N[5])(C[6]C[6]C)(H)	C[6](C[6]C[6]YbN)(C[6]C[6]H)(N[5]C[5]2)	H(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]C[6]C)(H){1|Yb<10>,1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6]YbN)(C[6]C[6]H)(N[5]C[5]2){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	118.7966	0.346	7	118.7966	0.119	7	118.8402	0.230	14	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:N[5]-3:	C[6]-3:	C[6](C[6]C[6]N[5])(C[6]C[6]H)(H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(N[5]C[5]2)	H(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]C[6]H)(H){1|C<3>,1|H<1>,4|C<4>}	C[6](C[6]C[6]CH)(C[6]C[6]H)(N[5]C[5]2){1|C<4>,1|O<1>,1|O<2>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	119.5740	0.000	1	119.5740	0.000	1	118.8402	0.230	14	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]2H)(C[6]C[6]H)(N[6]C[6]O)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|C<3>,1|O<1>,2|C<4>,2|H<1>}	C[6](C[6]C[6]2H)(C[6]C[6]H)(N[6]C[6]O){1|C<3>,3|C<4>,5|H<1>}	H(C[6]C[6]2)	119.2570	0.182	3	119.2570	0.033	3	119.3396	0.022	8	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]2O)(C[6]C[6]H)(N[6]C[6]O)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>,1|O<2>,2|C<4>}	C[6](C[6]C[6]2O)(C[6]C[6]H)(N[6]C[6]O){1|C<4>,2|C<3>,6|H<1>}	H(C[6]C[6]2)	119.3880	0.000	1	119.3880	0.000	1	119.3396	0.022	8	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]O[6]H)(C[6]C[6]H)(N[6]C[6]O)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Br<1>,1|C<3>,1|C<4>,1|H<1>,1|O<1>,1|O<2>}	C[6](C[6]C[6]O[6]H)(C[6]C[6]H)(N[6]C[6]O){3|C<3>,4|H<1>}	H(C[6]C[6]2)	119.4760	0.000	1	119.4760	0.000	1	119.3396	0.022	8	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]O[6]O)(C[6]C[6]H)(N[6]C[6]O)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|O<1>,2|O<2>}	C[6](C[6]C[6]O[6]O)(C[6]C[6]H)(N[6]C[6]O){1|C<4>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	119.3607	0.146	3	119.3607	0.021	3	119.3396	0.022	8	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-3:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]O)(H)	C[6](C[6]C[6]TbO)(C[6]C[6]H)(OTbC)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]O)(H){1|Tb<12>,1|C<3>,1|H<1>,1|O<3>}	C[6](C[6]C[6]TbO)(C[6]C[6]H)(OTbC){1|Br<1>,2|C<3>}	H(C[6]C[6]2)	120.6710	0.000	1	120.6710	0.000	1	120.1498	0.232	22	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]EuO)(C[6]C[6]H)(OEuC)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|Eu<15>,1|C<3>,1|H<1>,1|O<3>}	C[6](C[6]C[6]EuO)(C[6]C[6]H)(OEuC){1|C<3>,2|C<4>}	H(C[6]C[6]2)	119.7250	0.199	2	119.7250	0.040	2	120.1498	0.232	22	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]OY)(C[6]C[6]H)(OCY)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|Y<15>,1|C<3>,1|H<1>,1|O<3>}	C[6](C[6]C[6]OY)(C[6]C[6]H)(OCY){1|C<3>,2|C<4>}	H(C[6]C[6]2)	119.9180	0.000	1	119.9180	0.000	1	120.1498	0.232	22	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]CeO)(C[6]C[6]H)(OCeC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Ce<18>,1|C<3>,1|H<1>,1|O<3>}	C[6](C[6]C[6]CeO)(C[6]C[6]H)(OCeC){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.2227	0.490	4	120.2227	0.240	4	120.1498	0.232	22	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]ErO)(C[6]C[6]H)(OErC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Er<14>,1|C<3>,1|H<1>,1|O<3>}	C[6](C[6]C[6]ErO)(C[6]C[6]H)(OErC){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.0790	0.000	1	120.0790	0.000	1	120.1498	0.232	22	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]HoO)(C[6]C[6]H)(OHoC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Ho<15>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]HoO)(C[6]C[6]H)(OHoC){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.0775	0.117	2	120.0775	0.014	2	120.1498	0.232	22	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]LaO)(C[6]C[6]H)(OLaC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|La<18>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]LaO)(C[6]C[6]H)(OLaC){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.6387	0.241	3	119.6387	0.058	3	120.1498	0.232	22	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]NdO)(C[6]C[6]H)(ONdC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Nd<18>,1|C<3>,1|H<1>,1|O<3>}	C[6](C[6]C[6]NdO)(C[6]C[6]H)(ONdC){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.7470	0.371	2	120.7470	0.137	2	120.1498	0.232	22	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]TbO)(C[6]C[6]H)(OTbC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Tb<15>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]TbO)(C[6]C[6]H)(OTbC){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.9590	0.236	2	119.9590	0.056	2	120.1498	0.232	22	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]TiN)(C[6]C[6]H)(OTiC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Ti<11>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]TiN)(C[6]C[6]H)(OTiC){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.9590	0.021	2	120.9590	0.000	2	120.1498	0.232	22	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:O-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6]YbO)(C[6]C[6]H)(OYbC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Yb<15>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]YbO)(C[6]C[6]H)(OYbC){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.9430	0.334	2	119.9430	0.111	2	120.1498	0.232	22	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:P-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]P)(H)	C[6](C[6]C[6]TiN)(C[6]C[6]H)(PCC)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]P)(H){1|Ti<6>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]TiN)(C[6]C[6]H)(PCC){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	118.5830	0.000	1	118.5830	0.000	1	118.5830	0.000	1	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:S-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]S)(H)	C[6](C[6]C[6]TaO)(C[6]C[6]H)(SC[6]Ta)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]S)(H){1|Ta<13>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]TaO)(C[6]C[6]H)(SC[6]Ta){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.5840	0.141	2	119.5840	0.020	2	119.8211	0.216	11	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:S-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]S)(H)	C[6](C[6]C[6]TiO)(C[6]C[6]H)(SC[6]Ti)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]S)(H){1|Ti<8>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]TiO)(C[6]C[6]H)(SC[6]Ti){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.7090	0.000	1	119.7090	0.000	1	119.8211	0.216	11	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:S-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]S)(H)	C[6](C[6]C[6]ZrO)(C[6]C[6]H)(SC[6]Zr)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]S)(H){1|Zr<12>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]ZrO)(C[6]C[6]H)(SC[6]Zr){1|C<3>,2|C<4>}	H(C[6]C[6]2)	119.9495	0.221	2	119.9495	0.049	2	119.8211	0.216	11	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:S-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]S)(H)	C[6](C[6]C[6]HO)(C[6]C[6]H)(SC[6a]O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]S)(H){1|C<4>,1|O<2>,2|H<1>}	C[6](C[6]C[6]HO)(C[6]C[6]H)(SC[6a]O){1|C<3>,1|O<2>,2|H<1>}	H(C[6]C[6]2)	120.2425	0.682	2	120.2425	0.466	2	119.8211	0.216	11	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:S-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]S)(H)	C[6](C[6]C[6]NY)(C[6]C[6]H)(SYY)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]S)(H){1|Y<12>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]NY)(C[6]C[6]H)(SYY){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.1270	0.000	1	119.1270	0.000	1	119.8211	0.216	11	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:S-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]S)(H)	C[6](C[6]C[6]TiO)(C[6]C[6]H)(SC[6]Ti)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]S)(H){1|Ti<8>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]TiO)(C[6]C[6]H)(SC[6]Ti){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2030	0.034	2	120.2030	0.001	2	119.8211	0.216	11	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:S-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]S)(H)	C[6](C[6]C[6]YbN)(C[6]C[6]H)(SYb2)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]S)(H){1|Yb<12>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]YbN)(C[6]C[6]H)(SYb2){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.2380	0.000	1	119.2380	0.000	1	119.8211	0.216	11	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[5,6]O)(H)	C[6](C[6]C[5,6]HH)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[5,6]O)(H){1|C<4>,1|S<4>,2|C<3>,3|H<1>}	C[6](C[6]C[5,6]HH)(C[6a]C[6a]2)(C[6]C[6]H){1|O<1>,2|C<3>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	118.1870	0.000	1	118.1870	0.000	1	119.2330	0.616	66	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]CoO)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]C)(H){1|Co<5>,1|C<4>,1|H<1>,1|O<2>,2|C<3>}	C[6](C[6]C[6]CoO)(C[6a]C[6a]2)(C[6]C[6]H){1|C<4>,1|H<1>,1|P<4>,4|C<3>}	H(C[6]C[6]2)	119.0190	0.000	1	119.0190	0.000	1	119.2330	0.616	66	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]IrO)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]C)(H){1|Ir<5>,1|H<1>,1|O<2>,3|C<3>}	C[6](C[6]C[6]IrO)(C[6a]C[6a]2)(C[6]C[6]H){1|C<4>,1|H<1>,1|P<4>,4|C<3>}	H(C[6]C[6]2)	118.6755	0.193	2	118.6755	0.037	2	119.2330	0.616	66	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]PtO)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]C)(H){1|Pt<5>,1|H<1>,1|O<2>,3|C<3>}	C[6](C[6]C[6]PtO)(C[6a]C[6a]2)(C[6]C[6]H){1|C<4>,1|H<1>,1|P<4>,4|C<3>}	H(C[6]C[6]2)	118.6440	0.136	2	118.6440	0.018	2	119.2330	0.616	66	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]AlH)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|Al<4>,2|H<1>,3|C<3>}	C[6](C[6]C[6]AlH)(C[6a]C[6a]2)(C[6]C[6]H){1|N<3>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.7515	0.986	2	119.7515	0.973	2	119.2330	0.616	66	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]GaH)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|Ga<3>,2|H<1>,3|C<3>}	C[6](C[6]C[6]GaH)(C[6a]C[6a]2)(C[6]C[6]H){1|H<1>,2|C<4>,4|C<3>}	H(C[6]C[6]2)	119.2210	0.052	2	119.2210	0.003	2	119.2330	0.616	66	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]LaH)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|La<13>,1|H<1>,2|C<3>,2|C<4>}	C[6](C[6]C[6]LaH)(C[6a]C[6a]2)(C[6]C[6]H){1|C<4>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.5340	0.000	1	119.5340	0.000	1	119.2330	0.616	66	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]Li2)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|Li<3>,1|Li<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]Li2)(C[6a]C[6a]2)(C[6]C[6]H){3|H<1>,4|C<3>}	H(C[6]C[6]2)	119.6590	0.000	1	119.6997	0.010	3	119.2330	0.616	66	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]Li2)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){2|Li<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]Li2)(C[6a]C[6a]2)(C[6]C[6]H){1|O<3>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.7200	0.133	2	119.6997	0.010	3	119.2330	0.616	66	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]LiNi)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|Li<3>,1|Ni<7>,1|H<1>,3|C<3>}	C[6](C[6]C[6]LiNi)(C[6a]C[6a]2)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.0160	0.000	1	120.0160	0.000	1	119.2330	0.616	66	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]MoH)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|Mo<7>,1|C<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]MoH)(C[6a]C[6a]2)(C[6]C[6]H){1|P<4>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.0970	1.383	4	120.0970	1.912	4	119.2330	0.616	66	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]Ni2)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|Ni<4>,1|Ni<5>,1|C<4>,1|H<1>,2|C<3>}	C[6](C[6]C[6]Ni2)(C[6a]C[6a]2)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.6300	0.000	1	119.6235	0.000	2	119.2330	0.616	66	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]Ni2)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|Ni<4>,1|Ni<5>,1|H<1>,3|C<3>}	C[6](C[6]C[6]Ni2)(C[6a]C[6a]2)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.6170	0.000	1	119.6235	0.000	2	119.2330	0.616	66	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]NiH)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|Ni<4>,1|C<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]NiH)(C[6a]C[6a]2)(C[6]C[6]H){1|P<4>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.9592	1.560	4	120.0280	1.474	6	119.2330	0.616	66	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]NiH)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|Ni<5>,1|C<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]NiH)(C[6a]C[6a]2)(C[6]C[6]H){1|S<3>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.0850	0.000	1	120.0280	1.474	6	119.2330	0.616	66	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]NiH)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|Ni<6>,1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]C[6]NiH)(C[6a]C[6a]2)(C[6]C[6]H){1|P<4>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.2460	0.000	1	120.0280	1.474	6	119.2330	0.616	66	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]PrO)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|Pr<17>,1|H<1>,1|O<2>,3|C<3>}	C[6](C[6]C[6]PrO)(C[6a]C[6a]2)(C[6]C[6]H){1|C<4>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	118.0885	0.732	2	118.2750	0.372	3	119.2330	0.616	66	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]PrO)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|Pr<17>,1|H<1>,1|O<2>,3|C<3>}	C[6](C[6]C[6]PrO)(C[6a]C[6a]2)(C[6]C[6]H){3|H<1>,4|C<3>}	H(C[6]C[6]2)	118.6480	0.000	1	118.2750	0.372	3	119.2330	0.616	66	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]PtH)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|Pt<5>,1|C<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]PtH)(C[6a]C[6a]2)(C[6]C[6]H){1|S<2>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.5727	0.165	6	119.5727	0.027	6	119.2330	0.616	66	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]ThO)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|Th<12>,1|H<1>,1|O<2>,3|C<3>}	C[6](C[6]C[6]ThO)(C[6a]C[6a]2)(C[6]C[6]H){1|H<1>,2|C<4>,4|C<3>}	H(C[6]C[6]2)	119.6407	0.263	4	119.6016	0.060	5	119.2330	0.616	66	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]ThO)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|Th<12>,1|H<1>,1|O<2>,3|C<3>}	C[6](C[6]C[6]ThO)(C[6a]C[6a]2)(C[6]C[6]H){1|H<1>,3|C<3>,3|C<4>}	H(C[6]C[6]2)	119.4450	0.000	1	119.6016	0.060	5	119.2330	0.616	66	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]TiO)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|Ti<10>,1|H<1>,1|O<2>,3|C<3>}	C[6](C[6]C[6]TiO)(C[6a]C[6a]2)(C[6]C[6]H){3|H<1>,4|C<3>}	H(C[6]C[6]2)	119.2151	0.272	7	119.2151	0.074	7	119.2330	0.616	66	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]N[6]TaO)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|Ta<13>,1|H<1>,1|N<3>,1|O<2>,2|C<3>}	C[6](C[6]N[6]TaO)(C[6a]C[6a]2)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	118.8225	0.383	2	118.8225	0.146	2	119.2330	0.616	66	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]N[6]TiO)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]H)(H){1|Ti<9>,1|H<1>,1|N<3>,1|O<2>,2|C<3>}	C[6](C[6]N[6]TiO)(C[6a]C[6a]2)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.3430	0.352	2	119.3430	0.124	2	119.2330	0.616	66	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]N)(H)	C[6](C[6]C[6]NiO)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]N)(H){1|Ni<5>,1|H<1>,1|O<2>,3|C<3>}	C[6](C[6]C[6]NiO)(C[6a]C[6a]2)(C[6]C[6]H){1|H<1>,1|N<3>,1|P<4>,4|C<3>}	H(C[6]C[6]2)	119.0610	0.117	4	119.0610	0.014	4	119.2330	0.616	66	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]O)(H)	C[6](C[6]C[5,6]CC)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]O)(H){1|C<4>,2|C<2>,2|C<3>,2|H<1>}	C[6](C[6]C[5,6]CC)(C[6a]C[6a]2)(C[6]C[6]H){1|C<4>,1|O<1>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	117.8680	0.000	1	117.8680	0.000	1	119.2330	0.616	66	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[5,6]O)(H)	C[6](C[6]C[5,6]HH)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[5,6]O)(H){2|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]HH)(C[6a]C[6a]2)(C[6]C[6]H){1|C<4>,1|N<3>,1|O<1>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	118.4595	0.078	2	118.4595	0.006	2	119.2330	0.616	66	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6,6]O)(H)	C[6](C[6]C[6,6]HH)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6,6]O)(H){1|C<4>,1|S<4>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6]HH)(C[6a]C[6a]2)(C[6]C[6]H){1|N<3>,1|O<1>,1|P<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	118.3590	0.000	1	118.4805	0.030	2	119.2330	0.616	66	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6,6]O)(H)	C[6](C[6]C[6,6]HH)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6,6]O)(H){1|C<4>,2|H<1>,3|C<3>}	C[6](C[6]C[6,6]HH)(C[6a]C[6a]2)(C[6]C[6]H){1|C<4>,1|N<3>,1|O<1>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	118.6020	0.000	1	118.4805	0.030	2	119.2330	0.616	66	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]O[6]O)(H)	C[6](C[6]C[5,6]HH)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]O[6]O)(H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]C[5,6]HH)(C[6a]C[6a]2)(C[6]C[6]H){1|O<1>,1|O<2>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	118.5840	0.160	3	118.5840	0.026	3	119.2330	0.616	66	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]O[6]O)(H)	C[6](C[6]C[6,6]HH)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]O[6]O)(H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6]HH)(C[6a]C[6a]2)(C[6]C[6]H){1|O<1>,1|O<2>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	118.2200	0.000	1	118.2200	0.000	1	119.2330	0.616	66	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]O[6]O)(H)	C[6](C[6]C[6]ClH)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]O[6]O)(H){1|Cl<1>,1|C<4>,1|H<1>,2|C<3>}	C[6](C[6]C[6]ClH)(C[6a]C[6a]2)(C[6]C[6]H){1|O<1>,1|O<2>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	118.0640	0.000	1	118.0640	0.000	1	119.2330	0.616	66	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:N-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]OW)(NC[6a]C[6])(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<2>,1|W<9>}	C[6](C[6]C[6]OW)(NC[6a]C[6])(C[6]C[6]H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.6275	0.076	2	119.6275	0.006	2	119.6275	0.006	2	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]Br)(H)	C[6](C[6]C[6,6]N[6]H)(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]Br)(H){1|Cu<5>,1|C<3>,1|C<4>,1|N<4>,2|H<1>}	C[6](C[6]C[6,6]N[6]H)(N[6]C[6]Cu)(C[6]C[6]H){1|Br<1>,1|H<1>,2|C<3>,4|C<4>}	H(C[6]C[6]2)	121.2790	0.054	2	121.2790	0.003	2	120.3948	0.374	62	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]2Cr)(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Cr<9>,1|Ir<8>,1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[6]2Cr)(N[6]C[6]Ir)(C[6]C[6]H){1|C<3>,2|H<1>,3|C<4>}	H(C[6]C[6]2)	119.1920	0.000	1	119.1920	0.000	1	120.3948	0.374	62	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]N[6]Ru)(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Ru<8>,1|Ru<9>,1|C<3>,1|C<4>,1|H<1>,1|N<4>}	C[6](C[6]C[6]N[6]Ru)(N[6]C[6]Ru)(C[6]C[6]H){1|C<3>,2|H<1>,3|C<4>}	H(C[6]C[6]2)	121.5990	0.000	1	119.6875	7.308	2	120.3948	0.374	62	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]N[6]Ru)(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]C)(H){1|Ru<8>,1|Ru<9>,1|H<1>,1|N<4>,2|C<3>}	C[6](C[6]C[6]N[6]Ru)(N[6]C[6]Ru)(C[6]C[6]H){2|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	117.7760	0.000	1	119.6875	7.308	2	120.3948	0.374	62	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]Cl)(H)	C[6](C[6]C[6,6]N[6]H)(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]Cl)(H){1|Cu<5>,1|C<3>,1|C<4>,1|N<4>,2|H<1>}	C[6](C[6]C[6,6]N[6]H)(N[6]C[6]Cu)(C[6]C[6]H){1|Cl<1>,1|H<1>,2|C<3>,4|C<4>}	H(C[6]C[6]2)	121.2330	0.270	2	121.2330	0.073	2	120.3948	0.374	62	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]N[6]H)(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<5>,1|C<3>,1|C<4>,1|N<4>,2|H<1>}	C[6](C[6]C[6,6]N[6]H)(N[6]C[6]Cu)(C[6]C[6]H){2|C<3>,2|H<1>,4|C<4>}	H(C[6]C[6]2)	120.6685	0.121	2	120.6465	0.034	8	120.3948	0.374	62	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]N[6]H)(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<6>,1|C<3>,1|C<4>,1|N<4>,2|H<1>}	C[6](C[6]C[6,6]N[6]H)(N[6]C[6]Cu)(C[6]C[6]H){2|C<3>,2|H<1>,4|C<4>}	H(C[6]C[6]2)	120.6683	0.241	4	120.6465	0.034	8	120.3948	0.374	62	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]N[6]H)(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<6>,1|C<3>,1|C<4>,1|N<4>,2|H<1>}	C[6](C[6]C[6,6]N[6]H)(N[6]C[6]Cu)(C[6]C[6]H){2|H<1>,3|C<3>,3|C<4>}	H(C[6]C[6]2)	120.5810	0.192	2	120.6465	0.034	8	120.3948	0.374	62	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]N[6]H)(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Fe<6>,1|C<3>,1|C<4>,1|N<4>,2|H<1>}	C[6](C[6]C[6,6]N[6]H)(N[6]C[6]Fe)(C[6]C[6]H){2|C<3>,2|H<1>,4|C<4>}	H(C[6]C[6]2)	120.5900	0.092	2	120.5900	0.008	2	120.3948	0.374	62	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]N[6]H)(N[6]C[6]Mn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Mn<7>,1|C<3>,1|C<4>,1|N<4>,2|H<1>}	C[6](C[6]C[6,6]N[6]H)(N[6]C[6]Mn)(C[6]C[6]H){2|C<3>,2|H<1>,4|C<4>}	H(C[6]C[6]2)	120.1960	0.352	2	120.1960	0.124	2	120.3948	0.374	62	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]N[6]H)(N[6]C[6]Ni)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|C<3>,1|C<4>,1|N<4>,2|H<1>}	C[6](C[6]C[6,6]N[6]H)(N[6]C[6]Ni)(C[6]C[6]H){1|H<1>,2|C<3>,5|C<4>}	H(C[6]C[6]2)	120.8590	0.922	2	120.5418	0.314	5	120.3948	0.374	62	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]N[6]H)(N[6]C[6]Ni)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|C<3>,1|C<4>,1|N<4>,2|H<1>}	C[6](C[6]C[6,6]N[6]H)(N[6]C[6]Ni)(C[6]C[6]H){2|C<3>,2|H<1>,4|C<4>}	H(C[6]C[6]2)	120.3180	0.000	1	120.5418	0.314	5	120.3948	0.374	62	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]N[6]H)(N[6]C[6]Ni)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ni<7>,1|C<3>,1|C<4>,1|N<4>,2|H<1>}	C[6](C[6]C[6,6]N[6]H)(N[6]C[6]Ni)(C[6]C[6]H){2|C<3>,2|H<1>,4|C<4>}	H(C[6]C[6]2)	120.3365	0.264	2	120.5418	0.314	5	120.3948	0.374	62	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]N[6]H)(N[6]C[6]Zn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Zn<6>,1|C<3>,1|C<4>,1|N<4>,2|H<1>}	C[6](C[6]C[6,6]N[6]H)(N[6]C[6]Zn)(C[6]C[6]H){2|C<3>,2|H<1>,4|C<4>}	H(C[6]C[6]2)	120.5785	0.388	2	120.5785	0.151	2	120.3948	0.374	62	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]O[6]C)(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ir<8>,1|H<1>,1|O<2>,3|C<3>}	C[6](C[6]C[6,6a]O[6]C)(N[6]C[6]Ir)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.8250	0.000	1	119.8250	0.000	1	120.3948	0.374	62	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]2Cr)(N[6]C[6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cr<9>,1|Pd<4>,1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[6]2Cr)(N[6]C[6]Pd)(C[6]C[6]H){1|C<3>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	120.0951	0.433	7	120.0870	0.162	8	120.3948	0.374	62	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]2Cr)(N[6]C[6]Pd)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cr<9>,1|Pd<5>,1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[6]2Cr)(N[6]C[6]Pd)(C[6]C[6]H){1|C<3>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	120.0300	0.000	1	120.0870	0.162	8	120.3948	0.374	62	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]2Cr)(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cr<9>,1|Ru<6>,1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[6]2Cr)(N[6]C[6]Ru)(C[6]C[6]H){1|C<3>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	120.3609	0.198	10	120.3609	0.039	10	120.3948	0.374	62	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]2Ir)(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ir<11>,1|Ir<8>,1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[6]2Ir)(N[6]C[6]Ir)(C[6]C[6]H){1|C<3>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	120.8660	0.000	1	120.8660	0.000	1	120.3948	0.374	62	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]2O)(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ru<4>,1|C<3>,1|H<1>,1|O<3>,2|C<4>}	C[6](C[6]C[6]2O)(N[6]C[6]Ru)(C[6]C[6]H){1|Br<1>,1|C<3>,2|C<4>,5|H<1>}	H(C[6]C[6]2)	120.1220	0.000	1	120.1220	0.000	1	120.3948	0.374	62	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]2Ru)(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ru<12>,1|Ru<6>,1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[6]2Ru)(N[6]C[6]Ru)(C[6]C[6]H){1|C<3>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	120.6730	0.000	1	120.6730	0.000	1	120.3948	0.374	62	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6]C)(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Fe<5>,1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6]C)(N[6]C[6]Fe)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.1270	0.130	2	120.1270	0.017	2	120.3948	0.374	62	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6]H)(N[6]C[6]Co)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Co<4>,1|C<3>,1|C<4>,1|N<3>,2|H<1>}	C[6](C[6]C[6]N[6]H)(N[6]C[6]Co)(C[6]C[6]H){1|C<3>,1|N<3>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	121.7300	0.000	1	121.7300	0.000	1	120.3948	0.374	62	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6]H)(N[6]C[6]Cr)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cr<4>,1|C<3>,1|C<4>,1|N<3>,2|H<1>}	C[6](C[6]C[6]N[6]H)(N[6]C[6]Cr)(C[6]C[6]H){1|C<3>,1|N<3>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	120.1760	0.074	2	120.1760	0.005	2	120.3948	0.374	62	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6]H)(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|C<3>,1|C<4>,1|N<3>,2|H<1>}	C[6](C[6]C[6]N[6]H)(N[6]C[6]Ir)(C[6]C[6]H){1|P<4>,2|C<3>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	120.1570	0.000	1	120.1570	0.000	1	120.3948	0.374	62	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6]H)(N[6]C[6]Ni)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ni<4>,1|C<3>,1|C<4>,1|N<3>,2|H<1>}	C[6](C[6]C[6]N[6]H)(N[6]C[6]Ni)(C[6]C[6]H){1|C<3>,1|N<3>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	120.1520	0.000	1	120.1520	0.000	1	120.3948	0.374	62	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6]H)(N[6]C[6]Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ru<5>,1|C<3>,1|C<4>,1|N<3>,2|H<1>}	C[6](C[6]C[6]N[6]H)(N[6]C[6]Ru)(C[6]C[6]H){1|C<4>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	120.1620	0.000	1	120.1620	0.000	1	120.3948	0.374	62	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]N[5,6]N[6]H)(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cu<6>,1|C<3>,1|N<3>,1|N<4>,2|H<1>}	C[6](C[6]N[5,6]N[6]H)(N[6]C[6]Cu)(C[6]C[6]H){2|C<3>,2|H<1>,3|C<4>}	H(C[6]C[6]2)	120.6680	0.000	1	120.6680	0.000	1	120.3948	0.374	62	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]N[6]2H)(N[6]C[6]Cr)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Cr<6>,1|C<3>,2|H<1>,2|N<3>}	C[6](C[6]N[6]2H)(N[6]C[6]Cr)(C[6]C[6]H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	119.3600	0.000	1	119.3600	0.000	1	120.3948	0.374	62	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]N[6]2H)(N[6]C[6]Ni)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Ni<6>,1|C<3>,1|N<3>,1|N<4>,2|H<1>}	C[6](C[6]N[6]2H)(N[6]C[6]Ni)(C[6]C[6]H){1|C<3>,3|C<4>,3|H<1>}	H(C[6]C[6]2)	120.3160	0.000	1	120.3160	0.000	1	120.3948	0.374	62	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]N[6]2O)(N[6]C[6]Re)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Re<6>,1|C<3>,1|H<1>,1|O<2>,2|N<3>}	C[6](C[6]N[6]2O)(N[6]C[6]Re)(C[6]C[6]H){1|Re<6>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.6100	0.000	1	119.6100	0.000	1	120.3948	0.374	62	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]O[6]2H)(N[6]C[6]Re)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Re<6>,1|C<3>,1|O<2>,1|O<3>,2|H<1>}	C[6](C[6]O[6]2H)(N[6]C[6]Re)(C[6]C[6]H){1|C<3>,1|H<1>,3|C<4>}	H(C[6]C[6]2)	120.8190	0.000	1	120.8620	0.004	2	120.3948	0.374	62	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]O[6]2H)(N[6]C[6]Re)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(H){1|Re<6>,1|C<3>,2|H<1>,2|O<2>}	C[6](C[6]O[6]2H)(N[6]C[6]Re)(C[6]C[6]H){1|C<3>,1|H<1>,3|C<4>}	H(C[6]C[6]2)	120.9050	0.000	1	120.8620	0.004	2	120.3948	0.374	62	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	Ge-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]Ge)(C[6]C[6]H)(H)	C[6](GeC[6]2Ge)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]Ge)(C[6]C[6]H)(H){1|C<2>,2|H<1>}	C[6](GeC[6]2Ge)(C[6]C[6]H)2{1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.7910	0.000	1	119.7910	0.000	1	119.7910	0.000	1	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	N-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](NC[6a]GeLi)(N[6]C[6]Li)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Li<7>,1|C<3>,1|H<1>}	C[6](NC[6a]GeLi)(N[6]C[6]Li)(C[6]C[6]H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.2410	0.000	1	120.2410	0.000	1	120.4870	0.121	2	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	N-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	C[6](NC[6a]LiZn)(N[6]C[6]Zn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](NC[6a]LiZn)(N[6]C[6]Zn)(C[6]C[6]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.7330	0.000	1	120.7330	0.000	1	120.4870	0.121	2	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Co2)(C[6]C[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){2|Co<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Co2)(C[6]C[6]H)(CNO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.6075	0.083	2	120.6075	0.007	2	120.2143	0.230	10	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]MgC)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mg<4>,1|C<3>,1|C<4>,1|H<1>}	C[6](N[6]C[6]MgC)(C[6]C[6]H)(CCN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.1100	0.223	2	120.1100	0.050	2	120.2143	0.230	10	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ni2)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){2|Ni<6>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Ni2)(C[6]C[6]H)(CCN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	120.4665	0.239	4	120.4665	0.057	4	120.2143	0.230	10	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	N[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]ZrO)(C[6]C[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Zr<16>,1|C<4>,1|H<1>,1|O<2>}	C[6](N[6]C[6]ZrO)(C[6]C[6]H)(CNO){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.4210	0.049	2	119.4210	0.002	2	120.2143	0.230	10	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	P-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](PC[5]C[6]O)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<3>,1|H<1>}	C[6](PC[5]C[6]O)(C[6]C[6]H)2{1|C<2>,2|H<1>}	H(C[6]C[6]2)	117.9912	2.282	4	117.9912	5.209	4	119.3183	9.879	57	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	P-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](PC[5]C[6]Pd)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<2>,2|H<1>}	C[6](PC[5]C[6]Pd)(C[6]C[6]H)2{1|C<3>,1|H<1>}	H(C[6]C[6]2)	118.4220	0.000	1	119.4610	2.373	3	119.3183	9.879	57	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	P-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](PC[5]C[6]Pd)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<3>,1|H<1>}	C[6](PC[5]C[6]Pd)(C[6]C[6]H)2{1|C<2>,2|H<1>}	H(C[6]C[6]2)	119.9805	1.768	2	119.4610	2.373	3	119.3183	9.879	57	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	P-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](PC[6a]2Ag)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<2>,2|H<1>}	C[6](PC[6a]2Ag)(C[6]C[6]H)2{1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2560	0.000	1	120.2560	0.000	1	119.3183	9.879	57	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	P-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](PC[6a]2C[6])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<2>,1|H<1>}	C[6](PC[6a]2C[6])(C[6]C[6]H)2{1|C<2>,1|H<1>}	H(C[6]C[6]2)	120.4560	0.000	1	120.4560	0.000	1	119.3183	9.879	57	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	P-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](PC[6a]2Cu)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<2>,2|H<1>}	C[6](PC[6a]2Cu)(C[6]C[6]H)2{1|C<3>,1|H<1>}	H(C[6]C[6]2)	117.6050	2.782	3	118.1410	6.309	4	119.3183	9.879	57	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	P-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](PC[6a]2Cu)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<4>,2|H<1>}	C[6](PC[6a]2Cu)(C[6]C[6]H)2{1|C<3>,3|H<1>}	H(C[6]C[6]2)	119.7490	0.000	1	118.1410	6.309	4	119.3183	9.879	57	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	P-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](PC[6a]2Ir)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<2>,2|H<1>}	C[6](PC[6a]2Ir)(C[6]C[6]H)2{1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0070	0.000	1	120.0070	0.000	1	119.3183	9.879	57	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	P-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](PC[6a]2Mo)(C[6]C[6]H)(C[6]C[6]O)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<3>,1|O<2>}	C[6](PC[6a]2Mo)(C[6]C[6]H)(C[6]C[6]O){1|C<2>,2|H<1>}	H(C[6]C[6]2)	120.6400	0.000	1	120.6400	0.000	1	119.3183	9.879	57	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	P-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](PC[6a]2Mo)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<3>,1|H<1>}	C[6](PC[6a]2Mo)(C[6]C[6]H)2{1|C<2>,2|H<1>}	H(C[6]C[6]2)	117.7560	0.742	2	117.7560	0.551	2	119.3183	9.879	57	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	P-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](PC[6a]2Pd)(C[6]C[6]C)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|H<1>,2|C<4>}	C[6](PC[6a]2Pd)(C[6]C[6]C)(C[6]C[6]H){1|C<3>,3|H<1>}	H(C[6]C[6]2)	119.6400	0.000	1	119.6400	0.000	1	119.3183	9.879	57	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	P-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](PC[6a]2Pd)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<2>,2|H<1>}	C[6](PC[6a]2Pd)(C[6]C[6]H)2{1|C<3>,1|H<1>}	H(C[6]C[6]2)	117.5557	2.359	3	117.5557	5.566	3	119.3183	9.879	57	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	P-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](PC[6a]2Pt)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<2>,1|F<1>,1|H<1>}	C[6](PC[6a]2Pt)(C[6]C[6]H)2{1|C<3>,1|H<1>}	H(C[6]C[6]2)	123.6025	2.153	2	121.4674	5.075	5	119.3183	9.879	57	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	P-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](PC[6a]2Pt)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<4>,2|H<1>}	C[6](PC[6a]2Pt)(C[6]C[6]H)2{1|Ti<10>,1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0440	0.484	3	121.4674	5.075	5	119.3183	9.879	57	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	P-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](PC[6a]2Re)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<3>,1|H<1>}	C[6](PC[6a]2Re)(C[6]C[6]H)2{1|C<2>,2|H<1>}	H(C[6]C[6]2)	116.9430	0.656	2	116.9430	0.431	2	119.3183	9.879	57	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	P-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](PC[6a]2Rh)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<3>,1|H<1>}	C[6](PC[6a]2Rh)(C[6]C[6]H)2{1|C<2>,2|H<1>}	H(C[6]C[6]2)	120.0045	2.065	2	120.0147	1.447	4	119.3183	9.879	57	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	P-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](PC[6a]2Rh)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<4>,2|H<1>}	C[6](PC[6a]2Rh)(C[6]C[6]H)2{1|Ti<8>,1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0250	0.273	2	120.0147	1.447	4	119.3183	9.879	57	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	P-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](PC[6a]2Ru)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<2>,1|H<1>}	C[6](PC[6a]2Ru)(C[6]C[6]H)2{1|C<2>,1|H<1>}	H(C[6]C[6]2)	132.3210	0.000	1	132.3210	0.000	1	119.3183	9.879	57	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	P-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](PC[6a]AgC)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<3>,1|H<1>}	C[6](PC[6a]AgC)(C[6]C[6]H)2{1|C<2>,2|H<1>}	H(C[6]C[6]2)	119.6290	0.304	2	119.6290	0.092	2	119.3183	9.879	57	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	P-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](PC[6a]C[6]C)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<3>,1|H<1>}	C[6](PC[6a]C[6]C)(C[6]C[6]H)2{1|C<2>,2|H<1>}	H(C[6]C[6]2)	118.1140	1.270	2	118.1140	1.613	2	119.3183	9.879	57	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	P-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](PC[6a]C[6]O)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<2>,2|H<1>}	C[6](PC[6a]C[6]O)(C[6]C[6]H)2{1|C<3>,1|H<1>}	H(C[6]C[6]2)	113.2500	0.000	1	113.2500	0.000	1	119.3183	9.879	57	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	P-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](PC[6a]C[6]Pd)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<2>,2|H<1>}	C[6](PC[6a]C[6]Pd)(C[6]C[6]H)2{1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.6900	0.000	1	120.5903	8.044	3	119.3183	9.879	57	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	P-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](PC[6a]C[6]Pd)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<3>,1|H<1>}	C[6](PC[6a]C[6]Pd)(C[6]C[6]H)2{1|C<2>,2|H<1>}	H(C[6]C[6]2)	120.0405	3.778	2	120.5903	8.044	3	119.3183	9.879	57	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	P-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](PC[6a]C[6]Re)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<3>,1|H<1>}	C[6](PC[6a]C[6]Re)(C[6]C[6]H)2{1|C<2>,2|H<1>}	H(C[6]C[6]2)	120.1475	0.887	2	120.1475	0.788	2	119.3183	9.879	57	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	P-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](PC[6a]C[6]S)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<2>,2|H<1>}	C[6](PC[6a]C[6]S)(C[6]C[6]H)2{1|C<3>,1|H<1>}	H(C[6]C[6]2)	116.0210	4.872	2	116.0210	23.736	2	119.3183	9.879	57	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	P-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](PC[6a]C[6]Sb)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<2>,2|H<1>}	C[6](PC[6a]C[6]Sb)(C[6]C[6]H)2{1|C<3>,1|H<1>}	H(C[6]C[6]2)	125.5390	0.000	1	125.5390	0.000	1	119.3183	9.879	57	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	P-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](PC[6a]CrH)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<2>,2|H<1>}	C[6](PC[6a]CrH)(C[6]C[6]H)2{1|C<3>,1|H<1>}	H(C[6]C[6]2)	115.5940	0.000	1	115.5940	0.000	1	119.3183	9.879	57	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	P-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](PC[6a]MoC)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<2>,2|H<1>}	C[6](PC[6a]MoC)(C[6]C[6]H)2{1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.7350	3.765	3	120.1668	8.319	5	119.3183	9.879	57	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	P-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](PC[6a]MoC)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<3>,1|H<1>}	C[6](PC[6a]MoC)(C[6]C[6]H)2{1|C<2>,2|H<1>}	H(C[6]C[6]2)	120.8145	1.879	2	120.1668	8.319	5	119.3183	9.879	57	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	P-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](PC[6a]PdC)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<2>,2|H<1>}	C[6](PC[6a]PdC)(C[6]C[6]H)2{1|C<3>,1|H<1>}	H(C[6]C[6]2)	117.6845	1.790	2	117.6845	3.203	2	119.3183	9.879	57	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	P-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](PC[6a]RhC)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<3>,1|H<1>}	C[6](PC[6a]RhC)(C[6]C[6]H)2{1|C<2>,2|H<1>}	H(C[6]C[6]2)	120.4850	2.080	2	120.4850	4.328	2	119.3183	9.879	57	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	P-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](PC[6a]RuC)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<2>,2|H<1>}	C[6](PC[6a]RuC)(C[6]C[6]H)2{1|C<3>,1|H<1>}	H(C[6]C[6]2)	114.3020	0.000	1	114.3020	0.000	1	119.3183	9.879	57	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	P-4:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	C[6](PC[6a]2Fe)(C[6]C[6]H)(N[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|C<3>,2|H<1>}	C[6](PC[6a]2Fe)(C[6]C[6]H)(N[6]C[6]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7120	0.000	1	119.7120	0.000	1	119.8718	0.039	4	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	P-4:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	C[6](PC[6a]2Ir)(C[6]C[6]H)(N[6]C[6]C)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](PC[6a]2Ir)(C[6]C[6]H)(N[6]C[6]C){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0610	0.000	1	120.0610	0.000	1	119.8718	0.039	4	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	P-4:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	C[6](PC[6a]2Pd)(C[6]C[6]H)(N[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|C<3>,2|H<1>}	C[6](PC[6a]2Pd)(C[6]C[6]H)(N[6]C[6]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8570	0.233	2	119.8570	0.054	2	119.8718	0.039	4	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	P-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	C[6](PC[6a]C[6]C)(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](PC[6a]C[6]C)(N[6]C[6]Cu)(C[6]C[6]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.8835	0.005	2	120.8835	0.000	2	120.5454	0.328	27	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	P-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	C[6](PC[6a]C[6]Cu)(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](PC[6a]C[6]Cu)(N[6]C[6]Cu)(C[6]C[6]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3306	0.173	19	120.3306	0.030	19	120.5454	0.328	27	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	P-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	C[6](PC[6a]C[6]O)(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|Cu<4>,1|C<3>,1|H<1>}	C[6](PC[6a]C[6]O)(N[6]C[6]Cu)(C[6]C[6]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	121.1130	0.996	6	121.1130	0.992	6	120.5454	0.328	27	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	P[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]C[6a])(C[6]P[6]C)(H)	C[6](P[6]C[6,6a]C[6a]2)(C[6]C[6]H)(CC[6a]O)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C[6a])(C[6]P[6]C)(H){6|C<3>}	C[6](P[6]C[6,6a]C[6a]2)(C[6]C[6]H)(CC[6a]O){7|C<3>}	H(C[6]C[6]2)	115.7760	0.000	1	115.7760	0.000	1	115.7760	0.000	1	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	P[6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]P[6])(C[6]C[6]H)(H)	C[6](P[6]C[6a]N[6]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]P[6])(C[6]C[6]H)(H){1|C<2>,1|C<3>,2|H<1>,2|N<2>}	C[6](P[6]C[6a]N[6]2)(C[6]C[6]H)2{1|H<1>,2|P<4>,3|C<3>}	H(C[6]C[6]2)	112.1230	0.000	1	112.1230	0.000	1	112.1230	0.000	1	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	Si-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]Si)(C[6]C[6]H)(H)	C[6](SiC[6a]2C[5])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]Si)(C[6]C[6]H)(H){1|C<2>,2|H<1>}	C[6](SiC[6a]2C[5])(C[6]C[6]H)2{1|C<3>,1|H<1>}	H(C[6]C[6]2)	118.8930	0.000	1	118.8930	0.000	1	117.7983	14.919	12	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	Si-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]Si)(C[6]C[6]H)(H)	C[6](SiC[6a]2C[6])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]Si)(C[6]C[6]H)(H){1|C<2>,2|H<1>}	C[6](SiC[6a]2C[6])(C[6]C[6]H)2{1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.4110	0.000	1	119.4110	0.000	1	117.7983	14.919	12	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	Si-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]Si)(C[6]C[6]H)(H)	C[6](SiC[6a]2O[4])(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]Si)(C[6]C[6]H)(H){1|C<2>,2|H<1>}	C[6](SiC[6a]2O[4])(C[6]C[6]H)2{1|C<3>,1|H<1>}	H(C[6]C[6]2)	117.3960	0.000	1	117.3960	0.000	1	117.7983	14.919	12	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	Si-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]Si)(C[6]C[6]H)(H)	C[6](SiC[6a]CC)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]Si)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](SiC[6a]CC)(C[6]C[6]H)(C[6]N[6]H){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.6465	0.148	2	119.6465	0.022	2	117.7983	14.919	12	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	Si-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]Si)(C[6]C[6]H)(H)	C[6](SiC[6a]CC)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]Si)(C[6]C[6]H)(H){1|C<2>,2|H<1>}	C[6](SiC[6a]CC)(C[6]C[6]H)2{1|C<3>,1|H<1>}	H(C[6]C[6]2)	106.3910	0.000	1	106.3910	0.000	1	117.7983	14.919	12	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	Si-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]Si)(C[6]C[6]H)(H)	C[6](SiC[6a]C[6]C)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]Si)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](SiC[6a]C[6]C)(C[6]C[6]H)(C[6]N[6]H){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.7020	0.215	4	119.7020	0.046	4	117.7983	14.919	12	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	Si-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]Si)(C[6]C[6]H)(H)	C[6](SiC[6a]C[6]Si)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]Si)(C[6]C[6]H)(H){1|C<2>,2|H<1>}	C[6](SiC[6a]C[6]Si)(C[6]C[6]H)2{1|C<3>,1|H<1>}	H(C[6]C[6]2)	116.6940	2.468	2	116.6940	6.090	2	117.7983	14.919	12	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	Si-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[6]Si)(C[6]C[6]H)(H)	C[6](SiC[6a]2C[6])(N[6]C[6]Co)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[6]Si)(C[6]C[6]H)(H){1|Co<4>,1|C<3>,1|H<1>}	C[6](SiC[6a]2C[6])(N[6]C[6]Co)(C[6]C[6]H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.8360	0.065	2	119.8360	0.004	2	119.9263	0.034	7	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	Si-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[6]Si)(C[6]C[6]H)(H)	C[6](SiC[6a]2C[6])(N[6]C[6]Fe)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[6]Si)(C[6]C[6]H)(H){1|Fe<4>,1|C<3>,1|H<1>}	C[6](SiC[6a]2C[6])(N[6]C[6]Fe)(C[6]C[6]H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.7405	0.100	2	119.7405	0.010	2	119.9263	0.034	7	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	Si-4:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[6]Si)(C[6]C[6]H)(H)	C[6](SiC[6a]C[6]2)(N[6]C[6]Mo)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[6]Si)(C[6]C[6]H)(H){1|Mo<6>,1|C<3>,1|H<1>}	C[6](SiC[6a]C[6]2)(N[6]C[6]Mo)(C[6]C[6]H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.1103	0.042	3	120.1103	0.002	3	119.9263	0.034	7	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	Si[6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]Si[6]C[6])(C[6]C[6]H)(H)	C[6](Si[6]C[6a]O[6]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]Si[6]C[6])(C[6]C[6]H)(H){1|C<2>,1|C<3>,2|H<1>,2|O<2>}	C[6](Si[6]C[6a]O[6]2)(C[6]C[6]H)2{2|Si<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.6220	0.000	1	119.6220	0.000	1	119.6220	0.000	1	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:C[6]-3:H-1:	Si[6]-4:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]Si[6])(C[6]C[6]C)(H)	C[6](Si[6]C[6]CC)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]Si[6])(C[6]C[6]C)(H){2|C<4>,4|C<3>}	C[6](Si[6]C[6]CC)(C[6a]C[6a]2)(C[6]C[6]H){2|H<1>,5|C<3>}	H(C[6]C[6]2)	115.9120	0.000	1	115.9120	0.000	1	115.9120	0.000	1	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:N[6]-3:H-1:	B[6a]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]B[6a]C[6])(N[6]C[6]H)(H)	C[6](B[6a]O[6a]2O)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]B[6a]C[6])(N[6]C[6]H)(H){1|C<3>,2|H<1>,3|O<2>}	C[6](B[6a]O[6a]2O)(C[6]C[6]H)(C[6]N[6]H){2|H<1>,3|C<3>}	H(C[6]C[6]N[6])	119.1267	0.070	3	119.1267	0.005	3	119.1267	0.005	3	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[4]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[4]C[6])(N[6]C[6]H)(H)	C[6](C[4]C[4]2H)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[4]C[6])(N[6]C[6]H)(H){1|C<3>,2|C<4>,3|H<1>}	C[6](C[4]C[4]2H)(C[6]C[6]H)(C[6]N[6]H){1|C<4>,3|C<3>,4|H<1>}	H(C[6]C[6]N[6])	119.8450	0.161	2	119.8450	0.026	2	119.8450	0.026	2	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[5,6]-4:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5,6]C[6a])(N[6]C[6]S)(H)	C[6](C[5,6]C[5,6a]C[5]C[6])(C[6a]C[6a]2)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[5,6]C[6a])(N[6]C[6]S)(H){2|C<4>,2|H<1>,3|C<3>}	C[6](C[5,6]C[5,6a]C[5]C[6])(C[6a]C[6a]2)(C[6]N[6]H){1|C<4>,1|S<4>,2|N<3>,4|C<3>,5|H<1>}	H(C[6]C[6]N[6])	117.2430	0.027	2	117.2430	0.001	2	117.2430	0.001	2	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[5]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(N[6]C[6]Cu)(H)	C[6](C[5]C[5]2Fe)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[5]C[6])(N[6]C[6]Cu)(H){1|Fe<10>,1|H<1>,2|C<3>,2|C<4>}	C[6](C[5]C[5]2Fe)(C[6]C[6]H)(C[6]N[6]H){1|Cu<4>,1|C<3>,2|C<4>,3|H<1>}	H(C[6]C[6]N[6])	117.9373	0.268	3	117.9373	0.072	3	118.7645	1.898	17	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[5]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(N[6]C[6]Cu)(H)	C[6](C[5]C[5]2Fe)(C[6]N[6]H)2	H(C[6]C[6]N[6])	C[6](C[6]C[5]C[6])(N[6]C[6]Cu)(H){1|Fe<10>,1|N<2>,2|C<4>,2|H<1>}	C[6](C[5]C[5]2Fe)(C[6]N[6]H)2{1|Cu<6>,1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]N[6])	117.9800	0.000	1	117.9800	0.000	1	118.7645	1.898	17	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[5]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(N[6]C[6]Cu)(H)	C[6](C[5]C[5]N[5]H)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[5]C[6])(N[6]C[6]Cu)(H){1|C<3>,1|C<4>,1|N<3>,3|H<1>}	C[6](C[5]C[5]N[5]H)(C[6]C[6]H)(C[6]N[6]H){1|Cu<5>,1|C<3>,3|C<4>,3|H<1>}	H(C[6]C[6]N[6])	118.2580	1.189	2	118.2580	1.415	2	118.7645	1.898	17	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[5]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(N[6]C[6]H)(H)	C[6](C[5]C[5]2H)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[5]C[6])(N[6]C[6]H)(H){1|C<3>,1|O<2>,2|C<4>,2|H<1>}	C[6](C[5]C[5]2H)(C[6]C[6]H)(C[6]N[6]H){1|C<3>,2|C<4>,6|H<1>}	H(C[6]C[6]N[6])	123.3960	0.000	1	123.3960	0.000	1	118.7645	1.898	17	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[5]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(N[6]C[6]H)(H)	C[6](C[5]C[5]N[5]H)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[5]C[6])(N[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<4>,3|H<1>}	C[6](C[5]C[5]N[5]H)(C[6]C[6]H)(C[6]N[6]H){1|C<3>,3|C<4>,5|H<1>}	H(C[6]C[6]N[6])	119.9525	0.247	2	119.9525	0.061	2	118.7645	1.898	17	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[5]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(N[6]C[6]Ni)(H)	C[6](C[5]C[5]2Fe)(C[6]N[6]H)2	H(C[6]C[6]N[6])	C[6](C[6]C[5]C[6])(N[6]C[6]Ni)(H){1|Fe<10>,1|N<2>,2|C<4>,2|H<1>}	C[6](C[5]C[5]2Fe)(C[6]N[6]H)2{1|Ni<6>,1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]N[6])	118.4273	0.177	3	118.4273	0.031	3	118.7645	1.898	17	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[5]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(N[6]C[6]Pd)(H)	C[6](C[5]C[5]2Fe)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[5]C[6])(N[6]C[6]Pd)(H){1|Fe<10>,1|H<1>,2|C<3>,2|C<4>}	C[6](C[5]C[5]2Fe)(C[6]C[6]H)(C[6]N[6]H){1|Pd<4>,1|C<3>,2|C<4>,3|H<1>}	H(C[6]C[6]N[6])	118.5470	0.228	3	118.5470	0.052	3	118.7645	1.898	17	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[5]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(N[6]C[6]W)(H)	C[6](C[5]C[5]N[5]H)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[5]C[6])(N[6]C[6]W)(H){1|C<3>,1|C<4>,1|N<3>,3|H<1>}	C[6](C[5]C[5]N[5]H)(C[6]C[6]H)(C[6]N[6]H){1|C<3>,1|W<6>,3|C<4>,3|H<1>}	H(C[6]C[6]N[6])	118.0380	0.000	1	118.0380	0.000	1	118.7645	1.898	17	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[5]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(N[6]C[6]Zn)(H)	C[6](C[5]C[5]2Fe)(C[6]N[6]H)2	H(C[6]C[6]N[6])	C[6](C[6]C[5]C[6])(N[6]C[6]Zn)(H){1|Fe<10>,1|N<2>,2|C<4>,2|H<1>}	C[6](C[5]C[5]2Fe)(C[6]N[6]H)2{1|Zn<6>,1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]N[6])	118.4270	0.000	1	118.4270	0.000	1	118.7645	1.898	17	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6,6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6]C)(N[6]C[6,6]C)(H)	C[6](C[6,6]C[6,6]C[6]H)(C[6]N[6]H)(CC[6a]O)	H(C[6]C[6]N[6])	C[6](C[6]C[6,6]C)(N[6]C[6,6]C)(H){2|H<1>,3|C<4>}	C[6](C[6,6]C[6,6]C[6]H)(C[6]N[6]H)(CC[6a]O){1|C<3>,2|C<4>,2|H<1>,2|O<2>}	H(C[6]C[6]N[6])	117.8530	0.000	1	117.8530	0.000	1	117.8530	0.000	1	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6]C[6])(N[6]C[6]H)(H)	C[6](C[6,6]C[6,6]N[3x6]H)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[6,6]C[6])(N[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<4>,3|H<1>}	C[6](C[6,6]C[6,6]N[3x6]H)(C[6]C[6]H)(C[6]N[6]H){1|C<3>,3|C<4>,5|H<1>}	H(C[6]C[6]N[6])	120.0575	0.025	2	120.0575	0.001	2	120.0575	0.001	2	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6,6]-4:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6,6]N)(N[6]C[6,6]C)(H)	C[6](C[6,6]N[6,6]N[6]H)(C[6]N[6]H)(NOO)	H(C[6]C[6]N[6])	C[6](C[6]C[6,6]N)(N[6]C[6,6]C)(H){1|C<3>,2|H<1>,2|N<3>}	C[6](C[6,6]N[6,6]N[6]H)(C[6]N[6]H)(NOO){1|C<3>,1|H<1>,3|C<4>}	H(C[6]C[6]N[6])	119.3720	0.080	3	119.3720	0.006	3	119.4412	0.023	4	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6,6]-4:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6,6]N)(N[6]C[6,6]H)(H)	C[6](C[6,6]N[6,6]N[6]H)(C[6]N[6]H)(NOO)	H(C[6]C[6]N[6])	C[6](C[6]C[6,6]N)(N[6]C[6,6]H)(H){1|C<3>,2|H<1>,2|N<3>}	C[6](C[6,6]N[6,6]N[6]H)(C[6]N[6]H)(NOO){1|C<3>,1|H<1>,3|C<4>}	H(C[6]C[6]N[6])	119.6490	0.000	1	119.6490	0.000	1	119.4412	0.023	4	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]C)(H)	C[6](C[6]C[6]CH)(C[6]N[6]H)(CCO)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]C)(H){1|C<3>,1|C<4>,2|H<1>}	C[6](C[6]C[6]CH)(C[6]N[6]H)(CCO){1|C<4>,2|C<3>}	H(C[6]C[6]N[6])	119.0763	0.300	3	119.0763	0.090	3	119.9856	4.517	18	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]C)(H)	C[6](C[6]C[6]CH)(C[6]N[6]H)(CN[5]O)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]C)(H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]C[6]CH)(C[6]N[6]H)(CN[5]O){1|C<3>,2|C<4>}	H(C[6]C[6]N[6])	117.6460	0.000	1	117.6460	0.000	1	119.9856	4.517	18	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]C)(H)	C[6](C[6]C[6]HH)(C[6]N[6]H)(CNO)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]C)(H){1|C<3>,3|H<1>}	C[6](C[6]C[6]HH)(C[6]N[6]H)(CNO){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	120.7840	0.000	1	120.7840	0.000	1	119.9856	4.517	18	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]C)(H)	C[6](C[6]C[6a]C[6]H)(C[6]N[6]H)(CCO)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]C)(H){2|C<3>,2|H<1>}	C[6](C[6]C[6a]C[6]H)(C[6]N[6]H)(CCO){1|C<4>,4|C<3>}	H(C[6]C[6]N[6])	120.6944	2.567	10	120.6944	6.592	10	119.9856	4.517	18	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]H)(H)	C[6](C[6]C[6a]N[6]H)(C[6]N[6]H)(CC[6a]O)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>,1|O<1>}	C[6](C[6]C[6a]N[6]H)(C[6]N[6]H)(CC[6a]O){2|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.5760	0.000	1	118.6345	0.007	2	119.9856	4.517	18	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]H)(H)	C[6](C[6]C[6a]N[6]H)(C[6]N[6]H)(CC[6a]O)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>,1|S<1>}	C[6](C[6]C[6a]N[6]H)(C[6]N[6]H)(CC[6a]O){2|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.6930	0.000	1	118.6345	0.007	2	119.9856	4.517	18	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)(N[6]N[6]S)(H)	C[6](C[6]C[6]HH)(C[6]N[6]H)(CC[6a]O)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]N[6]S)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]N[6]H)(CC[6a]O){1|C<3>,1|N<2>,1|S<4>}	H(C[6]C[6]N[6])	119.8680	0.000	1	119.8680	0.000	1	119.9856	4.517	18	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-4:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]N)(N[6]C[6]C)(H)	C[6](C[6]C[6]CH)(C[6]N[6]H)(NOO)	H(C[6]C[6]N[6])	C[6](C[6]C[6]N)(N[6]C[6]C)(H){2|C<3>,2|H<1>}	C[6](C[6]C[6]CH)(C[6]N[6]H)(NOO){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]N[6])	119.1810	0.245	2	119.1810	0.060	2	119.1810	0.060	2	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-4:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(N[6]C[6]B)(H)	C[6](C[6]C[6]PdH)(C[6a]C[6a]2)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[6a]C[6])(N[6]C[6]B)(H){1|Pd<3>,2|H<1>,3|C<3>}	C[6](C[6]C[6]PdH)(C[6a]C[6a]2)(C[6]N[6]H){1|B<4>,1|H<1>,1|P<4>,4|C<3>}	H(C[6]C[6]N[6])	118.1440	0.006	2	118.1440	0.000	2	118.7477	0.963	10	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-4:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(N[6]C[6]C)(H)	C[6](C[6]C[6]NiH)(C[6a]C[6a]2)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[6a]C[6])(N[6]C[6]C)(H){1|Ni<4>,2|H<1>,3|C<3>}	C[6](C[6]C[6]NiH)(C[6a]C[6a]2)(C[6]N[6]H){1|C<4>,1|H<1>,1|P<4>,4|C<3>}	H(C[6]C[6]N[6])	119.6112	0.152	4	119.6112	0.023	4	118.7477	0.963	10	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-4:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(N[6]C[6]C)(H)	C[6](C[6]C[6a]C[6]H)(C[6a]C[6a]2)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[6a]C[6])(N[6]C[6]C)(H){1|C<4>,1|H<1>,1|O<1>,3|C<3>}	C[6](C[6]C[6a]C[6]H)(C[6a]C[6a]2)(C[6]N[6]H){1|C<4>,1|O<2>,3|H<1>,5|C<3>}	H(C[6]C[6]N[6])	117.6190	0.000	1	117.6190	0.000	1	118.7477	0.963	10	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-4:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(N[6]C[6]H)(H)	C[6](C[6]C[6]NiH)(C[6a]C[6a]2)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[6a]C[6])(N[6]C[6]H)(H){1|Ni<5>,1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]C[6]NiH)(C[6a]C[6a]2)(C[6]N[6]H){1|P<4>,2|H<1>,4|C<3>}	H(C[6]C[6]N[6])	119.8010	0.000	1	119.8010	0.000	1	118.7477	0.963	10	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-4:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(N[6]C[6]S)(H)	C[6](C[6]C[6a]2C[6])(C[6a]C[6a]2)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[6a]C[6])(N[6]C[6]S)(H){1|C<4>,2|H<1>,4|C<3>}	C[6](C[6]C[6a]2C[6])(C[6a]C[6a]2)(C[6]N[6]H){1|C<4>,1|S<4>,4|H<1>,6|C<3>}	H(C[6]C[6]N[6])	117.3960	0.000	1	117.3960	0.000	1	118.7477	0.963	10	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-4:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(N[6]C[6]S)(H)	C[6](C[6]C[6a]C[6]H)(C[6a]C[6a]2)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[6a]C[6])(N[6]C[6]S)(H){2|H<1>,4|C<3>}	C[6](C[6]C[6a]C[6]H)(C[6a]C[6a]2)(C[6]N[6]H){1|S<4>,3|H<1>,5|C<3>}	H(C[6]C[6]N[6])	117.9280	0.000	1	117.9280	0.000	1	118.7477	0.963	10	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:N[6]-3:H-1:	Si-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]Si)(N[6]C[6]Pd)(H)	C[6](SiC[6a]CC)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]Si)(N[6]C[6]Pd)(H){1|C<3>,2|H<1>}	C[6](SiC[6a]CC)(C[6]C[6]H)(C[6]N[6]H){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2870	0.117	2	118.2870	0.014	2	118.2730	0.219	6	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	C[6]-3:N[6]-3:H-1:	Si-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]Si)(N[6]C[6]Pd)(H)	C[6](SiC[6a]C[6]C)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[6]Si)(N[6]C[6]Pd)(H){1|C<3>,2|H<1>}	C[6](SiC[6a]C[6]C)(C[6]C[6]H)(C[6]N[6]H){1|Pd<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.2660	0.600	4	118.2660	0.360	4	118.2730	0.219	6	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	N[6,6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](N[6,6]C[3x6]C[6,6])(C[6]C[6]C)(H)	C[6](C[6]C[6,6]HH)(C[6]N[6,6]H)(CHO)	H(C[6]N[6,6]C[6])	C[6](N[6,6]C[3x6]C[6,6])(C[6]C[6]C)(H){1|N<3>,3|C<4>,4|H<1>}	C[6](C[6]C[6,6]HH)(C[6]N[6,6]H)(CHO){1|H<1>,3|C<4>}	H(C[6]N[6,6]C[6])	117.8373	0.138	3	117.8373	0.019	3	117.8373	0.019	3	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	N[6]-3:C[6]-3:H-1:	C-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](N[6]C[6]Co)(C[6]C[6]C)(H)	C[6](CC[5x3,5x5,20x6]HO)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Co)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](CC[5x3,5x5,20x6]HO)(C[6]C[6]H)(C[6]N[6]H){1|Co<4>,1|C<3>,1|H<1>}	H(C[6]C[6]N[6])	118.5130	0.000	1	118.5130	0.000	1	118.5130	0.000	1	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6a]C[6])(C[6]C[5,6]C)(H)	C[6](C[5,6]C[5,6a]C[5]C[6])(C[6]N[6]H)(CC[6a]O)	H(C[6]C[6]N[6])	C[6](N[6]C[6a]C[6])(C[6]C[5,6]C)(H){1|H<1>,5|C<3>}	C[6](C[5,6]C[5,6a]C[5]C[6])(C[6]N[6]H)(CC[6a]O){1|N<3>,1|O<1>,5|C<3>}	H(C[6]C[6]N[6])	118.0765	0.112	2	118.0765	0.013	2	117.8547	0.154	3	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6a]C[6])(C[6]C[5,6]C)(H)	C[6](C[5,6]C[5,6a]C[5]C[6])(C[6]N[6]H)(COO)	H(C[6]C[6]N[6])	C[6](N[6]C[6a]C[6])(C[6]C[5,6]C)(H){1|C<4>,1|H<1>,5|C<3>}	C[6](C[5,6]C[5,6a]C[5]C[6])(C[6]N[6]H)(COO){1|C<4>,1|N<3>,1|O<1>,2|C<2>,3|C<3>}	H(C[6]C[6]N[6])	117.4110	0.000	1	117.4110	0.000	1	117.8547	0.154	3	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6,6]C[6a])(C[6]C[6,6]C)(H)	C[6](C[6,6]C[6,6]C[6]H)(C[6]N[6]H)(CC[6a]O)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6]C[6a])(C[6]C[6,6]C)(H){2|C<4>,2|H<1>,3|C<3>}	C[6](C[6,6]C[6,6]C[6]H)(C[6]N[6]H)(CC[6a]O){1|C<4>,2|C<3>,2|H<1>,2|O<2>}	H(C[6]C[6]N[6])	118.2700	0.000	1	118.2700	0.000	1	118.2700	0.000	1	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6,6a]C)(C[6]C[6]C)(H)	C[6](C[6]C[6,6a]CH)(C[6]N[6]H)(COO)	H(C[6]C[6]N[6])	C[6](N[6]C[6,6a]C)(C[6]C[6]C)(H){1|C<4>,1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]CH)(C[6]N[6]H)(COO){1|C<4>,2|C<3>}	H(C[6]C[6]N[6])	117.9710	0.134	2	117.9710	0.018	2	118.1513	0.081	12	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6a]C[6])(C[6]C[6]C)(H)	C[6](C[6]C[6a]C[6]H)(C[6]N[6]H)(CCO)	H(C[6]C[6]N[6])	C[6](N[6]C[6a]C[6])(C[6]C[6]C)(H){1|C<4>,1|O<2>,2|H<1>,3|C<3>}	C[6](C[6]C[6a]C[6]H)(C[6]N[6]H)(CCO){1|C<4>,1|H<1>,4|C<3>}	H(C[6]C[6]N[6])	117.6160	0.000	1	118.1433	0.233	3	118.1513	0.081	12	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6a]C[6])(C[6]C[6]C)(H)	C[6](C[6]C[6a]C[6]H)(C[6]N[6]H)(CCO)	H(C[6]C[6]N[6])	C[6](N[6]C[6a]C[6])(C[6]C[6]C)(H){2|H<1>,4|C<3>}	C[6](C[6]C[6a]C[6]H)(C[6]N[6]H)(CCO){5|C<3>}	H(C[6]C[6]N[6])	118.4070	0.221	2	118.1433	0.233	3	118.1513	0.081	12	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6a]C[6])(C[6]C[6]C)(H)	C[6](C[6]C[6a]C[6]H)(C[6]N[6]H)(CC[6a]O)	H(C[6]C[6]N[6])	C[6](N[6]C[6a]C[6])(C[6]C[6]C)(H){1|C<4>,1|O<2>,2|H<1>,3|C<3>}	C[6](C[6]C[6a]C[6]H)(C[6]N[6]H)(CC[6a]O){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]N[6])	117.8090	0.000	1	117.8090	0.000	1	118.1513	0.081	12	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6a]C[6])(C[6]C[6]C)(H)	C[6](C[6]C[6a]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]N[6])	C[6](N[6]C[6a]C[6])(C[6]C[6]C)(H){2|H<1>,4|C<3>}	C[6](C[6]C[6a]C[6]H)(C[6]N[6]H)(COO){1|H<1>,4|C<3>}	H(C[6]C[6]N[6])	118.0120	0.000	1	118.2884	0.034	5	118.1513	0.081	12	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6a]C[6])(C[6]C[6]C)(H)	C[6](C[6]C[6a]C[6]H)(C[6]N[6]H)(COO)	H(C[6]C[6]N[6])	C[6](N[6]C[6a]C[6])(C[6]C[6]C)(H){2|H<1>,4|C<3>}	C[6](C[6]C[6a]C[6]H)(C[6]N[6]H)(COO){5|C<3>}	H(C[6]C[6]N[6])	118.3575	0.114	4	118.2884	0.034	5	118.1513	0.081	12	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](N[6]C[6a]C[6])(C[6]C[6]C)(H)	C[6](C[6]N[6]HH)(C[6]N[6]H)(CC[6a]O)	H(C[6]C[6]N[6])	C[6](N[6]C[6a]C[6])(C[6]C[6]C)(H){1|N<3>,2|C<3>,4|H<1>}	C[6](C[6]N[6]HH)(C[6]N[6]H)(CC[6a]O){1|C<4>,2|C<3>}	H(C[6]C[6]N[6])	118.1930	0.000	1	118.1930	0.000	1	118.1513	0.081	12	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](N[6]C[6]Ir)(C[6]C[6]2)(H)	C[6](C[6]C[6]2H)(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ir)(C[6]C[6]2)(H){1|C<4>,2|C<3>,3|H<1>}	C[6](C[6]C[6]2H)(C[6]C[6]H)(C[6]N[6]H){1|Ir<8>,1|C<4>,2|H<1>,4|C<3>}	H(C[6]C[6]N[6])	119.4010	0.000	1	119.4010	0.000	1	119.4010	0.000	1	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:3:	3:	N[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:N-3:	C[6]-3:	C[6](N[6]C[6a]C[6])(C[6]C[6]N)(H)	C[6](C[6]C[6]CH)(C[6]N[6]H)(NOO)	H(C[6]C[6]N[6])	C[6](N[6]C[6a]C[6])(C[6]C[6]N)(H){2|C<3>,2|C<4>,3|H<1>}	C[6](C[6]C[6]CH)(C[6]N[6]H)(NOO){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6]N[6])	118.3250	0.000	1	118.3250	0.000	1	118.3250	0.000	1	119.5038	1.802	1181	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[5,6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[5,6]N[5,6]C[5])(C[6]C[5,6]C)(H)	C[6](C[5,6]C[5,6]C[5]Fe)(C[6]C[5,6]H)(CH3)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]C[5])(C[6]C[5,6]C)(H){1|Fe<10>,1|C<3>,1|H<1>,1|N<3>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]Fe)(C[6]C[5,6]H)(CH3){1|C<3>,1|H<1>,1|N<3>,2|C<4>}	H(C[6]C[5,6]C[6])	119.3400	0.175	2	119.3400	0.031	2	119.3400	0.031	2	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[5,6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[5,6]C[5,6]O[5])(C[6]C[6,6]C)(H)	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[5,6]H)(CH3)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]O[5])(C[6]C[6,6]C)(H){1|H<1>,2|C<3>,2|C<4>}	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[5,6]H)(CH3){1|C<3>,1|O<2>,2|H<1>,3|C<4>}	H(C[6]C[5,6]C[6])	112.5690	0.000	1	112.5690	0.000	1	112.5690	0.000	1	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6,6a]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]C)(H)	C[6](C[5,6]C[5]N[5]O[6])(C[6]C[6,6a]H)(CH3)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]C)(H){1|C<4>,1|H<1>,1|N<3>,1|O<2>,2|C<3>}	C[6](C[5,6]C[5]N[5]O[6])(C[6]C[6,6a]H)(CH3){2|C<4>,5|C<3>}	H(C[6]C[6,6a]C[6])	118.1500	0.000	1	118.1500	0.000	1	118.1500	0.000	1	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]C)(H)	C[6](C[6,6]C[6,6]C[6]S)(C[6]C[6,6a]H)(CH3)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]C)(H){1|C<4>,1|O<2>,1|S<4>,3|C<3>}	C[6](C[6,6]C[6,6]C[6]S)(C[6]C[6,6a]H)(CH3){1|H<1>,1|O<1>,1|O<2>,3|C<3>}	H(C[6]C[6,6a]C[6])	118.0918	0.234	5	118.0918	0.055	5	118.0918	0.055	5	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6,6a]C[6,6a,6a]C[6a])(C[6]C[6]C)(H)	C[6](C[6]C[6,6a]C[6]H)(C[6]C[6,6a]H)(CH3)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a,6a]C[6a])(C[6]C[6]C)(H){1|C<4>,2|H<1>,3|C<3>}	C[6](C[6]C[6,6a]C[6]H)(C[6]C[6,6a]H)(CH3){1|H<1>,5|C<3>}	H(C[6]C[6,6a]C[6])	118.3020	0.176	4	118.3020	0.031	4	118.5932	0.222	6	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6,6a]C[6,6a,6a]C[6a])(C[6]C[6]C)(H)	C[6](C[6]C[6,6a]HH)(C[6]C[6,6a]H)(CC3)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a,6a]C[6a])(C[6]C[6]C)(H){2|H<1>,4|C<3>}	C[6](C[6]C[6,6a]HH)(C[6]C[6,6a]H)(CC3){3|C<3>}	H(C[6]C[6,6a]C[6])	119.1530	0.000	1	119.1530	0.000	1	118.5932	0.222	6	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H)	C[6](C[6]C[6a]2O[6])(C[6]C[6,6a]H)(CCHH)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]C)(H){1|H<1>,1|O<2>,4|C<3>}	C[6](C[6]C[6a]2O[6])(C[6]C[6,6a]H)(CCHH){6|C<3>}	H(C[6]C[6,6a]C[6])	119.1980	0.000	1	119.1980	0.000	1	118.5932	0.222	6	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6,6a]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:S-4:	C[6]-3:	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]S)(H)	C[6](C[6]C[6a]O[6]O)(C[6]C[6,6a]H)(SC[6a]OO)	H(C[6]C[6,6a]C[6])	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]S)(H){1|H<1>,2|O<2>,3|C<3>}	C[6](C[6]C[6a]O[6]O)(C[6]C[6,6a]H)(SC[6a]OO){4|C<3>}	H(C[6]C[6,6a]C[6])	119.7327	0.323	4	119.7327	0.104	4	119.7327	0.104	4	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[3,5,6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[3,5,6]C)(C[6]C[6]C)(H)	C[6](C[3,5,6]C[3,6]N[5,6]P[3,5])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[3,5,6]C)(C[6]C[6]C)(H){1|C<4>,1|H<1>,1|N<3>,1|P<3>}	C[6](C[3,5,6]C[3,6]N[5,6]P[3,5])(C[6]C[6]H)(CH3){2|C<4>,4|C<3>}	H(C[6]C[6]2)	118.4490	0.000	1	118.4490	0.000	1	118.4490	0.000	1	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[3,6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[3,6]C)(C[6]C[6]C)(H)	C[6](C[3,6]C[3,5,6]C[3,5]H)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[3,6]C)(C[6]C[6]C)(H){2|C<4>,2|H<1>}	C[6](C[3,6]C[3,5,6]C[3,5]H)(C[6]C[6]H)(CH3){1|C<3>,4|C<4>}	H(C[6]C[6]2)	118.3290	0.000	1	118.3290	0.000	1	118.7110	0.292	2	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[3,6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[3,6]C)(C[6]C[6]H)(H)	C[6](C[3,6]C[3,6]C[3]H)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[3,6]C)(C[6]C[6]H)(H){2|C<4>,2|H<1>}	C[6](C[3,6]C[3,6]C[3]H)(C[6]C[6]H)(CHHN){2|C<3>,3|H<1>}	H(C[6]C[6]2)	119.0930	0.000	1	119.0930	0.000	1	118.7110	0.292	2	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[3x6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[3x6]C)(C[6]C[6]O)(H)	C[6](C[3x6]C[3x6]2H)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[3x6]C)(C[6]C[6]O)(H){1|H<1>,1|O<2>,3|C<4>}	C[6](C[3x6]C[3x6]2H)(C[6]C[6]H)(CH3){1|O<1>,2|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.3940	0.260	3	119.3940	0.068	3	119.3940	0.068	3	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[4,6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[4,6]C)(C[6]C[6]C)(H)	C[6](C[4,6]C[4,6]C[4]H)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[4,6]C)(C[6]C[6]C)(H){2|C<4>,2|H<1>}	C[6](C[4,6]C[4,6]C[4]H)(C[6]C[6]H)(CH3){1|H<1>,2|C<3>,3|C<4>}	H(C[6]C[6]2)	118.3270	0.000	1	118.3270	0.000	1	118.3270	0.000	1	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[5,6,6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6,6]C)(C[6]O[6]O)(H)	C[6](C[5,6,6]C[5,6,6]C[6]O[5])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5,6,6]C)(C[6]O[6]O)(H){1|O<2>,2|C<4>}	C[6](C[5,6,6]C[5,6,6]C[6]O[5])(C[6]C[6]H)(CH3){1|C<3>,1|O<1>,2|C<4>,2|H<1>,2|O<2>}	H(C[6]C[6]2)	118.3280	0.000	1	118.3280	0.000	1	118.3280	0.000	1	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[5,6]O)(H)	C[6](C[5,6]C[5,5,6]C[5]H)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[5,6]O)(H){1|H<1>,1|O<2>,3|C<4>}	C[6](C[5,6]C[5,5,6]C[5]H)(C[6]C[6]H)(CH3){1|O<1>,3|C<4>,3|O<2>}	H(C[6]C[6]2)	119.3330	0.000	1	119.3330	0.000	1	118.6334	0.673	134	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[5,6]O)(H)	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[5,6]O)(H){1|C<3>,1|H<1>,3|C<4>}	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(CH3){1|O<1>,2|C<4>,4|H<1>}	H(C[6]C[6]2)	119.4420	0.000	1	119.4420	0.000	1	118.6334	0.673	134	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[6,6]C)(H)	C[6](C[5,6]C[5,6,6]B[5]H)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[6,6]C)(H){1|B<3>,1|C<3>,1|C<4>,1|H<1>}	C[6](C[5,6]C[5,6,6]B[5]H)(C[6]C[6]H)(CH3){1|N<2>,1|N<3>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	118.2630	0.000	1	117.9310	0.093	4	118.6334	0.673	134	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[6,6]C)(H)	C[6](C[5,6]C[5,6,6]B[5]H)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[6,6]C)(H){1|B<3>,1|C<3>,1|C<4>,1|H<1>}	C[6](C[5,6]C[5,6,6]B[5]H)(C[6]C[6]H)(CH3){2|C<3>,2|C<4>,2|N<3>}	H(C[6]C[6]2)	117.8203	0.256	3	117.9310	0.093	4	118.6334	0.673	134	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[6]C)(H)	C[6](C[5,6]C[5,6]C[5]C)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[6]C)(H){1|C<3>,3|C<4>}	C[6](C[5,6]C[5,6]C[5]C)(C[6]C[6]H)(CH3){1|H<1>,1|O<1>,4|C<3>}	H(C[6]C[6]2)	117.8350	0.000	1	117.4363	0.137	3	118.6334	0.673	134	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[6]C)(H)	C[6](C[5,6]C[5,6]C[5]C)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[6]C)(H){2|C<3>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]C)(C[6]C[6]H)(CH3){1|H<1>,1|O<1>,4|C<3>}	H(C[6]C[6]2)	117.2370	0.190	2	117.4363	0.137	3	118.6334	0.673	134	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[6]C)(H)	C[6](C[5,6]C[5,6]N[5]Zr)(C[6]C[6]H)(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[6]C)(H){1|Zr<8>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[5,6]C[5,6]N[5]Zr)(C[6]C[6]H)(CHHP){1|C<4>,3|C<3>}	H(C[6]C[6]2)	118.4750	0.000	1	118.6230	0.044	2	118.6334	0.673	134	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[6]C)(H)	C[6](C[5,6]C[5,6]N[5]Zr)(C[6]C[6]H)(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[6]C)(H){1|Zr<9>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[5,6]C[5,6]N[5]Zr)(C[6]C[6]H)(CHHP){1|C<4>,3|C<3>}	H(C[6]C[6]2)	118.7710	0.000	1	118.6230	0.044	2	118.6334	0.673	134	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[6]C)(H)	C[6](C[5,6]C[5,6]O[5]C)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[6]C)(H){1|H<1>,1|O<2>,2|C<4>}	C[6](C[5,6]C[5,6]O[5]C)(C[6]C[6]H)(CH3){1|C<4>,1|N<2>,1|O<2>,2|C<3>}	H(C[6]C[6]2)	118.1740	0.000	1	118.1740	0.000	1	118.6334	0.673	134	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Co)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H){1|Co<10>,3|C<4>}	C[6](C[5,6]C[5,6]C[5]Co)(C[6]C[6]H)(CH3){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.7170	0.208	2	118.7170	0.043	2	118.6334	0.673	134	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Cr)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H){1|Cr<10>,3|C<4>}	C[6](C[5,6]C[5,6]C[5]Cr)(C[6]C[6]H)(CH3){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.6376	0.391	20	118.6735	0.836	30	118.6334	0.673	134	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Cr)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H){1|Cr<7>,3|C<4>}	C[6](C[5,6]C[5,6]C[5]Cr)(C[6]C[6]H)(CH3){1|C<3>,1|H<1>,3|C<4>}	H(C[6]C[6]2)	118.6870	0.717	2	118.6735	0.836	30	118.6334	0.673	134	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Cr)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H){1|Cr<7>,3|C<4>}	C[6](C[5,6]C[5,6]C[5]Cr)(C[6]C[6]H)(CH3){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.9715	0.510	2	118.6735	0.836	30	118.6334	0.673	134	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Cr)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H){1|Cr<8>,3|C<4>}	C[6](C[5,6]C[5,6]C[5]Cr)(C[6]C[6]H)(CH3){1|C<3>,1|H<1>,3|C<4>}	H(C[6]C[6]2)	117.3827	1.558	3	118.6735	0.836	30	118.6334	0.673	134	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Cr)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H){1|Cr<8>,3|C<4>}	C[6](C[5,6]C[5,6]C[5]Cr)(C[6]C[6]H)(CH3){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.9957	1.622	3	118.6735	0.836	30	118.6334	0.673	134	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Fe)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H){1|Fe<10>,3|C<4>}	C[6](C[5,6]C[5,6]C[5]Fe)(C[6]C[6]H)(CH3){1|C<3>,1|H<1>,3|C<4>}	H(C[6]C[6]2)	118.4240	0.258	8	118.4876	0.070	10	118.6334	0.673	134	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Fe)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H){1|Fe<10>,3|C<4>}	C[6](C[5,6]C[5,6]C[5]Fe)(C[6]C[6]H)(CH3){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.7420	0.048	2	118.4876	0.070	10	118.6334	0.673	134	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Mo)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H){1|Mo<10>,3|C<4>}	C[6](C[5,6]C[5,6]C[5]Mo)(C[6]C[6]H)(CH3){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.5100	0.020	2	118.5849	0.029	11	118.6334	0.673	134	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Mo)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H){1|Mo<9>,3|C<4>}	C[6](C[5,6]C[5,6]C[5]Mo)(C[6]C[6]H)(CH3){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.6016	0.185	9	118.5849	0.029	11	118.6334	0.673	134	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H){1|Ru<10>,3|C<4>}	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]H)(CCHH){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.8089	0.189	10	118.8089	0.036	10	118.6334	0.673	134	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H){1|Ru<10>,3|C<4>}	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]H)(CH3){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.6200	0.133	2	118.5197	0.196	10	118.6334	0.673	134	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H){1|Ru<7>,3|C<4>}	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]H)(CH3){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.4995	0.220	2	118.5197	0.196	10	118.6334	0.673	134	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H){1|Ru<8>,3|C<4>}	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]H)(CH3){1|C<3>,1|H<1>,3|C<4>}	H(C[6]C[6]2)	118.3625	0.691	4	118.5197	0.196	10	118.6334	0.673	134	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H){1|Ru<8>,3|C<4>}	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]H)(CH3){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.7540	0.180	2	118.5197	0.196	10	118.6334	0.673	134	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H){1|Zr<12>,3|C<4>}	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(CH3){1|C<3>,1|H<1>,3|C<4>}	H(C[6]C[6]2)	118.5490	0.278	13	118.5690	0.082	36	118.6334	0.673	134	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H){1|Zr<12>,3|C<4>}	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(CH3){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.9420	0.168	2	118.5690	0.082	36	118.6334	0.673	134	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H){1|Zr<13>,3|C<4>}	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(CH3){1|C<3>,1|C<5>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	118.4310	0.000	1	118.5690	0.082	36	118.6334	0.673	134	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H){1|Zr<13>,3|C<4>}	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(CH3){1|C<3>,1|H<1>,3|C<4>}	H(C[6]C[6]2)	118.6187	0.309	10	118.5690	0.082	36	118.6334	0.673	134	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H){1|Zr<14>,3|C<4>}	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(CH3){1|C<3>,1|H<1>,3|C<4>}	H(C[6]C[6]2)	118.4579	0.298	8	118.5690	0.082	36	118.6334	0.673	134	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H){1|Zr<15>,3|C<4>}	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(CH3){1|C<3>,1|H<1>,3|C<4>}	H(C[6]C[6]2)	118.5915	0.083	2	118.5690	0.082	36	118.6334	0.673	134	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H)	C[6](C[5,6]C[5,6]O[5]N)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<2>,1|O<2>}	C[6](C[5,6]C[5,6]O[5]N)(C[6]C[6]H)(CH3){1|H<1>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	119.0540	0.000	1	119.0540	0.000	1	118.6334	0.673	134	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[6]O)(H)	C[6](C[5,6]C[5,6]C[5]C)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[6]O)(H){1|C<3>,3|C<4>}	C[6](C[5,6]C[5,6]C[5]C)(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|O<1>,1|O<2>,2|H<1>}	H(C[6]C[6]2)	118.0865	0.062	2	118.0865	0.004	2	118.6334	0.673	134	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[6]O)(H)	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[6]O)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(CH3){1|O<1>,3|C<4>,3|H<1>}	H(C[6]C[6]2)	124.6960	0.000	1	121.7577	9.649	3	118.6334	0.673	134	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[6]O)(H)	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[6]O)(H){2|C<4>,3|H<1>}	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(CH3){1|N<3>,1|O<1>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	120.2885	2.519	2	121.7577	9.649	3	118.6334	0.673	134	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[6]O)(H)	C[6](C[5,6]C[5,6a]C[5]C[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[6]O)(H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[5,6]C[5,6a]C[5]C[6])(C[6]C[6]H)(CH3){1|C<4>,1|H<1>,1|N<3>,2|O<1>,3|C<3>}	H(C[6]C[6]2)	117.8920	0.000	1	118.3708	0.082	5	118.6334	0.673	134	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[6]O)(H)	C[6](C[5,6]C[5,6a]C[5]C[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[6]O)(H){1|H<1>,3|C<3>}	C[6](C[5,6]C[5,6a]C[5]C[6])(C[6]C[6]H)(CH3){1|C<4>,1|O<1>,5|C<3>}	H(C[6]C[6]2)	118.4905	0.117	4	118.3708	0.082	5	118.6334	0.673	134	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[6]O)(H)	C[6](C[5,6]C[5]2C[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[6]O)(H){1|C<3>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5]2C[6])(C[6]C[6]H)(CH3){1|C<3>,1|O<1>,3|C<4>,4|H<1>}	H(C[6]C[6]2)	118.4770	0.000	1	118.4770	0.000	1	118.6334	0.673	134	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[6]O)(H)	C[6](C[5,6]C[5]2C[6])(C[6]C[6]H)(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[6]O)(H){1|C<3>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5]2C[6])(C[6]C[6]H)(CHHO){1|C<3>,1|O<1>,3|C<4>,4|H<1>}	H(C[6]C[6]2)	119.0970	0.000	1	119.0970	0.000	1	118.6334	0.673	134	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-3:Si-4:	C[6]-3:	C[6](C[6]C[5,6,6]O)(C[6]C[5,6]Si)(H)	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(SiC3)	H(C[6]C[6]2)	C[6](C[6]C[5,6,6]O)(C[6]C[5,6]Si)(H){1|C<4>,1|H<1>,3|C<3>}	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(SiC3){1|C<3>,1|C<4>,1|H<1>,2|O<1>}	H(C[6]C[6]2)	118.1730	0.000	1	118.1730	0.000	1	118.1730	0.000	1	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[3x6]O)(C[6]C[6,6]C)(H)	C[6](C[6,6]C[3x6]C[6]H)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[3x6]O)(C[6]C[6,6]C)(H){1|C<4>,1|H<1>,3|C<3>}	C[6](C[6,6]C[3x6]C[6]H)(C[6]C[6]H)(CH3){1|C<3>,1|H<1>,2|C<4>,2|O<1>}	H(C[6]C[6]2)	118.6610	0.000	1	118.6610	0.000	1	118.4083	0.648	6	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[4,6]O)(C[6]C[6,6]C)(H)	C[6](C[6,6]C[4,6,6]O[6]C)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[4,6]O)(C[6]C[6,6]C)(H){1|H<1>,1|O<2>,3|C<4>}	C[6](C[6,6]C[4,6,6]O[6]C)(C[6]C[6]H)(CH3){1|C<3>,1|H<1>,1|O<1>,2|C<4>}	H(C[6]C[6]2)	117.2260	0.000	1	117.2260	0.000	1	118.4083	0.648	6	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6]C)(C[6]C[6]H)(H)	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6]C)(C[6]C[6]H)(H){2|C<3>,2|C<4>}	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(CH3){1|C<3>,1|H<1>,1|O<1>,1|O<2>,2|C<4>}	H(C[6]C[6]2)	119.1940	0.000	1	119.1940	0.000	1	118.4083	0.648	6	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6]C)(C[6]C[6]O)(H)	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6]C)(C[6]C[6]O)(H){2|H<1>,3|C<4>}	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(CH3){1|O<1>,3|C<4>,3|H<1>}	H(C[6]C[6]2)	118.2140	0.000	1	118.2140	0.000	1	118.4083	0.648	6	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6]C)(C[6]C[6]O)(H)	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6]C)(C[6]C[6]O)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(CH3){1|C<3>,1|O<1>,2|H<1>,3|C<4>}	H(C[6]C[6]2)	117.8480	0.000	1	118.5775	1.064	2	118.4083	0.648	6	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6]C)(C[6]C[6]O)(H)	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6]C)(C[6]C[6]O)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(CH3){1|O<1>,2|H<1>,4|C<4>}	H(C[6]C[6]2)	119.3070	0.000	1	118.5775	1.064	2	118.4083	0.648	6	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[3,5,6]O)(C[6]C[6]C)(H)	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[3,5,6]O)(C[6]C[6]C)(H){2|H<1>,3|C<4>}	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(CH3){1|H<1>,1|O<1>,2|C<4>}	H(C[6]C[6]2)	118.9710	0.000	1	118.9710	0.000	1	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[3,5,6]O)(C[6]C[6]C)(H)	C[6](C[6]C[5,6]HO)(C[6]C[6]H)(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[3,5,6]O)(C[6]C[6]C)(H){1|H<1>,1|O<2>,3|C<4>}	C[6](C[6]C[5,6]HO)(C[6]C[6]H)(CHHO){1|C<4>,1|H<1>,1|O<1>,1|O<2>}	H(C[6]C[6]2)	117.6080	0.000	1	117.6080	0.000	1	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6,6]O)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5,6,6]O)(C[6]C[6]C)(H){1|C<3>,1|C<4>,1|N<3>,2|H<1>}	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	118.5695	0.320	2	118.5695	0.103	2	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]O)(C[6]C[6]C)(H)	C[6](C[6]C[5,6]ClH)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5,6]O)(C[6]C[6]C)(H){1|Cl<1>,1|H<1>,1|O<2>,2|C<4>}	C[6](C[6]C[5,6]ClH)(C[6]C[6]H)(CH3){1|N<2>,1|O<1>,2|C<4>}	H(C[6]C[6]2)	118.4670	0.000	1	118.4670	0.000	1	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]O)(C[6]C[6]C)(H)	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5,6]O)(C[6]C[6]C)(H){2|C<4>,3|H<1>}	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(CH3){1|C<4>,1|H<1>,1|O<1>,1|O<2>}	H(C[6]C[6]2)	118.2520	0.000	1	118.2520	0.000	1	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]O)(C[6]C[6]C)(H)	C[6](C[6]C[5,6]OO)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5,6]O)(C[6]C[6]C)(H){1|C<3>,1|C<4>,1|H<1>,2|O<2>}	C[6](C[6]C[5,6]OO)(C[6]C[6]H)(CH3){1|C<4>,1|H<1>,1|O<1>,1|O<2>}	H(C[6]C[6]2)	117.9250	0.000	1	118.7290	1.293	2	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]O)(C[6]C[6]C)(H)	C[6](C[6]C[5,6]OO)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5,6]O)(C[6]C[6]C)(H){1|C<4>,1|H<1>,3|O<2>}	C[6](C[6]C[5,6]OO)(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	119.5330	0.000	1	118.7290	1.293	2	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]O)(C[6]C[6]C)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5,6]O)(C[6]C[6]C)(H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	117.9800	0.000	1	117.9800	0.000	1	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6]C)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]CH)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6]C)(C[6]C[6]C)(H){1|H<1>,1|O<2>,2|C<4>}	C[6](C[6]C[6,6]CH)(C[6]C[6]H)(CH3){2|C<3>,2|C<4>}	H(C[6]C[6]2)	118.5530	0.000	1	118.5530	0.000	1	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6]C)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6,6]C)(C[6]C[6]C)(H){2|C<4>,2|H<1>}	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(CHHO){1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	118.5180	0.000	1	118.5180	0.000	1	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6]C)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]NdO)(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6,6]C)(C[6]C[6]C)(H){1|Nd<21>,1|C<4>,2|O<2>}	C[6](C[6]C[6,6]NdO)(C[6]C[6]H)(CC3){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	115.6697	0.336	6	115.6697	0.113	6	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6]C)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]OW)(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6,6]C)(C[6]C[6]C)(H){1|W<14>,1|C<4>,2|O<2>}	C[6](C[6]C[6,6]OW)(C[6]C[6]H)(CC3){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	116.5283	1.358	3	116.5283	1.844	3	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]CH)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]C)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[6,6]CH)(C[6]C[6]H)(CH3){1|O<1>,3|C<4>}	H(C[6]C[6]2)	118.0560	0.000	1	118.0560	0.000	1	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]C)(H){1|C<3>,1|C<4>,3|H<1>}	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(CH3){1|O<1>,1|O<2>,2|C<4>}	H(C[6]C[6]2)	118.7720	0.000	1	118.8922	0.058	5	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]C)(H){2|C<4>,3|H<1>}	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	118.7420	0.000	1	118.8922	0.058	5	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]C)(H){2|C<4>,3|H<1>}	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(CH3){1|H<1>,1|O<1>,2|C<4>}	H(C[6]C[6]2)	118.9823	0.291	3	118.8922	0.058	5	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]HO)(C[6]C[6]H)(CCCH)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]C)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[6]C[6,6]HO)(C[6]C[6]H)(CCCH){1|H<1>,1|O<1>,2|C<4>}	H(C[6]C[6]2)	120.5277	2.065	3	120.5277	4.265	3	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]C)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(CCCH)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]C)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(CCCH){1|C<4>,1|O<1>,2|H<1>}	H(C[6]C[6]2)	117.7940	0.000	1	117.7940	0.000	1	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]C)(H)	C[6](C[6]C[6]HO)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]C)(H){1|H<1>,2|C<4>,2|O<2>}	C[6](C[6]C[6]HO)(C[6]C[6]H)(CH3){1|C<4>,1|H<1>,1|O<1>,1|O<2>}	H(C[6]C[6]2)	118.5620	0.314	2	118.5620	0.099	2	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]C)(H)	C[6](C[6]C[6,6a]Li2)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]C)(H){1|Li<3>,1|Li<4>,2|C<3>}	C[6](C[6]C[6,6a]Li2)(C[6]C[6]H)(CHHN){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.5980	0.219	2	119.5980	0.048	2	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]C)(H)	C[6](C[6]C[6]DyO)(C[6]C[6]H)(CDyHO)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]C)(H){1|Dy<16>,1|C<3>,1|H<1>,1|O<3>}	C[6](C[6]C[6]DyO)(C[6]C[6]H)(CDyHO){1|Br<1>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	120.1100	0.137	6	120.1100	0.019	6	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]Br)(C[6]C[6]C)(H)	C[6](C[6]C[6]DyO)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]Br)(C[6]C[6]C)(H){1|Dy<16>,1|C<3>,1|H<1>,1|O<3>}	C[6](C[6]C[6]DyO)(C[6]C[6]H)(CHHN){1|Br<1>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	119.6680	0.218	6	119.6680	0.048	6	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]AgH)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Ag<5>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]AgH)(C[6]C[6]H)(CHHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.6850	0.000	1	119.6850	0.000	1	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]CaN)(C[6]C[6]H)(CCCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Ca<12>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]CaN)(C[6]C[6]H)(CCCH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.2780	0.142	4	119.2528	0.026	6	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]CaN)(C[6]C[6]H)(CCCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Ca<8>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]CaN)(C[6]C[6]H)(CCCH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.2025	0.245	2	119.2528	0.026	6	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]CaO)(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Ca<7>,1|C<3>,1|H<1>,1|O<3>}	C[6](C[6]C[6]CaO)(C[6]C[6]H)(CC3){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	118.8775	0.175	2	118.8775	0.031	2	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]CoN)(C[6]C[6]H)(CCCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Co<5>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]CoN)(C[6]C[6]H)(CCCH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	118.9770	0.000	1	118.9770	0.000	1	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]CrN)(C[6]C[6]H)(CCCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Cr<4>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]CrN)(C[6]C[6]H)(CCCH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	118.2360	1.289	4	118.7064	1.217	7	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]CrN)(C[6]C[6]H)(CCCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Cr<6>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]CrN)(C[6]C[6]H)(CCCH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	118.9300	0.000	1	118.7064	1.217	7	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]CrN)(C[6]C[6]H)(CCCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Cr<7>,1|C<3>,1|H<1>,1|N<4>}	C[6](C[6]C[6]CrN)(C[6]C[6]H)(CCCH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.5355	0.078	2	118.7064	1.217	7	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]DyO)(C[6]C[6]H)(CDyHO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Dy<16>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]DyO)(C[6]C[6]H)(CDyHO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.2590	0.557	2	119.2590	0.310	2	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]ErN)(C[6]C[6]H)(CCCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Er<15>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]ErN)(C[6]C[6]H)(CCCH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.6260	0.616	4	119.6260	0.380	4	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]EuN)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Eu<8>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]EuN)(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.3590	0.086	2	119.3590	0.007	2	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]GdO)(C[6]C[6]H)(CGdHO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Gd<16>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]GdO)(C[6]C[6]H)(CGdHO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.3845	0.095	2	119.3845	0.009	2	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(CCCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|C<4>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(CCCH){1|C<3>,3|H<1>}	H(C[6]C[6]2)	119.3630	0.000	1	118.4310	1.737	2	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(CCCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(CCCH){1|C<4>,3|H<1>}	H(C[6]C[6]2)	117.4990	0.000	1	118.4310	1.737	2	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(CC[6a]2H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,3|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(CC[6a]2H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.1820	0.000	1	119.1820	0.000	1	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|N<4>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(CH3){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.4340	0.000	1	119.6185	1.330	2	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|N<3>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	118.8030	0.000	1	119.6185	1.330	2	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,3|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(CHHO){1|C<3>,2|H<1>}	H(C[6]C[6]2)	121.0450	0.000	1	121.0450	0.000	1	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(CN[6]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,3|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(CN[6]HH){1|C<3>,2|H<1>}	H(C[6]C[6]2)	117.1680	0.000	1	117.1680	0.000	1	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]HO)(C[6]C[6]H)(CHHS)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|O<2>,2|H<1>}	C[6](C[6]C[6]HO)(C[6]C[6]H)(CHHS){1|C<3>,1|O<2>,2|H<1>}	H(C[6]C[6]2)	120.3800	0.000	1	120.3800	0.000	1	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]HU)(C[6]C[6]H)(CC[5]CC)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|U<16>,1|C<3>,1|H<1>,1|H<2>}	C[6](C[6]C[6]HU)(C[6]C[6]H)(CC[5]CC){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.9110	0.281	4	119.7266	0.229	5	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]HU)(C[6]C[6]H)(CC[5]CC)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|U<16>,1|C<3>,2|H<1>}	C[6](C[6]C[6]HU)(C[6]C[6]H)(CC[5]CC){1|C<3>,2|H<1>}	H(C[6]C[6]2)	118.9890	0.000	1	119.7266	0.229	5	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]HV)(C[6]C[6]H)(CC[5a]CC)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|V<6>,2|H<1>}	C[6](C[6]C[6]HV)(C[6]C[6]H)(CC[5a]CC){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.9335	0.005	2	119.9335	0.000	2	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]HfN)(C[6]C[6]H)(CCCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Hf<8>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]HfN)(C[6]C[6]H)(CCCH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.4190	0.214	2	119.2777	0.064	4	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]HfN)(C[6]C[6]H)(CCCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Hf<9>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]HfN)(C[6]C[6]H)(CCCH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.1365	0.258	2	119.2777	0.064	4	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]HfN)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Hf<9>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]HfN)(C[6]C[6]H)(CHHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.0160	0.000	1	119.0160	0.000	1	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]HfN)(C[6]C[6]H)(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Hf<10>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]HfN)(C[6]C[6]H)(CHHP){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.2338	0.154	4	119.2768	0.017	11	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]HfN)(C[6]C[6]H)(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Hf<11>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]HfN)(C[6]C[6]H)(CHHP){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.3047	0.054	3	119.2768	0.017	11	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]HfN)(C[6]C[6]H)(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Hf<9>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]HfN)(C[6]C[6]H)(CHHP){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.2990	0.166	4	119.2768	0.017	11	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]Ir2)(C[6]C[6]H)(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){2|Ir<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]Ir2)(C[6]C[6]H)(CHHP){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	118.9585	1.426	2	118.9585	2.034	2	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]IrN)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Ir<7>,1|C<3>,1|H<1>,1|N<4>}	C[6](C[6]C[6]IrN)(C[6]C[6]H)(CH3){1|C<3>,1|H<1>}	H(C[6]C[6]2)	118.8750	0.024	2	118.8750	0.001	2	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]LaH)(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|La<13>,1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]LaH)(C[6]C[6]H)(CC3){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.0720	0.000	1	119.0720	0.000	1	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]LaN)(C[6]C[6]H)(CCCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|La<16>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]LaN)(C[6]C[6]H)(CCCH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.3825	0.499	2	119.3825	0.249	2	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]Li2)(C[6]C[6]H)(CF3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){2|Li<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]Li2)(C[6]C[6]H)(CF3){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1990	0.000	1	120.1990	0.000	1	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]Li2)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){2|Li<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]Li2)(C[6]C[6]H)(CHHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7715	0.054	2	119.7715	0.003	2	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]LiN)(C[6]C[6]H)(CCCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Li<5>,1|C<3>,1|H<1>,1|N<4>}	C[6](C[6]C[6]LiN)(C[6]C[6]H)(CCCH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.4020	0.006	2	119.4020	0.000	2	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]LiN)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Li<5>,1|C<3>,1|H<1>,1|N<4>}	C[6](C[6]C[6]LiN)(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.1210	0.110	2	119.1210	0.012	2	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]MgH)(C[6]C[6]H)(CC[6a]2H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Mg<6>,1|C<3>,2|H<1>}	C[6](C[6]C[6]MgH)(C[6]C[6]H)(CC[6a]2H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.4180	0.000	1	119.4180	0.000	1	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]NU)(C[6]C[6]H)(CCCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>,1|U<8>}	C[6](C[6]C[6]NU)(C[6]C[6]H)(CCCH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.2820	0.000	1	119.1078	0.102	17	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]NU)(C[6]C[6]H)(CCCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|U<13>,1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]NU)(C[6]C[6]H)(CCCH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.0154	0.264	10	119.1078	0.102	17	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]NU)(C[6]C[6]H)(CCCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|U<14>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]NU)(C[6]C[6]H)(CCCH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.3585	0.403	4	119.1078	0.102	17	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]NU)(C[6]C[6]H)(CCCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|U<15>,1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]NU)(C[6]C[6]H)(CCCH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	118.9810	0.338	2	119.1078	0.102	17	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]NY)(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Y<10>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]NY)(C[6]C[6]H)(CC3){1|C<3>,2|H<1>}	H(C[6]C[6]2)	118.3720	0.030	2	118.3720	0.001	2	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]N[5]Li)(C[6]C[6]H)(CCCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Li<6>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[5]Li)(C[6]C[6]H)(CCCH){1|C<3>,1|H<1>,3|C<4>}	H(C[6]C[6]2)	119.0920	0.000	1	119.0920	0.000	1	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]N[5]Pd)(C[6]C[6]H)(CCCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Pd<6>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[5]Pd)(C[6]C[6]H)(CCCH){1|C<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.1700	0.000	1	119.1700	0.000	1	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]N[5]Ru)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Ru<10>,1|C<4>,1|H<1>,1|N<4>}	C[6](C[6]C[6]N[5]Ru)(C[6]C[6]H)(CH3){1|C<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.2450	0.000	1	119.2450	0.000	1	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6]Ru)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Ru<10>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[6]Ru)(C[6]C[6]H)(CH3){1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.5675	0.152	2	119.5675	0.023	2	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]NdN)(C[6]C[6]H)(CCCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Nd<15>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]NdN)(C[6]C[6]H)(CCCH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.0957	0.379	4	119.0957	0.143	4	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]NdN)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Nd<12>,1|C<3>,1|H<1>,1|N<4>}	C[6](C[6]C[6]NdN)(C[6]C[6]H)(CHHN){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.2853	0.085	3	119.2853	0.007	3	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]NdO)(C[6]C[6]H)(CCCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Nd<12>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]NdO)(C[6]C[6]H)(CCCH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.3260	0.228	2	119.1837	0.073	6	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]NdO)(C[6]C[6]H)(CCCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Nd<12>,1|C<3>,1|H<1>,1|O<3>}	C[6](C[6]C[6]NdO)(C[6]C[6]H)(CCCH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.1125	0.291	4	119.1837	0.073	6	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]NiH)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Ni<6>,1|C<3>,2|H<1>}	C[6](C[6]C[6]NiH)(C[6]C[6]H)(CHHN){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.9665	0.169	2	119.9665	0.029	2	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]NiN)(C[6]C[6]H)(CCCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Ni<4>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]NiN)(C[6]C[6]H)(CCCH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.3580	0.116	2	119.3580	0.013	2	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]RhP)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Rh<9>,1|C<4>,1|H<1>,1|P<4>}	C[6](C[6]C[6]RhP)(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	118.1540	0.000	1	118.1540	0.000	1	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]RuC)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Ru<7>,1|H<1>,2|C<4>}	C[6](C[6]C[6]RuC)(C[6]C[6]H)(CH3){1|Ru<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.0500	0.199	2	119.0500	0.040	2	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]ScN)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Sc<9>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]ScN)(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.4010	0.192	2	119.4010	0.037	2	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]SmN)(C[6]C[6]H)(CCCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Sm<10>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]SmN)(C[6]C[6]H)(CCCH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.3705	0.359	2	119.3332	0.046	4	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]SmN)(C[6]C[6]H)(CCCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Sm<11>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]SmN)(C[6]C[6]H)(CCCH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.2960	0.068	2	119.3332	0.046	4	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]SrN)(C[6]C[6]H)(CCCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Sr<6>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]SrN)(C[6]C[6]H)(CCCH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.1201	0.229	8	119.1201	0.052	8	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]ThN)(C[6]C[6]H)(CCCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Th<17>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]ThN)(C[6]C[6]H)(CCCH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.4393	0.346	4	119.4393	0.120	4	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]ThO)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Th<14>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]ThO)(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.3683	0.171	3	119.3683	0.029	3	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]TiO)(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Ti<7>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]TiO)(C[6]C[6]H)(CC3){1|H<1>,2|C<3>}	H(C[6]C[6]2)	118.3090	0.000	1	118.3090	0.000	1	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]YbN)(C[6]C[6]H)(CCCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Yb<13>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]YbN)(C[6]C[6]H)(CCCH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.3260	0.265	4	119.3260	0.070	4	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]YbN)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Yb<12>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]YbN)(C[6]C[6]H)(CH3){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.2525	1.071	2	119.2525	1.148	2	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]ZrN)(C[6]C[6]H)(CCCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Zr<9>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]ZrN)(C[6]C[6]H)(CCCH){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.1445	0.110	6	119.1445	0.012	6	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]ZrN)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Zr<10>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]ZrN)(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.1730	0.023	2	119.1887	0.047	4	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]ZrN)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Zr<7>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]ZrN)(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.2045	0.373	2	119.1887	0.047	4	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]ZrN)(C[6]C[6]H)(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Zr<11>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]ZrN)(C[6]C[6]H)(CHHP){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.2177	0.252	4	119.2235	0.041	6	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]ZrN)(C[6]C[6]H)(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Zr<9>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]ZrN)(C[6]C[6]H)(CHHP){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.2350	0.122	2	119.2235	0.041	6	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6]Cr)(C[6]C[6]H)(CCCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Cr<4>,1|H<1>,2|C<3>}	C[6](C[6]C[6a]C[6]Cr)(C[6]C[6]H)(CCCH){1|C<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.7560	0.345	2	119.7560	0.119	2	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6]H)(C[6]C[6]H)(CCCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){2|C<3>,2|H<1>}	C[6](C[6]C[6a]C[6]H)(C[6]C[6]H)(CCCH){1|C<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.3965	0.275	2	119.3965	0.076	2	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6]Ir)(C[6]C[6]H)(CCCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Ir<9>,1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6a]C[6]Ir)(C[6]C[6]H)(CCCH){1|C<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.4850	0.000	1	119.4850	0.000	1	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6]Pt)(C[6]C[6]H)(CCCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Pt<4>,1|H<1>,2|C<3>}	C[6](C[6]C[6a]C[6]Pt)(C[6]C[6]H)(CCCH){1|C<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.3845	0.062	2	119.3845	0.004	2	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]P[6]HP)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Si<4>,1|H<1>,2|P<4>}	C[6](C[6]P[6]HP)(C[6]C[6]H)(CH3){1|Ru<8>,1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	116.9020	0.052	2	116.8520	0.005	4	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]P[6]HP)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){2|H<1>,2|P<4>}	C[6](C[6]P[6]HP)(C[6]C[6]H)(CH3){1|Ru<9>,1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	116.8020	0.040	2	116.8520	0.005	4	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]N)(H)	C[6](C[6]C[6]CC)(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]N)(H){2|H<1>,3|C<4>}	C[6](C[6]C[6]CC)(C[6]C[6]H)(CCHH){1|C<4>,1|N<2>,2|H<1>}	H(C[6]C[6]2)	118.0020	0.000	1	118.0020	0.000	1	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]N)(H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]N)(H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]C[6]CH)(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	118.1320	0.000	1	118.1320	0.000	1	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]N)(H)	C[6](C[6]C[6]DyO)(C[6]C[6]H)(CDyHO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]N)(H){1|Dy<16>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]DyO)(C[6]C[6]H)(CDyHO){1|C<3>,1|N<2>,1|O<2>}	H(C[6]C[6]2)	119.9487	0.988	3	119.9487	0.976	3	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]N)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]N)(H){1|C<3>,1|C<4>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(CH3){1|H<1>,1|N<2>,2|C<3>}	H(C[6]C[6]2)	118.8500	0.000	1	118.4607	0.279	3	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]N)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]N)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(CH3){1|C<4>,1|N<2>,2|H<1>}	H(C[6]C[6]2)	118.2660	0.576	2	118.4607	0.279	3	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]N)(H)	C[6](C[6]C[6]TbO)(C[6]C[6]H)(CTbHO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]N)(H){1|Tb<16>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]TbO)(C[6]C[6]H)(CTbHO){1|C<3>,1|N<2>,1|O<2>}	H(C[6]C[6]2)	120.0600	1.056	3	120.0600	1.116	3	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]CC)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){2|H<1>,3|C<4>}	C[6](C[6]C[6]CC)(C[6]C[6]H)(CH3){1|H<1>,1|O<1>,2|C<4>}	H(C[6]C[6]2)	118.3520	0.014	2	118.3520	0.000	2	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|S<4>,2|C<4>,2|H<1>}	C[6](C[6]C[6]CH)(C[6]C[6]H)(CCHH){1|C<3>,1|C<4>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	117.7620	0.000	1	117.7620	0.000	1	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|C<3>,1|C<4>,3|H<1>}	C[6](C[6]C[6]CH)(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	117.9130	0.000	1	118.3420	0.073	5	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|C<3>,1|C<4>,3|H<1>}	C[6](C[6]C[6]CH)(C[6]C[6]H)(CH3){1|O<1>,3|C<4>}	H(C[6]C[6]2)	118.4493	0.142	4	118.3420	0.073	5	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]CO)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|H<1>,1|O<2>,3|C<4>}	C[6](C[6]C[6]CO)(C[6]C[6]H)(CH3){1|O<1>,3|C<4>}	H(C[6]C[6]2)	118.3700	0.000	1	118.3700	0.000	1	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(CCCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(CCCH){1|C<4>,1|O<1>,2|H<1>}	H(C[6]C[6]2)	118.1030	0.000	1	118.1030	0.000	1	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(CCHH){1|C<4>,1|O<1>,2|H<1>}	H(C[6]C[6]2)	118.6230	0.084	3	118.6230	0.007	3	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(CC[5]CH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(CC[5]CH){1|C<4>,1|O<1>,2|H<1>}	H(C[6]C[6]2)	118.4215	0.486	2	118.4215	0.236	2	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	118.3760	0.000	1	118.4205	0.074	8	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(CH3){1|C<4>,1|O<1>,2|C<3>}	H(C[6]C[6]2)	118.6220	0.209	3	118.4205	0.074	8	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(CH3){1|O<1>,3|C<4>}	H(C[6]C[6]2)	118.5120	0.062	2	118.4205	0.074	8	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){2|C<4>,3|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(CH3){1|C<4>,1|O<1>,2|H<1>}	H(C[6]C[6]2)	118.0490	0.102	2	118.4205	0.074	8	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]HO)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|C<4>,1|F<1>,1|O<2>,2|H<1>}	C[6](C[6]C[6]HO)(C[6]C[6]H)(CH3){1|C<4>,1|H<1>,1|O<1>,1|O<2>}	H(C[6]C[6]2)	118.1300	0.328	2	118.2887	0.074	4	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]HO)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|C<4>,2|H<1>,2|O<2>}	C[6](C[6]C[6]HO)(C[6]C[6]H)(CH3){1|C<4>,1|H<1>,1|O<1>,1|O<2>}	H(C[6]C[6]2)	118.3610	0.000	1	118.2887	0.074	4	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6]HO)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]O)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[6]C[6]HO)(C[6]C[6]H)(CH3){1|C<4>,1|H<1>,1|O<1>,1|O<2>}	H(C[6]C[6]2)	118.5340	0.000	1	118.2887	0.074	4	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]N[6]C)(H)	C[6](C[6]N[6]HH)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]N[6]C)(H){1|N<3>,2|H<1>}	C[6](C[6]N[6]HH)(C[6]C[6]H)(CH3){1|C<4>,1|N<2>,1|S<4>}	H(C[6]C[6]2)	119.8400	0.000	1	119.8400	0.000	1	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]O[6]O)(H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(CCCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]O[6]O)(H){1|H<1>,2|C<4>}	C[6](C[6]C[6]CH)(C[6]C[6]H)(CCCH){1|O<1>,1|O<2>,2|C<4>}	H(C[6]C[6]2)	118.5890	0.000	1	118.5890	0.000	1	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]O[6]O)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]O[6]O)(H){1|C<4>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(CH3){1|C<4>,1|H<1>,1|O<1>,1|O<2>}	H(C[6]C[6]2)	119.3427	0.591	3	119.3427	0.349	3	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]2Fe)(C[6]C[6]H)(CCCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Fe<9>,1|C<4>,2|C<3>}	C[6](C[6]C[6]2Fe)(C[6]C[6]H)(CCCH){1|C<3>,3|C<4>}	H(C[6]C[6]2)	118.7000	0.000	1	118.7000	0.000	1	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]CO)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|C<4>,1|H<1>,1|O<2>}	C[6](C[6]C[6]CO)(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|O<1>}	H(C[6]C[6]2)	118.5855	0.074	2	118.5855	0.006	2	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]CeO)(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Ce<11>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]CeO)(C[6]C[6]H)(CC3){1|C<3>,1|C<4>,1|P<4>}	H(C[6]C[6]2)	117.7303	0.149	3	117.8262	0.059	13	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]CeO)(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Ce<14>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]CeO)(C[6]C[6]H)(CC3){1|C<3>,2|C<4>}	H(C[6]C[6]2)	117.4085	0.016	2	117.8262	0.059	13	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]CeO)(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Ce<16>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]CeO)(C[6]C[6]H)(CC3){1|C<3>,1|C<4>,1|C<5>}	H(C[6]C[6]2)	117.9665	0.137	8	117.8262	0.059	13	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]CeO)(C[6]C[6]H)(CCeHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Ce<14>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]CeO)(C[6]C[6]H)(CCeHN){1|C<3>,2|C<4>}	H(C[6]C[6]2)	119.1000	0.151	2	119.1000	0.023	2	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]Cr2)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){2|Cr<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]Cr2)(C[6]C[6]H)(CH3){1|C<3>,2|C<4>}	H(C[6]C[6]2)	119.0720	0.153	4	119.0720	0.023	4	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]Cu2)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){2|Cu<2>,1|C<3>,1|H<1>}	C[6](C[6]C[6]Cu2)(C[6]C[6]H)(CH3){1|C<3>,2|C<4>}	H(C[6]C[6]2)	119.3317	0.589	14	119.3317	0.347	14	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]CuB)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Cu<6>,1|B<4>,1|C<4>,1|H<1>}	C[6](C[6]C[6]CuB)(C[6]C[6]H)(CH3){1|C<3>,2|C<4>}	H(C[6]C[6]2)	118.6400	0.000	1	118.6400	0.000	1	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]DyO)(C[6]C[6]H)(CC[6]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Dy<12>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]DyO)(C[6]C[6]H)(CC[6]HH){1|C<3>,2|C<4>}	H(C[6]C[6]2)	118.9055	0.023	2	118.9055	0.001	2	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]DyO)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Dy<15>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]DyO)(C[6]C[6]H)(CHHN){1|C<3>,1|C<4>,1|O<2>}	H(C[6]C[6]2)	119.3140	0.000	1	119.2485	0.009	2	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]DyO)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Dy<15>,1|C<4>,1|H<1>,1|O<2>}	C[6](C[6]C[6]DyO)(C[6]C[6]H)(CHHN){1|C<3>,1|C<4>,1|O<3>}	H(C[6]C[6]2)	119.1830	0.000	1	119.2485	0.009	2	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]ErO)(C[6]C[6]H)(CC[6]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Er<12>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]ErO)(C[6]C[6]H)(CC[6]HH){1|C<3>,2|C<4>}	H(C[6]C[6]2)	119.0390	0.242	3	119.0390	0.058	3	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]EuO)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Eu<15>,1|C<3>,1|H<1>,1|O<3>}	C[6](C[6]C[6]EuO)(C[6]C[6]H)(CHHN){1|C<3>,1|C<4>,1|O<3>}	H(C[6]C[6]2)	118.8685	0.342	2	118.8685	0.117	2	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]Fe2)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){2|Fe<3>,1|C<3>,1|H<1>}	C[6](C[6]C[6]Fe2)(C[6]C[6]H)(CH3){1|C<3>,2|C<4>}	H(C[6]C[6]2)	119.3725	0.217	4	119.3725	0.047	4	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]FeSi)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Fe<10>,1|Si<5>,1|C<4>,1|H<1>}	C[6](C[6]C[6]FeSi)(C[6]C[6]H)(CH3){1|C<3>,2|C<4>}	H(C[6]C[6]2)	118.6690	0.000	1	118.6690	0.000	1	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]GdO)(C[6]C[6]H)(CC[6]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Gd<12>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]GdO)(C[6]C[6]H)(CC[6]HH){1|C<3>,2|C<4>}	H(C[6]C[6]2)	119.0677	0.107	3	119.0677	0.012	3	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]GdO)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Gd<17>,1|C<4>,1|H<1>,1|O<3>}	C[6](C[6]C[6]GdO)(C[6]C[6]H)(CHHN){1|C<3>,1|C<4>,1|O<3>}	H(C[6]C[6]2)	118.8865	0.214	2	118.8865	0.046	2	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]HP)(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|P<4>,2|H<1>}	C[6](C[6]C[6]HP)(C[6]C[6]H)(CC3){1|C<3>,2|C<4>}	H(C[6]C[6]2)	118.4740	0.206	2	118.4740	0.043	2	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]HP)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|P<4>,2|H<1>}	C[6](C[6]C[6]HP)(C[6]C[6]H)(CH3){1|C<3>,2|C<4>}	H(C[6]C[6]2)	118.1215	0.043	2	118.1215	0.002	2	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]HU)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|U<17>,1|C<4>,1|H<1>,1|H<2>}	C[6](C[6]C[6]HU)(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	119.3140	0.000	1	119.4380	0.031	2	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]HU)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|U<17>,1|C<4>,2|H<1>}	C[6](C[6]C[6]HU)(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	119.5620	0.000	1	119.4380	0.031	2	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]HoN)(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Ho<14>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]HoN)(C[6]C[6]H)(CC3){1|C<3>,1|C<4>,1|C<5>}	H(C[6]C[6]2)	117.9710	0.000	1	117.8575	0.026	2	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]HoN)(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Ho<15>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]HoN)(C[6]C[6]H)(CC3){1|C<3>,1|C<4>,1|C<5>}	H(C[6]C[6]2)	117.7440	0.000	1	117.8575	0.026	2	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]LaN)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|La<22>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]LaN)(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|C<5>}	H(C[6]C[6]2)	118.6290	0.000	1	118.6290	0.000	1	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]Li2)(C[6]C[6]H)(CF3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){2|Li<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]Li2)(C[6]C[6]H)(CF3){1|C<3>,2|C<4>}	H(C[6]C[6]2)	120.6318	0.077	4	120.6318	0.006	4	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]Li2)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Li<3>,1|Li<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]Li2)(C[6]C[6]H)(CH3){1|C<3>,2|C<4>}	H(C[6]C[6]2)	119.1880	0.171	2	119.1880	0.029	2	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]Li2)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Li<3>,1|Li<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]Li2)(C[6]C[6]H)(CHHN){1|C<3>,2|C<4>}	H(C[6]C[6]2)	119.6280	0.014	2	119.6280	0.000	2	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]LuN)(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Lu<14>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]LuN)(C[6]C[6]H)(CC3){1|C<3>,1|C<4>,1|C<5>}	H(C[6]C[6]2)	117.9470	0.000	1	117.9470	0.000	1	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]LuO)(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Lu<12>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]LuO)(C[6]C[6]H)(CC3){1|C<3>,2|C<4>}	H(C[6]C[6]2)	118.6775	0.138	2	118.6775	0.019	2	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]Mn2)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){2|Mn<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]Mn2)(C[6]C[6]H)(CH3){1|C<3>,2|C<4>}	H(C[6]C[6]2)	119.5493	0.574	4	119.5493	0.330	4	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]NU)(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|U<16>,1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]NU)(C[6]C[6]H)(CC3){1|C<3>,2|C<4>}	H(C[6]C[6]2)	117.8535	0.115	2	117.8535	0.013	2	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]NU)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|U<13>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]NU)(C[6]C[6]H)(CH3){1|C<3>,2|C<4>}	H(C[6]C[6]2)	119.2645	0.886	2	119.1040	0.419	6	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]NU)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|U<15>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]NU)(C[6]C[6]H)(CH3){1|C<3>,2|C<4>}	H(C[6]C[6]2)	119.0238	0.641	4	119.1040	0.419	6	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]NV)(C[6]C[6]H)(CC[6a]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|H<1>,1|N<3>,1|V<5>}	C[6](C[6]C[6]NV)(C[6]C[6]H)(CC[6a]HH){1|C<3>,2|C<4>}	H(C[6]C[6]2)	118.9327	0.071	4	118.9327	0.005	4	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]NV)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|H<1>,1|N<3>,1|V<7>}	C[6](C[6]C[6]NV)(C[6]C[6]H)(CH3){1|C<3>,2|C<4>}	H(C[6]C[6]2)	118.9090	0.154	2	118.9090	0.024	2	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]NY)(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Y<14>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]NY)(C[6]C[6]H)(CC3){1|C<3>,1|C<4>,1|C<5>}	H(C[6]C[6]2)	117.9430	0.000	1	117.9430	0.000	1	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]N[5]Ru)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Ru<6>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[5]Ru)(C[6]C[6]H)(CH3){2|C<4>,3|C<3>}	H(C[6]C[6]2)	119.3150	0.000	1	119.3150	0.000	1	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]NiB)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Ni<5>,1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]NiB)(C[6]C[6]H)(CH3){1|C<3>,2|C<4>}	H(C[6]C[6]2)	118.8555	0.179	2	118.9383	0.037	3	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]NiB)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Ni<5>,1|B<4>,1|C<4>,1|H<1>}	C[6](C[6]C[6]NiB)(C[6]C[6]H)(CH3){1|C<3>,2|C<4>}	H(C[6]C[6]2)	119.1040	0.000	1	118.9383	0.037	3	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]NiH)(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Ni<5>,1|C<4>,2|H<1>}	C[6](C[6]C[6]NiH)(C[6]C[6]H)(CC3){1|C<4>,2|C<3>}	H(C[6]C[6]2)	119.0130	0.000	1	119.0130	0.000	1	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]OU)(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<4>,1|H<1>,1|O<2>,1|U<9>}	C[6](C[6]C[6]OU)(C[6]C[6]H)(CC3){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	117.6330	0.000	1	117.7720	0.052	3	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]OU)(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|U<12>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]OU)(C[6]C[6]H)(CC3){1|C<3>,1|C<4>,1|P<4>}	H(C[6]C[6]2)	117.6480	0.000	1	117.7720	0.052	3	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]OU)(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|U<16>,1|C<4>,1|H<1>,1|O<2>}	C[6](C[6]C[6]OU)(C[6]C[6]H)(CC3){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	118.0350	0.000	1	117.7720	0.052	3	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]OU)(C[6]C[6]H)(CC[6]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|U<10>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]OU)(C[6]C[6]H)(CC[6]HH){1|C<3>,2|C<4>}	H(C[6]C[6]2)	118.4743	0.442	18	118.4743	0.196	18	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]OU)(C[6]C[6]H)(CC[6a]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|H<1>,1|O<2>,1|U<8>}	C[6](C[6]C[6]OU)(C[6]C[6]H)(CC[6a]HH){1|C<3>,2|C<4>}	H(C[6]C[6]2)	117.9320	0.000	1	117.9320	0.000	1	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]OU)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|H<1>,1|O<2>,1|U<8>}	C[6](C[6]C[6]OU)(C[6]C[6]H)(CH3){1|C<3>,2|C<4>}	H(C[6]C[6]2)	118.8490	0.000	1	118.8490	0.000	1	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]OU)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|H<1>,1|O<2>,1|U<8>}	C[6](C[6]C[6]OU)(C[6]C[6]H)(CHHN){1|C<3>,2|C<4>}	H(C[6]C[6]2)	119.1630	0.000	1	118.8660	0.292	3	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]OU)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|U<10>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]OU)(C[6]C[6]H)(CHHN){1|C<3>,2|C<4>}	H(C[6]C[6]2)	118.7175	0.672	2	118.8660	0.292	3	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]OU)(C[6]C[6]H)(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|H<1>,1|O<2>,1|U<9>}	C[6](C[6]C[6]OU)(C[6]C[6]H)(CHHO){1|C<3>,2|C<4>}	H(C[6]C[6]2)	118.6431	0.512	8	118.8157	0.281	24	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]OU)(C[6]C[6]H)(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|U<10>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]OU)(C[6]C[6]H)(CHHO){1|C<3>,2|C<4>}	H(C[6]C[6]2)	118.9019	0.533	16	118.8157	0.281	24	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]OU)(C[6]C[6]H)(CN[6]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|H<1>,1|O<2>,1|U<8>}	C[6](C[6]C[6]OU)(C[6]C[6]H)(CN[6]HH){1|C<3>,2|C<4>}	H(C[6]C[6]2)	118.9350	0.000	1	118.9350	0.000	1	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]OV)(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|H<1>,1|O<2>,1|V<7>}	C[6](C[6]C[6]OV)(C[6]C[6]H)(CC3){1|C<3>,2|C<4>}	H(C[6]C[6]2)	118.0305	0.187	2	117.8958	0.025	5	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]OV)(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|H<1>,1|O<2>,1|V<7>}	C[6](C[6]C[6]OV)(C[6]C[6]H)(CC3){1|C<4>,2|C<3>}	H(C[6]C[6]2)	117.7960	0.066	2	117.8958	0.025	5	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]OV)(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|H<1>,1|O<2>,1|V<8>}	C[6](C[6]C[6]OV)(C[6]C[6]H)(CC3){1|C<4>,2|C<3>}	H(C[6]C[6]2)	117.8260	0.000	1	117.8958	0.025	5	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]OV)(C[6]C[6]H)(CC[6a]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|H<1>,1|O<2>,1|V<5>}	C[6](C[6]C[6]OV)(C[6]C[6]H)(CC[6a]HH){1|C<3>,2|C<4>}	H(C[6]C[6]2)	118.7345	0.158	2	118.5820	0.052	4	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]OV)(C[6]C[6]H)(CC[6a]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|H<1>,1|O<2>,1|V<6>}	C[6](C[6]C[6]OV)(C[6]C[6]H)(CC[6a]HH){1|C<3>,2|C<4>}	H(C[6]C[6]2)	118.4295	0.192	2	118.5820	0.052	4	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]OW)(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|C<4>,1|O<2>,1|W<8>}	C[6](C[6]C[6]OW)(C[6]C[6]H)(CC3){1|C<4>,2|C<3>}	H(C[6]C[6]2)	119.0820	0.577	2	118.6710	0.182	6	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]OW)(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|W<14>,1|C<4>,1|H<1>,1|O<2>}	C[6](C[6]C[6]OW)(C[6]C[6]H)(CC3){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	118.4655	0.155	4	118.6710	0.182	6	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]OY)(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Y<12>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]OY)(C[6]C[6]H)(CC3){1|C<3>,2|C<4>}	H(C[6]C[6]2)	118.1305	0.170	2	118.1305	0.029	2	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]OY)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Y<15>,1|C<3>,1|H<1>,1|O<3>}	C[6](C[6]C[6]OY)(C[6]C[6]H)(CHHN){1|C<3>,1|C<4>,1|O<3>}	H(C[6]C[6]2)	118.9370	0.000	1	118.8670	0.010	2	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]OY)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Y<15>,1|C<4>,1|H<1>,1|O<3>}	C[6](C[6]C[6]OY)(C[6]C[6]H)(CHHN){1|C<3>,1|C<4>,1|O<3>}	H(C[6]C[6]2)	118.7970	0.000	1	118.8670	0.010	2	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]PdB)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Pd<5>,1|B<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]PdB)(C[6]C[6]H)(CH3){1|C<3>,2|C<4>}	H(C[6]C[6]2)	118.4720	0.000	1	118.2027	0.061	3	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]PdB)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Pd<6>,1|B<4>,1|C<4>,1|H<1>}	C[6](C[6]C[6]PdB)(C[6]C[6]H)(CH3){1|C<3>,2|C<4>}	H(C[6]C[6]2)	118.0680	0.117	2	118.2027	0.061	3	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]PdC)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Pd<5>,1|H<1>,2|C<4>}	C[6](C[6]C[6]PdC)(C[6]C[6]H)(CH3){1|C<3>,2|C<4>}	H(C[6]C[6]2)	118.7680	0.000	1	118.7680	0.000	1	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]PdH)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Pd<6>,1|C<4>,2|H<1>}	C[6](C[6]C[6]PdH)(C[6]C[6]H)(CH3){1|C<3>,2|C<4>}	H(C[6]C[6]2)	119.1630	0.000	1	119.1630	0.000	1	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]RuO)(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Ru<10>,1|C<4>,1|H<1>,1|O<2>}	C[6](C[6]C[6]RuO)(C[6]C[6]H)(CC3){1|C<3>,1|C<4>,1|O<2>}	H(C[6]C[6]2)	117.4645	0.330	2	117.4645	0.109	2	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]SmO)(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Sm<6>,1|C<3>,1|H<1>,1|O<3>}	C[6](C[6]C[6]SmO)(C[6]C[6]H)(CC3){1|C<3>,2|C<4>}	H(C[6]C[6]2)	118.6060	0.000	1	118.6060	0.000	1	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]SmO)(C[6]C[6]H)(CC[6a]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Sm<6>,1|C<3>,1|H<1>,1|O<3>}	C[6](C[6]C[6]SmO)(C[6]C[6]H)(CC[6a]HH){1|C<3>,2|C<4>}	H(C[6]C[6]2)	119.1510	0.000	1	119.1510	0.000	1	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]TaN)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Ta<7>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]TaN)(C[6]C[6]H)(CH3){1|C<3>,2|C<4>}	H(C[6]C[6]2)	118.8975	0.156	2	118.8975	0.024	2	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]TaO)(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Ta<13>,1|C<4>,1|H<1>,1|O<2>}	C[6](C[6]C[6]TaO)(C[6]C[6]H)(CC3){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	118.1540	0.000	1	118.1917	0.113	7	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]TaO)(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Ta<8>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]TaO)(C[6]C[6]H)(CC3){1|C<4>,2|C<3>}	H(C[6]C[6]2)	118.1980	0.368	6	118.1917	0.113	7	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]ThN)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Th<15>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]ThN)(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|C<5>}	H(C[6]C[6]2)	118.6480	0.000	1	118.5842	0.059	6	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]ThN)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Th<15>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]ThN)(C[6]C[6]H)(CH3){1|C<3>,2|C<4>}	H(C[6]C[6]2)	118.5714	0.270	5	118.5842	0.059	6	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]TiO)(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Ti<10>,1|C<4>,1|H<1>,1|O<2>}	C[6](C[6]C[6]TiO)(C[6]C[6]H)(CC3){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	118.6870	0.153	2	118.0606	0.263	14	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]TiO)(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Ti<11>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]TiO)(C[6]C[6]H)(CC3){1|C<3>,2|C<4>}	H(C[6]C[6]2)	117.8060	0.040	4	118.0606	0.263	14	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]TiO)(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Ti<13>,1|C<4>,1|H<1>,1|O<2>}	C[6](C[6]C[6]TiO)(C[6]C[6]H)(CC3){1|C<3>,1|C<4>,1|O<3>}	H(C[6]C[6]2)	118.0307	0.189	3	118.0606	0.263	14	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]TiO)(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Ti<8>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]TiO)(C[6]C[6]H)(CC3){1|C<4>,2|C<3>}	H(C[6]C[6]2)	118.0250	0.871	4	118.0606	0.263	14	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]TiO)(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Ti<9>,1|C<4>,1|H<1>,1|O<2>}	C[6](C[6]C[6]TiO)(C[6]C[6]H)(CC3){1|C<3>,1|C<4>,1|O<3>}	H(C[6]C[6]2)	118.0580	0.000	1	118.0606	0.263	14	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]TiO)(C[6]C[6]H)(CC[6a]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Ti<7>,1|C<3>,1|H<1>,1|O<3>}	C[6](C[6]C[6]TiO)(C[6]C[6]H)(CC[6a]HH){1|C<3>,2|C<4>}	H(C[6]C[6]2)	118.7140	0.054	2	118.7527	0.006	3	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]TiO)(C[6]C[6]H)(CC[6a]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Ti<8>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]TiO)(C[6]C[6]H)(CC[6a]HH){1|C<3>,2|C<4>}	H(C[6]C[6]2)	118.8300	0.000	1	118.7527	0.006	3	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]TiO)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Ti<12>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]TiO)(C[6]C[6]H)(CH3){1|C<4>,2|C<3>}	H(C[6]C[6]2)	117.9510	0.994	2	117.9510	0.988	2	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]YbH)(C[6]C[6]H)(CCCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Yb<13>,1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]YbH)(C[6]C[6]H)(CCCH){3|C<4>}	H(C[6]C[6]2)	118.6070	0.000	1	118.6070	0.000	1	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]YbO)(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Yb<10>,1|C<3>,1|H<1>,1|O<3>}	C[6](C[6]C[6]YbO)(C[6]C[6]H)(CC3){1|C<3>,2|C<4>}	H(C[6]C[6]2)	118.5695	0.070	2	118.3593	0.063	4	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]YbO)(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Yb<14>,1|C<4>,1|H<1>,1|O<3>}	C[6](C[6]C[6]YbO)(C[6]C[6]H)(CC3){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	118.1490	0.083	2	118.3593	0.063	4	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]ZrH)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Zr<14>,1|C<4>,1|H<1>,1|H<2>}	C[6](C[6]C[6]ZrH)(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	119.3750	0.000	1	119.3750	0.000	1	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]ZrN)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Zr<10>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]ZrN)(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|C<5>}	H(C[6]C[6]2)	117.9820	0.000	1	117.9820	0.000	1	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]ZrO)(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Zr<10>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]ZrO)(C[6]C[6]H)(CC3){1|C<4>,2|C<3>}	H(C[6]C[6]2)	117.8930	0.000	1	117.7055	0.241	11	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]ZrO)(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Zr<12>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]ZrO)(C[6]C[6]H)(CC3){1|C<3>,1|C<4>,1|S<3>}	H(C[6]C[6]2)	117.8680	0.284	2	117.7055	0.241	11	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]ZrO)(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Zr<13>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]ZrO)(C[6]C[6]H)(CC3){1|C<3>,2|C<4>}	H(C[6]C[6]2)	117.5300	0.000	2	117.7055	0.241	11	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]ZrO)(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Zr<14>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]ZrO)(C[6]C[6]H)(CC3){1|C<4>,2|C<3>}	H(C[6]C[6]2)	118.3360	0.361	2	117.7055	0.241	11	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]ZrO)(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Zr<16>,1|C<3>,1|C<4>,1|O<2>}	C[6](C[6]C[6]ZrO)(C[6]C[6]H)(CC3){1|C<3>,1|C<4>,1|O<2>}	H(C[6]C[6]2)	117.1060	0.000	1	117.7055	0.241	11	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]ZrO)(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Zr<7>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]ZrO)(C[6]C[6]H)(CC3){1|C<4>,2|C<3>}	H(C[6]C[6]2)	116.7620	0.000	1	117.7055	0.241	11	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]ZrO)(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Zr<8>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]ZrO)(C[6]C[6]H)(CC3){1|C<4>,2|C<3>}	H(C[6]C[6]2)	117.7660	0.006	2	117.7055	0.241	11	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]ZrO)(C[6]C[6]H)(CC[6a]3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Zr<12>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]ZrO)(C[6]C[6]H)(CC[6a]3){1|C<3>,1|C<4>,1|C<5>}	H(C[6]C[6]2)	118.3320	0.000	1	118.3320	0.000	1	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]ZrO)(C[6]C[6]H)(CC[6a]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Zr<7>,1|C<3>,1|H<1>,1|O<3>}	C[6](C[6]C[6]ZrO)(C[6]C[6]H)(CC[6a]HH){1|C<3>,2|C<4>}	H(C[6]C[6]2)	119.0830	0.489	2	119.0830	0.239	2	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6a]C[6]Cr)(C[6]C[6]H)(CCCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Cr<4>,1|H<1>,2|C<3>}	C[6](C[6]C[6a]C[6]Cr)(C[6]C[6]H)(CCCH){2|C<4>,3|C<3>}	H(C[6]C[6]2)	118.9495	0.129	2	118.9495	0.017	2	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6a]C[6]H)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|C<4>,2|H<1>}	C[6](C[6]C[6a]C[6]H)(C[6]C[6]H)(CH3){2|C<4>,4|C<3>}	H(C[6]C[6]2)	118.6390	0.000	1	118.6390	0.000	1	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6a]C[6]Ni)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Ni<4>,1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6a]C[6]Ni)(C[6]C[6]H)(CH3){2|C<4>,3|C<3>}	H(C[6]C[6]2)	118.9790	0.000	1	118.9790	0.000	1	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6a]C[6]Pd)(C[6]C[6]H)(CCCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Pd<4>,1|H<1>,2|C<3>}	C[6](C[6]C[6a]C[6]Pd)(C[6]C[6]H)(CCCH){2|C<4>,3|C<3>}	H(C[6]C[6]2)	118.8197	0.119	19	118.8199	0.017	21	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6a]C[6]Pd)(C[6]C[6]H)(CCCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Pd<4>,3|C<3>}	C[6](C[6]C[6a]C[6]Pd)(C[6]C[6]H)(CCCH){2|C<4>,3|C<3>}	H(C[6]C[6]2)	118.6070	0.000	1	118.8199	0.017	21	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6a]C[6]Pd)(C[6]C[6]H)(CCCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Pd<5>,1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6a]C[6]Pd)(C[6]C[6]H)(CCCH){2|C<4>,3|C<3>}	H(C[6]C[6]2)	119.0360	0.000	1	118.8199	0.017	21	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6a]C[6]Yb)(C[6]C[6]H)(CCCH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Yb<13>,1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6a]C[6]Yb)(C[6]C[6]H)(CCCH){2|C<3>,3|C<4>}	H(C[6]C[6]2)	118.6770	0.000	1	118.6770	0.000	1	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]N[6]CH)(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<4>,1|N<4>,2|H<1>}	C[6](C[6]N[6]CH)(C[6]C[6]H)(CCHH){1|C<3>,3|C<4>}	H(C[6]C[6]2)	119.9910	0.000	1	119.9910	0.000	1	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]N[6]CH)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|N<3>,3|H<1>}	C[6](C[6]N[6]CH)(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|S<4>}	H(C[6]C[6]2)	119.4910	0.949	2	119.4910	0.900	2	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]OU)(C[6]C[6]H)(CC[6]HH)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]C)(H){1|U<10>,1|H<1>,1|O<2>,3|C<3>}	C[6](C[6]C[6]OU)(C[6]C[6]H)(CC[6]HH){1|C<4>,2|C<3>}	H(C[6]C[6]2)	118.6202	0.182	4	118.6202	0.033	4	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]C)(H)	C[6](C[6]C[6]OU)(C[6]C[6]H)(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]C)(H){1|U<10>,1|H<1>,1|O<2>,3|C<3>}	C[6](C[6]C[6]OU)(C[6]C[6]H)(CHHO){1|C<4>,2|C<3>}	H(C[6]C[6]2)	118.7398	0.441	4	118.7398	0.194	4	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H)	C[6](C[6]N[6]HH)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]C)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]N[6]HH)(C[6]C[6]H)(CH3){1|C<3>,1|N<2>,1|S<4>}	H(C[6]C[6]2)	120.0460	0.000	1	120.0460	0.000	1	118.8239	0.677	533	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:N-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]N)(H)	C[6](C[6]C[6]OV)(C[6]C[6]H)(NCCV)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<2>,1|V<6>}	C[6](C[6]C[6]OV)(C[6]C[6]H)(NCCV){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	117.6420	0.000	1	117.6420	0.000	1	119.5354	0.967	15	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:N-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]OV)(C[6]C[6]H)(NC[6]2V)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<2>,1|V<8>}	C[6](C[6]C[6]OV)(C[6]C[6]H)(NC[6]2V){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9317	0.128	8	119.6706	0.746	14	119.5354	0.967	15	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:N-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]OV)(C[6]C[6]H)(NC[6]2V)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<2>,1|V<9>}	C[6](C[6]C[6]OV)(C[6]C[6]H)(NC[6]2V){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.3225	1.289	6	119.6706	0.746	14	119.5354	0.967	15	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:P-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]P)(H)	C[6](C[6]C[6]NY)(C[6]C[6]H)(PCCY)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]P)(H){1|Y<10>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]NY)(C[6]C[6]H)(PCCY){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	118.9140	0.000	1	118.9140	0.000	1	119.4435	0.397	11	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:P-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]P)(H)	C[6](C[6]C[6]OU)(C[6]C[6]H)(PC[6a]2U)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]P)(H){1|U<12>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]OU)(C[6]C[6]H)(PC[6a]2U){1|C<3>,2|C<4>}	H(C[6]C[6]2)	119.6770	0.000	1	119.6770	0.000	1	119.4435	0.397	11	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:P-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]P)(H)	C[6](C[6]C[6]ScN)(C[6]C[6]H)(PScCC)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]P)(H){1|Sc<9>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]ScN)(C[6]C[6]H)(PScCC){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.3370	0.000	1	119.3370	0.000	1	119.4435	0.397	11	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:P-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]P)(H)	C[6](C[6]C[6]TiN)(C[6]C[6]H)(PTiCC)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]P)(H){1|Ti<7>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]TiN)(C[6]C[6]H)(PTiCC){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.4523	1.134	3	119.4523	1.286	3	119.4435	0.397	11	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:P-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](C[6]C[6]HfO)(C[6]C[6]H)(PHfCC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|Hf<13>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]HfO)(C[6]C[6]H)(PHfCC){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9850	0.000	1	119.9850	0.000	1	119.4435	0.397	11	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:P-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](C[6]C[6]LaO)(C[6]C[6]H)(PC3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|La<14>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]LaO)(C[6]C[6]H)(PC3){1|C<3>,2|H<1>}	H(C[6]C[6]2)	118.7820	0.000	1	118.7820	0.000	1	119.4435	0.397	11	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:P-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](C[6]C[6]ZrO)(C[6]C[6]H)(PC3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|Zr<14>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]ZrO)(C[6]C[6]H)(PC3){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.2810	0.000	1	119.2810	0.000	1	119.4435	0.397	11	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:P-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](C[6]C[6]ZrO)(C[6]C[6]H)(PZrCC)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|Zr<13>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]ZrO)(C[6]C[6]H)(PZrCC){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7725	0.278	2	119.7725	0.077	2	119.4435	0.397	11	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:S-4:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]S)(H)	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(SC[6a]OO)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]S)(H){1|C<3>,1|C<4>,2|H<1>}	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(SC[6a]OO){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.7795	0.320	2	119.7795	0.103	2	119.7795	0.103	2	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:Si-4:	C[6]-3:	C[6](C[6]C[6]Si)(C[6]C[6]H)(H)	C[6](C[6]N[5a]C[6]H)(C[6]C[6]H)(SiC3)	H(C[6]C[6]2)	C[6](C[6]C[6]Si)(C[6]C[6]H)(H){1|C<4>,1|N<3>,2|H<1>}	C[6](C[6]N[5a]C[6]H)(C[6]C[6]H)(SiC3){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	118.7970	0.000	1	118.7970	0.000	1	118.7970	0.000	1	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]DyO)(C[6]C[6]H)(CCHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Dy<15>,1|C<3>,1|H<1>,1|O<2>}	C[6](N[6]C[6]DyO)(C[6]C[6]H)(CCHP){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.6915	0.062	2	119.6915	0.004	2	119.7072	0.060	5	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]NdO)(C[6]C[6]H)(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Nd<15>,1|C<3>,1|H<1>,1|O<2>}	C[6](N[6]C[6]NdO)(C[6]C[6]H)(CHHP){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.5300	0.157	2	119.5300	0.025	2	119.7072	0.060	5	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	N[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6]ThO)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Th<19>,1|C<4>,1|H<1>,1|O<2>}	C[6](N[6]C[6]ThO)(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.0930	0.000	1	120.0930	0.000	1	119.7072	0.060	5	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	P[5,6,6]-4:C[6]-3:Si-4:	C[6]-3:	C[6](C[6]P[5,6,6]Si)(C[6]C[6]H)(H)	C[6](P[5,6,6]C[5,3x6]P[3,5,6]Au)(C[6]C[6]H)(SiC3)	H(C[6]C[6]2)	C[6](C[6]P[5,6,6]Si)(C[6]C[6]H)(H){1|Au<2>,1|C<4>,1|H<1>,1|P<3>}	C[6](P[5,6,6]C[5,3x6]P[3,5,6]Au)(C[6]C[6]H)(SiC3){1|H<1>,1|P<3>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	116.7230	0.000	1	116.7230	0.000	1	117.0537	0.103	3	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	P[5,6,6]-4:C[6]-3:Si-4:	C[6]-3:	C[6](C[6]P[5,6,6]Si)(C[6]C[6]H)(H)	C[6](P[5,6,6]C[5,3x6]P[3,5,6]Cu)(C[6]C[6]H)(SiC3)	H(C[6]C[6]2)	C[6](C[6]P[5,6,6]Si)(C[6]C[6]H)(H){1|Cu<3>,1|C<4>,1|H<1>,1|P<3>}	C[6](P[5,6,6]C[5,3x6]P[3,5,6]Cu)(C[6]C[6]H)(SiC3){1|H<1>,1|P<3>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	117.2190	0.204	2	117.2190	0.041	2	117.0537	0.103	3	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:C[6]-3:H-1:	P[6]-4:C[6]-3:Si-4:	C[6]-3:	C[6](C[6]P[6]Si)(C[6]C[6]H)(H)	C[6](P[6]C[6]RuO)(C[6]C[6]H)(SiC3)	H(C[6]C[6]2)	C[6](C[6]P[6]Si)(C[6]C[6]H)(H){1|Ru<8>,1|O<2>,2|C<4>}	C[6](P[6]C[6]RuO)(C[6]C[6]H)(SiC3){1|C<3>,1|P<4>,2|H<1>}	H(C[6]C[6]2)	115.9505	0.173	2	115.9505	0.030	2	115.9505	0.030	2	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:N[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]B)(H)	C[6](C[6]C[6]2H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]B)(H){1|C<3>,1|C<4>,2|H<1>}	C[6](C[6]C[6]2H)(C[6]N[6]H)(CH3){1|B<3>,1|C<4>,1|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.2175	0.206	2	118.2175	0.042	2	118.3295	0.053	11	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:N[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]C)(H)	C[6](C[6]C[6]HH)(C[6]N[6]H)(CC[6a]HH)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]C)(H){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]N[6]H)(CC[6a]HH){1|Si<3>,1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	118.3360	0.000	1	118.3360	0.000	1	118.3295	0.053	11	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:N[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]C)(H)	C[6](C[6]C[6]HH)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]C)(H){1|C<3>,3|H<1>}	C[6](C[6]C[6]HH)(C[6]N[6]H)(CH3){1|C<4>,2|C<3>}	H(C[6]C[6]N[6])	118.2055	0.156	2	118.2055	0.024	2	118.3295	0.053	11	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:N[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]C)(H)	C[6](C[6]N[6]PdO)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]C)(H){1|Pd<5>,1|N<3>,1|O<1>,1|O<2>}	C[6](C[6]N[6]PdO)(C[6]N[6]H)(CH3){1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	118.7010	0.000	1	118.7010	0.000	1	118.3295	0.053	11	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:N[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]S)(H)	C[6](C[6]C[6a]C[6]H)(C[6]N[6]H)(CCHH)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]S)(H){2|C<3>,2|H<1>}	C[6](C[6]C[6a]C[6]H)(C[6]N[6]H)(CCHH){1|H<1>,1|S<4>,3|C<3>}	H(C[6]C[6]N[6])	118.0950	0.071	2	118.0950	0.005	2	118.3295	0.053	11	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	C[6]-3:N[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(N[6]C[6]S)(H)	C[6](C[6]C[6a]C[6]H)(C[6]N[6]H)(CC[6a]HH)	H(C[6]C[6]N[6])	C[6](C[6]C[6]C)(N[6]C[6]S)(H){1|C<3>,1|C<4>,1|H<1>,1|O<1>}	C[6](C[6]C[6a]C[6]H)(C[6]N[6]H)(CC[6a]HH){1|S<4>,2|H<1>,3|C<3>}	H(C[6]C[6]N[6])	118.5173	0.160	3	118.5173	0.026	3	118.3295	0.053	11	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	N[5,6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]C)(H)	C[6](C[6]C[6a]C[6]H)(C[6]N[5,6]H)(CC[6a]HH)	H(C[6]N[5,6]C[6])	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]C)(H){1|C<3>,3|H<1>,4|C<4>}	C[6](C[6]C[6a]C[6]H)(C[6]N[5,6]H)(CC[6a]HH){1|H<1>,1|N<3>,2|C<3>,2|C<4>}	H(C[6]N[5,6]C[6])	117.1850	0.000	1	117.1850	0.000	1	117.1850	0.000	1	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	N[6,6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]C)(H)	C[6](C[6]C[5,6]CH)(C[6]N[6,6]H)(CC[6a]HH)	H(C[6]N[6,6]C[6])	C[6](N[6,6]C[6,6]C[6])(C[6]C[6]C)(H){2|C<3>,2|C<4>,4|H<1>}	C[6](C[6]C[5,6]CH)(C[6]N[6,6]H)(CC[6a]HH){2|C<3>,2|C<4>}	H(C[6]N[6,6]C[6])	117.9200	0.000	1	117.9200	0.000	1	117.9200	0.000	1	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Al)(C[6]C[6]C)(H)	C[6](C[6]C[6]HH)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Al)(C[6]C[6]C)(H){1|C<3>,3|H<1>}	C[6](C[6]C[6]HH)(C[6]N[6]H)(CH3){1|Al<4>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	116.9840	0.078	4	116.9840	0.006	4	117.2711	0.175	16	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Mg)(C[6]C[6]C)(H)	C[6](C[6]C[6]HH)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Mg)(C[6]C[6]C)(H){1|C<3>,3|H<1>}	C[6](C[6]C[6]HH)(C[6]N[6]H)(CH3){1|Mg<4>,1|C<3>,1|C<4>}	H(C[6]C[6]N[6])	116.5555	0.066	2	116.5555	0.004	2	117.2711	0.175	16	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Os)(C[6]C[6]C)(H)	C[6](C[6]N[6]OsO)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Os)(C[6]C[6]C)(H){1|Os<8>,1|N<3>,2|O<2>}	C[6](C[6]N[6]OsO)(C[6]N[6]H)(CH3){1|Os<8>,1|C<4>}	H(C[6]C[6]N[6])	117.6070	0.000	1	117.6070	0.000	1	117.2711	0.175	16	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Rh)(C[6]C[6]C)(H)	C[6](C[6]N[6]RhO)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Rh)(C[6]C[6]C)(H){1|Dy<12>,1|Rh<9>,1|N<3>,2|O<2>}	C[6](C[6]N[6]RhO)(C[6]N[6]H)(CH3){1|Rh<9>,1|C<4>}	H(C[6]C[6]N[6])	117.6000	0.189	4	117.5970	0.021	8	117.2711	0.175	16	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]Rh)(C[6]C[6]C)(H)	C[6](C[6]N[6]RhO)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Rh)(C[6]C[6]C)(H){1|Er<12>,1|Rh<9>,1|N<3>,2|O<2>}	C[6](C[6]N[6]RhO)(C[6]N[6]H)(CH3){1|Rh<9>,1|C<4>}	H(C[6]C[6]N[6])	117.5940	0.115	4	117.5970	0.021	8	117.2711	0.175	16	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:4:	3:	N[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6a]C[6])(C[6]C[6]C)(H)	C[6](C[6]C[6a]C[6]H)(C[6]N[6]H)(CCCH)	H(C[6]C[6]N[6])	C[6](N[6]C[6a]C[6])(C[6]C[6]C)(H){2|C<4>,2|H<1>,3|C<3>}	C[6](C[6]C[6a]C[6]H)(C[6]N[6]H)(CCCH){1|C<4>,1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]N[6])	116.9080	0.000	1	116.9080	0.000	1	117.2711	0.175	16	118.7511	0.800	769	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:5:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-5:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]CeO)(C[6]C[6]H)(CCeHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Ce<16>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]CeO)(C[6]C[6]H)(CCeHHN){1|C<3>,2|C<4>}	H(C[6]C[6]2)	119.1759	0.153	8	119.1759	0.023	8	119.0548	0.084	10	119.0548	0.084	10	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:5:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-5:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]ThN)(C[6]C[6]H)(CThH3)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Th<15>,1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]ThN)(C[6]C[6]H)(CThH3){1|C<3>,2|C<4>}	H(C[6]C[6]2)	118.5320	0.000	1	118.5320	0.000	1	119.0548	0.084	10	119.0548	0.084	10	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:3:5:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-3:C-5:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]ZrO)(C[6]C[6]H)(CZrHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|Zr<12>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]ZrO)(C[6]C[6]H)(CZrHHN){1|C<3>,2|C<4>}	H(C[6]C[6]2)	118.6090	0.000	1	118.6090	0.000	1	119.0548	0.084	10	119.0548	0.084	10	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:4:3:	3:	C[6]-3:C[6]-3:H-1:	B-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6]B)(C[6]C[6]H)(H)	C[6](BC[6a]2C[6])(C[6]C[6]DyH)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]B)(C[6]C[6]H)(H){1|Dy<16>,1|C<4>,1|H<1>,1|H<2>}	C[6](BC[6a]2C[6])(C[6]C[6]DyH)(C[6]C[6]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	118.8127	0.321	4	118.8127	0.103	4	118.7826	0.077	8	119.1324	1.855	54	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:4:3:	3:	C[6]-3:C[6]-3:H-1:	B-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6]B)(C[6]C[6]H)(H)	C[6](BC[6a]2C[6])(C[6]C[6]TbH)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]B)(C[6]C[6]H)(H){1|Tb<16>,1|C<4>,1|H<1>,1|H<2>}	C[6](BC[6a]2C[6])(C[6]C[6]TbH)(C[6]C[6]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	118.7525	0.271	4	118.7525	0.073	4	118.7826	0.077	8	119.1324	1.855	54	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:4:3:	3:	C[6]-3:C[6]-3:H-1:	C-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](CC[6a]C[6]H)(C[6]C[6]OV)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){1|C<3>,1|H<1>,1|O<2>,1|V<7>}	C[6](CC[6a]C[6]H)(C[6]C[6]OV)(C[6]C[6]H){1|C<3>,2|C<4>}	H(C[6]C[6]2)	118.9970	0.079	2	118.9970	0.006	2	118.9970	0.006	2	119.1324	1.855	54	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:4:3:	3:	C[6]-3:C[6]-3:H-1:	C[3,6]-4:C-4:C[6]-3:	C[6]-3:	C[6](C[6]C[3,6]C)(C[6]C[6]O)(H)	C[6](C[3,6]C[3]C[6]O[3])(CC[5,6]HH)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[3,6]C)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|H<1>,1|O<2>}	C[6](C[3,6]C[3]C[6]O[3])(CC[5,6]HH)(C[6]C[6]H){1|C<3>,1|C<4>,1|O<1>,2|H<1>}	H(C[6]C[6]2)	118.2890	0.000	1	118.2890	0.000	1	118.2890	0.000	1	119.1324	1.855	54	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:4:3:	3:	C[6]-3:C[6]-3:H-1:	C[3x6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[3x6]C[5])(C[6]C[6]O)(H)	C[6](C[3x6]C[3x6]2H)(C[5]C[5]2C)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[3x6]C[5])(C[6]C[6]O)(H){1|H<1>,1|O<2>,6|C<4>}	C[6](C[3x6]C[3x6]2H)(C[5]C[5]2C)(C[6]C[6]H){1|O<1>,2|C<3>,4|H<1>,6|C<4>}	H(C[6]C[6]2)	124.4560	0.000	1	124.4560	0.000	1	124.4560	0.000	1	119.1324	1.855	54	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:4:3:	3:	C[6]-3:C[6]-3:H-1:	C[3x6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[3x6]C[6])(C[6]C[6]C)(H)	C[6](C[3x6]C[6,6]3)(C[6]C[6]DyO)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[3x6]C[6])(C[6]C[6]C)(H){1|Dy<12>,1|C<3>,1|H<1>,1|O<2>,3|C<4>}	C[6](C[3x6]C[6,6]3)(C[6]C[6]DyO)(C[6]C[6]H){1|C<3>,5|C<4>,6|H<1>}	H(C[6]C[6]2)	117.9510	0.137	3	117.9510	0.019	3	118.0745	0.047	11	119.1324	1.855	54	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:4:3:	3:	C[6]-3:C[6]-3:H-1:	C[3x6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[3x6]C[6])(C[6]C[6]C)(H)	C[6](C[3x6]C[6,6]3)(C[6]C[6]ErO)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[3x6]C[6])(C[6]C[6]C)(H){1|Er<12>,1|C<3>,1|H<1>,1|O<2>,3|C<4>}	C[6](C[3x6]C[6,6]3)(C[6]C[6]ErO)(C[6]C[6]H){1|C<3>,5|C<4>,6|H<1>}	H(C[6]C[6]2)	118.1030	0.267	3	118.1030	0.071	3	118.0745	0.047	11	119.1324	1.855	54	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:4:3:	3:	C[6]-3:C[6]-3:H-1:	C[3x6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[3x6]C[6])(C[6]C[6]C)(H)	C[6](C[3x6]C[6,6]3)(C[6]C[6]GdO)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[3x6]C[6])(C[6]C[6]C)(H){1|Gd<12>,1|C<3>,1|H<1>,1|O<2>,3|C<4>}	C[6](C[3x6]C[6,6]3)(C[6]C[6]GdO)(C[6]C[6]H){1|C<3>,5|C<4>,6|H<1>}	H(C[6]C[6]2)	118.2203	0.195	3	118.2203	0.038	3	118.0745	0.047	11	119.1324	1.855	54	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:4:3:	3:	C[6]-3:C[6]-3:H-1:	C[3x6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[3x6]C[6])(C[6]C[6]C)(H)	C[6](C[3x6]C[6,6]3)(C[6]C[6]TiO)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[3x6]C[6])(C[6]C[6]C)(H){1|Ti<7>,1|C<3>,1|H<1>,1|O<2>,3|C<4>}	C[6](C[3x6]C[6,6]3)(C[6]C[6]TiO)(C[6]C[6]H){2|C<3>,4|C<4>,6|H<1>}	H(C[6]C[6]2)	117.9985	0.298	2	117.9985	0.089	2	118.0745	0.047	11	119.1324	1.855	54	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:4:3:	3:	C[6]-3:C[6]-3:H-1:	C[4]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[4]C[6])(C[6]C[6]O)(H)	C[6](C[4]C[4]2H)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[4]C[6])(C[6]C[6]O)(H){3|C<4>,5|H<1>}	C[6](C[4]C[4]2H)(C[6]C[6]HH)(C[6]C[6]H){1|C<3>,1|O<1>,2|C<4>,5|H<1>}	H(C[6]C[6]2)	118.1750	0.000	1	118.1750	0.000	1	118.3085	0.036	2	119.1324	1.855	54	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:4:3:	3:	C[6]-3:C[6]-3:H-1:	C[4]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[4]C[6])(C[6]C[6]O)(H)	C[6](C[4]C[4]2O)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[4]C[6])(C[6]C[6]O)(H){1|O<2>,3|C<4>,4|H<1>}	C[6](C[4]C[4]2O)(C[6]C[6]HH)(C[6]C[6]H){1|O<1>,4|C<4>,4|H<1>}	H(C[6]C[6]2)	118.4420	0.000	1	118.4420	0.000	1	118.3085	0.036	2	119.1324	1.855	54	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:4:3:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[5,6]C[6])(C[6]C[5,6]O)(H)	C[6](C[5,6]O[5,6]C[5]H)(C[6]C[6]2H)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C[6])(C[6]C[5,6]O)(H){1|O<2>,3|H<1>,4|C<4>}	C[6](C[5,6]O[5,6]C[5]H)(C[6]C[6]2H)(C[6]C[6]H){1|O<1>,1|O<2>,3|H<1>,6|C<4>}	H(C[6]C[6]2)	120.2300	0.000	1	120.2300	0.000	1	119.5945	0.808	2	119.1324	1.855	54	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:4:3:	3:	C[6]-3:C[6]-3:H-1:	C[5,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[5,6]C[6])(C[6]C[6]O)(H)	C[6](C[5,6]C[3,5,6]C[5,6,6]H)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C[6])(C[6]C[6]O)(H){3|C<4>,5|H<1>}	C[6](C[5,6]C[3,5,6]C[5,6,6]H)(C[6]C[6]HH)(C[6]C[6]H){1|H<1>,1|O<1>,3|C<3>,5|C<4>}	H(C[6]C[6]2)	118.9590	0.000	1	118.9590	0.000	1	119.5945	0.808	2	119.1324	1.855	54	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:4:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6]C)(H)	C[6](C[5]C[5,6]C[5]Ti)(C[6]C[6]TiO)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6]C)(H){1|Ti<11>,1|C<3>,1|H<1>,1|O<2>,2|C<4>}	C[6](C[5]C[5,6]C[5]Ti)(C[6]C[6]TiO)(C[6]C[6]H){1|H<1>,2|C<3>,4|C<4>}	H(C[6]C[6]2)	120.3110	0.000	2	120.1305	0.043	4	119.7849	0.185	8	119.1324	1.855	54	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:4:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6]C)(H)	C[6](C[5]C[5,6]C[5]Ti)(C[6]C[6]TiO)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6]C)(H){1|Ti<11>,1|C<3>,1|H<1>,1|O<2>,2|C<4>}	C[6](C[5]C[5,6]C[5]Ti)(C[6]C[6]TiO)(C[6]C[6]H){2|C<3>,5|C<4>}	H(C[6]C[6]2)	119.9500	0.000	2	120.1305	0.043	4	119.7849	0.185	8	119.1324	1.855	54	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:4:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6]C)(H)	C[6](C[5]C[5,6]C[5]Zr)(C[6]C[6]ZrO)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6]C)(H){1|Zr<13>,1|C<3>,1|H<1>,1|O<2>,2|C<4>}	C[6](C[5]C[5,6]C[5]Zr)(C[6]C[6]ZrO)(C[6]C[6]H){1|H<1>,2|C<3>,4|C<4>}	H(C[6]C[6]2)	119.4950	0.000	2	119.4950	0.000	2	119.7849	0.185	8	119.1324	1.855	54	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:4:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6]C)(H)	C[6](C[5]N[5a]N[5]2)(C[6]C[6]CH)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6]C)(H){1|C<3>,1|C<4>,1|N<3>,2|H<1>,2|N<2>}	C[6](C[5]N[5a]N[5]2)(C[6]C[6]CH)(C[6]C[6]H){1|C<4>,1|H<1>,5|C<3>}	H(C[6]C[6]2)	119.0690	0.000	1	119.0690	0.000	1	119.7849	0.185	8	119.1324	1.855	54	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:4:3:	3:	C[6]-3:C[6]-3:H-1:	C[5]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H)	C[6](C[5]C[5]2H)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H){1|C<3>,2|C<4>,4|H<1>}	C[6](C[5]C[5]2H)(C[6]C[6]HH)(C[6]C[6]H){1|C<4>,1|N<3>,2|C<3>,5|H<1>}	H(C[6]C[6]2)	119.6980	0.000	1	119.6980	0.000	1	119.7849	0.185	8	119.1324	1.855	54	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:4:3:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6]C[5])(C[6]C[6]H)(H)	C[6](C[6,6]C[6,6]N[6]Zr)(C[5]C[5,5]C[5]Zr)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]C[5])(C[6]C[6]H)(H){1|Zr<11>,1|C<3>,1|H<1>,1|N<3>,2|C<4>}	C[6](C[6,6]C[6,6]N[6]Zr)(C[5]C[5,5]C[5]Zr)(C[6]C[6]H){1|C<3>,1|C<5>,1|H<1>,1|S<2>,4|C<4>}	H(C[6]C[6]2)	116.8010	0.000	1	116.8010	0.000	1	116.8010	0.000	1	119.1324	1.855	54	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:4:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6]H)(H)	C[6](C[6]C[6]2Pr)(C[6]C[6]PrO)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6]H)(H){1|Pr<17>,1|C<3>,1|H<1>,1|O<2>,2|C<4>}	C[6](C[6]C[6]2Pr)(C[6]C[6]PrO)(C[6]C[6]H){2|C<3>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	118.8150	0.000	1	118.8465	0.002	2	120.0778	2.525	5	119.1324	1.855	54	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:4:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6]H)(H)	C[6](C[6]C[6]2Pr)(C[6]C[6]PrO)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6]H)(H){1|Pr<17>,1|C<4>,1|H<1>,1|O<2>,2|C<3>}	C[6](C[6]C[6]2Pr)(C[6]C[6]PrO)(C[6]C[6]H){1|C<4>,1|H<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	118.8780	0.000	1	118.8465	0.002	2	120.0778	2.525	5	119.1324	1.855	54	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:4:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6]H)(H)	C[6](C[6]C[6]2Th)(C[6]C[6]ThO)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6]H)(H){1|Th<12>,1|C<3>,1|H<1>,1|O<2>,2|C<4>}	C[6](C[6]C[6]2Th)(C[6]C[6]ThO)(C[6]C[6]H){1|H<1>,2|C<3>,4|C<4>}	H(C[6]C[6]2)	119.7780	0.000	1	119.7780	0.000	1	120.0778	2.525	5	119.1324	1.855	54	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:4:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6]H)(H)	C[6](C[6]C[6]HO)(C[6]S[6]2H)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6]H)(H){1|C<4>,1|O<2>,1|S<2>,1|S<3>,3|H<1>}	C[6](C[6]C[6]HO)(C[6]S[6]2H)(C[6]C[6]H){1|C<3>,1|O<1>,1|O<2>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	122.7160	0.000	1	122.7160	0.000	1	120.0778	2.525	5	119.1324	1.855	54	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:4:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6]2)(C[6]C[6]H)(H)	C[6](C[6]C[6]LiNi)(C[6]C[6]2Li)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]2)(C[6]C[6]H)(H){1|Li<5>,1|Ni<7>,1|C<4>,1|H<1>,2|C<3>}	C[6](C[6]C[6]LiNi)(C[6]C[6]2Li)(C[6]C[6]H){3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.2020	0.000	1	120.2020	0.000	1	120.0778	2.525	5	119.1324	1.855	54	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:4:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:P-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]P)(H)	C[6](C[6]C[6]CeO)(PC[6a]2Ce)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]P)(H){1|Ce<11>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]CeO)(PC[6a]2Ce)(C[6]C[6]H){1|C<3>,2|C<4>}	H(C[6]C[6]2)	119.6170	0.198	3	119.6170	0.039	3	119.6086	0.075	7	119.1324	1.855	54	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:4:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:P-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](C[6]C[6]HH)(PC[6a]2Ru)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<3>,3|H<1>}	C[6](C[6]C[6]HH)(PC[6a]2Ru)(C[6]C[6]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9900	0.000	1	119.9900	0.000	1	119.6086	0.075	7	119.1324	1.855	54	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:4:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:P-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](C[6]C[6]HH)(PC[6a]AgC)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<3>,3|H<1>}	C[6](C[6]C[6]HH)(PC[6a]AgC)(C[6]C[6]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.6355	0.097	2	119.6355	0.009	2	119.6086	0.075	7	119.1324	1.855	54	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:4:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-4:P-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]P)(H)	C[6](C[6]C[6]HH)(PC[6a]RhC)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]P)(H){1|C<3>,3|H<1>}	C[6](C[6]C[6]HH)(PC[6a]RhC)(C[6]C[6]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.1480	0.000	1	119.1480	0.000	1	119.6086	0.075	7	119.1324	1.855	54	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:4:3:	3:	C[6]-3:C[6]-3:H-1:	N-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	C[6](NC[6a]C[6]W)(C[6]C[6]OW)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|W<10>,1|C<3>,1|H<1>,1|O<2>}	C[6](NC[6a]C[6]W)(C[6]C[6]OW)(C[6]C[6]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1755	0.357	2	120.1755	0.128	2	120.1755	0.128	2	119.1324	1.855	54	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:4:3:	3:	C[6]-3:N[6]-3:H-1:	C[6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(N[6]C[6]C)(H)	C[6](C[6]C[6a]C[6]H)(C[5]C[5]N[5]H)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[5]C[6])(N[6]C[6]C)(H){1|C<4>,1|N<3>,2|C<3>,3|H<1>}	C[6](C[6]C[6a]C[6]H)(C[5]C[5]N[5]H)(C[6]N[6]H){3|C<4>,3|H<1>,4|C<3>}	H(C[6]C[6]N[6])	122.6880	0.000	1	122.6880	0.000	1	122.6880	0.000	1	119.1324	1.855	54	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:4:3:	3:	N[6,6]-3:C[6]-3:H-1:	C[6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](N[6,6]C[3x6]C[6,6])(C[6]C[6]2)(H)	C[6](C[6]C[6,6]N[6,6]H)(C[6]C[6,6]HH)(C[6]N[6,6]H)	H(C[6]N[6,6]C[6])	C[6](N[6,6]C[3x6]C[6,6])(C[6]C[6]2)(H){2|N<3>,4|C<4>,5|H<1>}	C[6](C[6]C[6,6]N[6,6]H)(C[6]C[6,6]HH)(C[6]N[6,6]H){2|H<1>,7|C<4>}	H(C[6]N[6,6]C[6])	117.2750	0.000	1	117.2750	0.000	1	117.2513	0.001	3	119.1324	1.855	54	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	4:4:3:	3:	N[6,6]-3:C[6]-3:H-1:	C[6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](N[6,6]C[3x6]C[6])(C[6]C[6]2)(H)	C[6](C[6]N[6,6]C[6]H)(C[6]C[6,6]HH)(C[6]N[6,6]H)	H(C[6]N[6,6]C[6])	C[6](N[6,6]C[3x6]C[6])(C[6]C[6]2)(H){1|N<3>,4|C<4>,6|H<1>}	C[6](C[6]N[6,6]C[6]H)(C[6]C[6,6]HH)(C[6]N[6,6]H){3|H<1>,6|C<4>}	H(C[6]N[6,6]C[6])	117.2395	0.016	2	117.2395	0.000	2	117.2513	0.001	3	119.1324	1.855	54	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	5:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-5:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6,6]C[6,6]B[6]Li2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){2|Li<7>,1|B<5>,1|C<5>,1|H<1>}	C[6](C[6,6]C[6,6]B[6]Li2)(C[6]C[6]H)(H){1|B<5>,1|C<5>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.9700	0.184	2	119.9258	0.021	6	119.9258	0.021	6	120.0171	0.598	17	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	5:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6,6]-5:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6,6]C[6,6]B[6]Li2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){2|Li<8>,1|B<5>,1|C<5>,1|H<1>}	C[6](C[6,6]C[6,6]B[6]Li2)(C[6]C[6]H)(H){1|B<5>,1|C<3>,1|C<5>,2|H<1>}	H(C[6]C[6]2)	119.9038	0.148	4	119.9258	0.021	6	119.9258	0.021	6	120.0171	0.598	17	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	5:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-5:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]OYY)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){2|Y<14>,1|O<3>,2|C<3>}	C[6](C[6]C[6,6]OYY)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8600	0.000	1	119.8600	0.000	1	120.0669	0.939	11	120.0171	0.598	17	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	5:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-5:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]Yb2O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){2|Yb<14>,1|O<3>,2|C<3>}	C[6](C[6]C[6,6]Yb2O)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.4820	0.000	1	119.4820	0.000	1	120.0669	0.939	11	120.0171	0.598	17	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	5:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-5:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]Li3)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Li<3>,1|Si<4>,2|Li<5>,1|C<5>}	C[6](C[6]C[6]Li3)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<3>}	H(C[6]C[6]2)	122.7010	0.000	1	122.7010	0.000	1	120.0669	0.939	11	120.0171	0.598	17	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	5:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-5:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]Ru3)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Ru<5>,2|Ru<6>,1|C<5>,1|H<1>}	C[6](C[6]C[6]Ru3)(C[6]C[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.0065	0.151	2	120.1317	0.081	4	120.0669	0.939	11	120.0171	0.598	17	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	5:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-5:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]C[6]Ru3)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){3|Ru<6>,1|C<5>,1|H<1>}	C[6](C[6]C[6]Ru3)(C[6]C[6]H)(H){1|Ru<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.2570	0.399	2	120.1317	0.081	4	120.0669	0.939	11	120.0171	0.598	17	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	5:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-5:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]Ru3)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){3|Ru<9>,1|H<1>,1|N<4>}	C[6](C[6]N[6]Ru3)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.7190	0.000	1	119.7190	0.000	1	120.0669	0.939	11	120.0171	0.598	17	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	5:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-5:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]ThCH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Th<17>,1|H<1>,1|N<3>,2|C<4>}	C[6](C[6]N[6]ThCH)(C[6]C[6]H)(H){1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.3700	0.000	1	119.4823	0.330	3	120.0669	0.939	11	120.0171	0.598	17	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	5:3:1:	3:	C[6]-3:C[6]-3:H-1:	C[6]-5:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]H)2(H)	C[6](C[6]N[6]ThCH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)2(H){1|Th<21>,1|C<4>,1|C<5>,1|H<1>,1|N<3>}	C[6](C[6]N[6]ThCH)(C[6]C[6]H)(H){1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.5385	0.801	2	119.4823	0.330	3	120.0669	0.939	11	120.0171	0.598	17	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	5:3:3:	3:	C[6]-3:C[6]-3:H-1:	C-5:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	C[6](CC[6a]C[6]ReO)(N[6]C[6]Re)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Re<7>,1|C<3>,1|H<1>}	C[6](CC[6a]C[6]ReO)(N[6]C[6]Re)(C[6]C[6]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.8410	0.014	2	120.8410	0.000	2	120.8410	0.000	2	119.7243	0.911	31	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	5:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[3x3,3x5,12x6]-5:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[3x3,3x5,12x6]N[6])(C[6]C[6]H)(H)	C[6](C[3x3,3x5,12x6]B[3x3,3x5,12x6]B[5x3,3x5,11x6]2C[3x3,3x5,12x6])(C[6]C[6]H)(N[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[3x3,3x5,12x6]N[6])(C[6]C[6]H)(H){1|B<5>,1|C<3>,1|C<5>,2|B<6>,2|H<1>}	C[6](C[3x3,3x5,12x6]B[3x3,3x5,12x6]B[5x3,3x5,11x6]2C[3x3,3x5,12x6])(C[6]C[6]H)(N[6]C[6]H){1|B<5>,1|C<3>,4|B<6>,6|H<1>}	H(C[6]C[6]2)	122.1880	0.000	1	122.1880	0.000	1	122.1880	0.000	1	119.7243	0.911	31	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	5:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[3x3,3x5,12x6]-5:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[3x3,3x5,12x6]N[6])(C[6]C[6]H)(H)	C[6](C[3x3,3x5,12x6]B[3x3,3x5,12x6]B[5x3,3x5,11x6]2C[3x3,3x5,12x6])(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[3x3,3x5,12x6]N[6])(C[6]C[6]H)(H){1|Ir<7>,1|C<3>,1|C<5>,1|H<1>,3|B<6>}	C[6](C[3x3,3x5,12x6]B[3x3,3x5,12x6]B[5x3,3x5,11x6]2C[3x3,3x5,12x6])(N[6]C[6]Ir)(C[6]C[6]H){1|C<3>,1|H<2>,5|B<6>,5|H<1>}	H(C[6]C[6]2)	120.3260	0.000	1	120.3260	0.000	1	120.3260	0.000	1	119.7243	0.911	31	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	5:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[3x3,4,3x5,14x6]-5:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[3x3,4,3x5,14x6]C[6])(C[6]C[5,6]H)(H)	C[6](C[3x3,4,3x5,14x6]B[4x3,4,5x5,21x6]2B[5x3,4x5,17x6]2)(C[6]N[5,6]H)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[3x3,4,3x5,14x6]C[6])(C[6]C[5,6]H)(H){1|C<3>,1|H<1>,1|N<3>,4|B<6>}	C[6](C[3x3,4,3x5,14x6]B[4x3,4,5x5,21x6]2B[5x3,4x5,17x6]2)(C[6]N[5,6]H)(C[6]C[6]H){1|B<4>,1|C<3>,1|C<5>,5|B<6>,5|H<1>}	H(C[6]C[6]2)	119.8540	0.000	1	119.8540	0.000	1	119.8573	0.156	7	119.7243	0.911	31	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	5:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[3x3,4,3x5,14x6]-5:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[3x3,4,3x5,14x6]C[6])(C[6]C[5a]N[6])(H)	C[6](C[3x3,4,3x5,14x6]B[4x3,4,5x5,21x6]2B[5x3,4x5,17x6]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[3x3,4,3x5,14x6]C[6])(C[6]C[5a]N[6])(H){1|Ir<6>,1|H<1>,1|S<2>,2|C<3>,4|B<6>}	C[6](C[3x3,4,3x5,14x6]B[4x3,4,5x5,21x6]2B[5x3,4x5,17x6]2)(C[6]C[6]H)2{1|C<3>,1|C<5>,1|N<3>,5|B<6>,5|H<1>}	H(C[6]C[6]2)	119.4080	0.337	2	119.4080	0.113	2	119.8573	0.156	7	119.7243	0.911	31	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	5:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[3x3,4,3x5,14x6]-5:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[3x3,4,3x5,14x6]C[6])(C[6]C[6]N[6])(H)	C[6](C[3x3,4,3x5,14x6]B[4x3,4,5x5,21x6]2B[5x3,4x5,17x6]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[3x3,4,3x5,14x6]C[6])(C[6]C[6]N[6])(H){1|Ir<6>,1|H<1>,1|N<3>,2|C<3>,4|B<6>}	C[6](C[3x3,4,3x5,14x6]B[4x3,4,5x5,21x6]2B[5x3,4x5,17x6]2)(C[6]C[6]H)2{1|C<3>,1|C<5>,1|N<3>,5|B<6>,5|H<1>}	H(C[6]C[6]2)	119.9700	0.000	1	119.9700	0.000	1	119.8573	0.156	7	119.7243	0.911	31	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	5:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[3x3,4,3x5,14x6]-5:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[3x3,4,3x5,14x6]C[6])(C[6]N[6]H)(H)	C[6](C[3x3,4,3x5,14x6]B[4x3,4,5x5,21x6]2B[5x3,4x5,17x6]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[3x3,4,3x5,14x6]C[6])(C[6]N[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>,4|B<6>}	C[6](C[3x3,4,3x5,14x6]B[4x3,4,5x5,21x6]2B[5x3,4x5,17x6]2)(C[6]C[6]H)2{1|C<3>,1|C<5>,1|N<3>,5|B<6>,5|H<1>}	H(C[6]C[6]2)	120.1203	0.317	3	120.1203	0.100	3	119.8573	0.156	7	119.7243	0.911	31	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	5:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[3x3,4,3x5,14x6]-5:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[3x3,4,3x5,14x6]N[6])(C[6]C[6]H)(H)	C[6](C[3x3,4,3x5,14x6]B[4x3,4,5x5,21x6]2B[5x3,4x5,17x6]2)(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[3x3,4,3x5,14x6]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|C<3>,1|H<1>,4|B<6>}	C[6](C[3x3,4,3x5,14x6]B[4x3,4,5x5,21x6]2B[5x3,4x5,17x6]2)(N[6]C[6]Ir)(C[6]C[6]H){1|C<3>,1|C<5>,5|B<6>,6|H<1>}	H(C[6]C[6]2)	118.9080	0.000	1	118.9080	0.000	1	118.9080	0.000	1	119.7243	0.911	31	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	5:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-5:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]Dy2O)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){2|Dy<15>,1|C<3>,1|H<1>,1|O<3>}	C[6](C[6]C[6]Dy2O)(C[6]C[6]H)(CHN){1|C<4>,2|C<3>}	H(C[6]C[6]2)	118.5150	0.315	2	118.5150	0.099	2	118.5499	0.051	8	119.7243	0.911	31	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	5:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-5:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]Ho2O)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){2|Ho<15>,1|C<3>,1|H<1>,1|O<3>}	C[6](C[6]C[6]Ho2O)(C[6]C[6]H)(CHN){1|C<4>,2|C<3>}	H(C[6]C[6]2)	118.7950	0.156	2	118.7950	0.024	2	118.5499	0.051	8	119.7243	0.911	31	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	5:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-5:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]Tb2O)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){2|Tb<14>,1|C<3>,1|H<1>,1|O<3>}	C[6](C[6]C[6]Tb2O)(C[6]C[6]H)(CHN){1|C<4>,2|C<3>}	H(C[6]C[6]2)	118.3395	0.156	2	118.4447	0.023	4	118.5499	0.051	8	119.7243	0.911	31	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	5:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6]-5:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]C)2(H)	C[6](C[6]C[6]Tb2O)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]C)2(H){2|Tb<15>,1|C<3>,1|H<1>,1|O<3>}	C[6](C[6]C[6]Tb2O)(C[6]C[6]H)(CHN){1|C<4>,2|C<3>}	H(C[6]C[6]2)	118.5500	0.023	2	118.4447	0.023	4	118.5499	0.051	8	119.7243	0.911	31	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	5:3:3:	3:	C[6]-3:C[6]-3:H-1:	P-5:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6]H)(C[6]N[6]P)(H)	C[6](PC[6a]2FF)(C[6]C[6]H)(N[6]C[6]C)	H(C[6]C[6]2)	C[6](C[6]C[6]H)(C[6]N[6]P)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](PC[6a]2FF)(C[6]C[6]H)(N[6]C[6]C){1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7870	0.000	1	119.7870	0.000	1	119.7870	0.000	1	119.7243	0.911	31	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	5:3:3:	3:	C[6]-3:C[6]-3:H-1:	Si-5:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[6]Si)(C[6]C[6]H)(H)	C[6](SiC[6]PtCO)(N[6]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[6]Si)(C[6]C[6]H)(H){1|Pt<7>,1|C<3>,1|H<1>}	C[6](SiC[6]PtCO)(N[6]C[6]Pt)(C[6]C[6]H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.3107	0.200	8	120.3107	0.040	8	120.3121	0.035	9	119.7243	0.911	31	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	5:3:3:	3:	C[6]-3:C[6]-3:H-1:	Si-5:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[6]Si)(C[6]C[6]H)(H)	C[6](SiC[6a]C[6]2Cu)(N[6]C[6]Cu)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[6]Si)(C[6]C[6]H)(H){1|Cu<5>,1|C<3>,1|H<1>}	C[6](SiC[6a]C[6]2Cu)(N[6]C[6]Cu)(C[6]C[6]H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.3230	0.000	1	120.3230	0.000	1	120.3121	0.035	9	119.7243	0.911	31	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	5:3:3:	3:	C[6]-3:N[5,6]-3:H-1:	C[3x3,4,3x5,14x6]-5:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[3x3,4,3x5,14x6]C[6])(N[5,6]C[5,6]B[5])(H)	C[6](C[3x3,4,3x5,14x6]B[4x3,4,5x5,21x6]2B[5x3,4x5,17x6]2)(C[6]N[5,6]H)(C[6]C[6]H)	H(C[6]N[5,6]C[6])	C[6](C[6]C[3x3,4,3x5,14x6]C[6])(N[5,6]C[5,6]B[5])(H){1|H<1>,2|C<4>,3|C<3>,4|B<6>}	C[6](C[3x3,4,3x5,14x6]B[4x3,4,5x5,21x6]2B[5x3,4x5,17x6]2)(C[6]N[5,6]H)(C[6]C[6]H){1|B<4>,1|C<3>,1|C<5>,5|B<6>,5|H<1>}	H(C[6]N[5,6]C[6])	118.3530	0.000	1	118.3530	0.000	1	118.3530	0.000	1	119.7243	0.911	31	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	5:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-5:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]Dy2O)(C[6]C[6]H)(CDyHO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){2|Dy<16>,1|C<3>,1|H<1>,1|O<3>}	C[6](C[6]C[6]Dy2O)(C[6]C[6]H)(CDyHO){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.2430	0.382	2	119.2430	0.146	2	119.2428	0.049	4	119.1536	0.077	5	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	5:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-5:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]Gd2O)(C[6]C[6]H)(CGdHO)	H(C[6]C[6]2)	C[6](C[6]C[6]C)(C[6]C[6]H)(H){2|Gd<16>,1|C<3>,1|H<1>,1|O<3>}	C[6](C[6]C[6]Gd2O)(C[6]C[6]H)(CGdHO){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.2425	0.046	2	119.2425	0.002	2	119.2428	0.049	4	119.1536	0.077	5	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	5:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[6]-5:C[6]-3:Si-4:	C[6]-3:	C[6](C[6]C[6]Si)(C[6]C[6]H)(H)	C[6](C[6]C[6]Li2S)(C[6]C[6]H)(SiC3)	H(C[6]C[6]2)	C[6](C[6]C[6]Si)(C[6]C[6]H)(H){2|Li<5>,1|C<5>,1|H<1>,1|S<3>}	C[6](C[6]C[6]Li2S)(C[6]C[6]H)(SiC3){1|Li<3>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	118.7970	0.000	1	118.7970	0.000	1	118.7970	0.000	1	119.1536	0.077	5	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	6:3:1:	3:	C[6]-3:C[6,6a]-3:H-1:	C[5x3,5x5,21x6]-6:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5x3,5x5,21x6]H)(C[6,6a]C[6,6a]C[6a])(H)	C[6](C[5x3,5x5,21x6]B[5x3,5x5,20x6]3B[5x3,5x5,21x6]C[5x3,5x5,20x6])(C[6]C[6,6a]H)(H)	H(C[6]C[6,6a]C[6])	C[6](C[6]C[5x3,5x5,21x6]H)(C[6,6a]C[6,6a]C[6a])(H){1|C<6>,1|H<1>,2|C<3>,4|B<6>}	C[6](C[5x3,5x5,21x6]B[5x3,5x5,20x6]3B[5x3,5x5,21x6]C[5x3,5x5,20x6])(C[6]C[6,6a]H)(H){2|C<3>,4|H<1>,5|B<6>}	H(C[6]C[6,6a]C[6])	116.6025	0.506	2	116.6025	0.256	2	116.6025	0.256	2	116.6025	0.256	2	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	6:3:3:	3:	C[6]-3:C[6]-3:H-1:	B[5x3,5x5,20x6]-6:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]B[5x3,5x5,20x6]C[6])(C[6]C[6]H)(H)	C[6](B[5x3,5x5,20x6]B[5x3,5x5,20x6]4C[5x3,5x5,20x6])(C[6]C[6]C)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]B[5x3,5x5,20x6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|C<6>,1|H<1>,4|B<6>}	C[6](B[5x3,5x5,20x6]B[5x3,5x5,20x6]4C[5x3,5x5,20x6])(C[6]C[6]C)(C[6]C[6]H){1|Ir<8>,1|C<3>,1|C<6>,4|B<6>,7|H<1>}	H(C[6]C[6]2)	118.5150	0.000	1	118.5150	0.000	1	118.5150	0.000	1	119.2258	4.177	10	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	6:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[3x3,3x5,12x6]-6:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[3x3,3x5,12x6]C[6])(C[6]C[6]H)(H)	C[6](C[3x3,3x5,12x6]B[3x3,3x5,12x6]2B[5x3,3x5,11x6]2Rh)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[3x3,3x5,12x6]C[6])(C[6]C[6]H)(H){1|Rh<10>,1|H<1>,2|C<3>,4|B<6>}	C[6](C[3x3,3x5,12x6]B[3x3,3x5,12x6]2B[5x3,3x5,11x6]2Rh)(C[6]C[6]H)2{1|C<3>,1|C<6>,4|B<6>,6|H<1>}	H(C[6]C[6]2)	119.2985	5.280	2	119.2985	27.878	2	119.2985	27.878	2	119.2258	4.177	10	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	6:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5x3,5x5,20x6]-6:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5x3,5x5,20x6]C[6])(C[6]C[6]H)(H)	C[6](C[5x3,5x5,20x6]B[5x3,5x5,20x6]4C[5x3,5x5,20x6])(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5x3,5x5,20x6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<5>,1|H<1>,1|N<3>,4|B<6>}	C[6](C[5x3,5x5,20x6]B[5x3,5x5,20x6]4C[5x3,5x5,20x6])(C[6]C[6]H)(C[6]N[6]H){1|Ir<6>,1|C<3>,5|B<6>,5|H<1>}	H(C[6]C[6]2)	120.1630	0.000	1	120.4847	0.235	3	120.4847	0.235	3	119.2258	4.177	10	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	6:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5x3,5x5,20x6]-6:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5x3,5x5,20x6]C[6])(C[6]C[6]H)(H)	C[6](C[5x3,5x5,20x6]B[5x3,5x5,20x6]4C[5x3,5x5,20x6])(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5x3,5x5,20x6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<6>,1|H<1>,1|N<3>,4|B<6>}	C[6](C[5x3,5x5,20x6]B[5x3,5x5,20x6]4C[5x3,5x5,20x6])(C[6]C[6]H)(C[6]N[6]H){1|Ir<6>,1|C<3>,1|C<4>,5|B<6>,5|H<1>}	H(C[6]C[6]2)	120.2490	0.000	1	120.4847	0.235	3	120.4847	0.235	3	119.2258	4.177	10	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	6:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5x3,5x5,20x6]-6:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5x3,5x5,20x6]C[6])(C[6]C[6]H)(H)	C[6](C[5x3,5x5,20x6]B[5x3,5x5,20x6]4C[5x3,5x5,20x6])(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5x3,5x5,20x6]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<6>,1|H<1>,1|N<3>,4|B<6>}	C[6](C[5x3,5x5,20x6]B[5x3,5x5,20x6]4C[5x3,5x5,20x6])(C[6]C[6]H)(C[6]N[6]H){1|Ir<6>,1|C<3>,5|B<6>,6|H<1>}	H(C[6]C[6]2)	121.0420	0.000	1	120.4847	0.235	3	120.4847	0.235	3	119.2258	4.177	10	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	6:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[5x3,5x5,20x6]-6:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5x3,5x5,20x6]N[6])(C[6]C[6]H)(H)	C[6](C[5x3,5x5,20x6]B[5x3,5x5,20x6]4C[5x3,5x5,20x6])(N[6]C[6]Ir)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5x3,5x5,20x6]N[6])(C[6]C[6]H)(H){1|Ir<6>,1|C<3>,1|C<6>,1|H<1>,4|B<6>}	C[6](C[5x3,5x5,20x6]B[5x3,5x5,20x6]4C[5x3,5x5,20x6])(N[6]C[6]Ir)(C[6]C[6]H){1|C<3>,5|B<6>,6|H<1>}	H(C[6]C[6]2)	119.3240	0.000	1	119.3240	0.000	1	119.3240	0.000	1	119.2258	4.177	10	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	6:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[5x3,5x5,20x6]-6:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5x3,5x5,20x6]C[6])(N[6]C[6]Ir)(H)	C[6](C[5x3,5x5,20x6]B[5x3,5x5,20x6]4C[5x3,5x5,20x6])(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[5x3,5x5,20x6]C[6])(N[6]C[6]Ir)(H){1|C<5>,1|H<1>,2|C<3>,4|B<6>}	C[6](C[5x3,5x5,20x6]B[5x3,5x5,20x6]4C[5x3,5x5,20x6])(C[6]C[6]H)(C[6]N[6]H){1|Ir<6>,1|C<3>,5|B<6>,5|H<1>}	H(C[6]C[6]N[6])	117.6630	0.000	1	118.1227	0.159	3	118.1227	0.159	3	119.2258	4.177	10	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	6:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[5x3,5x5,20x6]-6:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5x3,5x5,20x6]C[6])(N[6]C[6]Ir)(H)	C[6](C[5x3,5x5,20x6]B[5x3,5x5,20x6]4C[5x3,5x5,20x6])(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[5x3,5x5,20x6]C[6])(N[6]C[6]Ir)(H){1|C<6>,1|H<1>,2|C<3>,4|B<6>}	C[6](C[5x3,5x5,20x6]B[5x3,5x5,20x6]4C[5x3,5x5,20x6])(C[6]C[6]H)(C[6]N[6]H){1|Ir<6>,1|C<3>,1|C<4>,5|B<6>,5|H<1>}	H(C[6]C[6]N[6])	118.3700	0.000	1	118.1227	0.159	3	118.1227	0.159	3	119.2258	4.177	10	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	6:3:3:	3:	C[6]-3:N[6]-3:H-1:	C[5x3,5x5,20x6]-6:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5x3,5x5,20x6]C[6])(N[6]C[6]Ir)(H)	C[6](C[5x3,5x5,20x6]B[5x3,5x5,20x6]4C[5x3,5x5,20x6])(C[6]C[6]H)(C[6]N[6]H)	H(C[6]C[6]N[6])	C[6](C[6]C[5x3,5x5,20x6]C[6])(N[6]C[6]Ir)(H){1|C<6>,1|H<1>,2|C<3>,4|B<6>}	C[6](C[5x3,5x5,20x6]B[5x3,5x5,20x6]4C[5x3,5x5,20x6])(C[6]C[6]H)(C[6]N[6]H){1|Ir<6>,1|C<3>,5|B<6>,6|H<1>}	H(C[6]C[6]N[6])	118.3350	0.000	1	118.1227	0.159	3	118.1227	0.159	3	119.2258	4.177	10	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	6:3:4:	3:	C[6]-3:C[6]-3:H-1:	C[5x3,5x5,21x6]-6:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5x3,5x5,21x6]C)(C[6]C[6]C)(H)	C[6](C[5x3,5x5,21x6]B[5x3,5x5,20x6]4C[5x3,5x5,21x6])(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[5x3,5x5,21x6]C)(C[6]C[6]C)(H){1|C<6>,1|H<1>,4|B<6>}	C[6](C[5x3,5x5,21x6]B[5x3,5x5,20x6]4C[5x3,5x5,21x6])(C[6]C[6]H)(CC3){1|C<3>,1|C<4>,4|H<1>,5|B<6>}	H(C[6]C[6]2)	115.3515	0.118	2	115.3515	0.014	2	115.3515	0.014	2	115.3515	0.014	2	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:3:1:	7:3:3:	3:	C[6]-3:C[6]-3:H-1:	C[6x3]-7:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6x3]C[6])(C[6]C[6]C)(H)	C[6](C[6x3]C[3,3,4,4,6]2C[3x3,4,6]2C[4x3,4,6]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6x3]C[6])(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|O<1>,2|C<7>,4|C<6>}	C[6](C[6x3]C[3,3,4,4,6]2C[3x3,4,6]2C[4x3,4,6]2)(C[6]C[6]H)2{10|H<2>,1|C<3>,2|C<4>,2|H<3>,6|H<1>}	H(C[6]C[6]2)	118.7605	0.066	2	118.7605	0.004	2	118.7605	0.004	2	118.7605	0.004	2	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	2:3:3:	3:	C[6]-3:C[6]-4:H-1:	O[6]-2:C[5a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]O[6])(C[6]C[6,6]CH)(H)	C[6](O[6]C[5,6,6])(C[5a]C[5a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]O[6])(C[6]C[6,6]CH)(H){1|C<4>,1|H<1>,3|C<3>}	C[6](O[6]C[5,6,6])(C[5a]C[5a]2)(C[6]C[6]H){1|C<3>,1|O<2>,3|H<1>,4|C<4>}	H(C[6]C[6]2)	117.3830	1.218	2	117.3830	1.483	2	117.3830	1.483	2	117.3830	1.483	2	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:2:3:	3:	C[6]-3:C[6]-4:H-1:	C[6a]-3:O[6]-2:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]O[6])(C[6]C[6,6]CH)(H)	C[6](C[6a]C[6a]2)(O[6]C[6,6])(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]O[6])(C[6]C[6,6]CH)(H){4|C<3>}	C[6](C[6a]C[6a]2)(O[6]C[6,6])(C[6]C[6]H){1|Br<1>,1|C<4>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	118.4650	0.000	1	118.4650	0.000	1	118.4650	0.000	1	118.4650	0.000	1	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H)	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|C<3>,2|C<4>,4|H<1>}	H(C[6]C[6]2)	119.5810	0.000	1	119.0085	0.255	4	118.7480	0.269	8	119.4978	1.545	272	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H)	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H){1|C<3>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|O<2>,3|C<4>,3|H<1>}	H(C[6]C[6]2)	118.5845	0.023	2	119.0085	0.255	4	118.7480	0.269	8	119.4978	1.545	272	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H)	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H){2|C<3>,2|H<1>}	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|O<1>,1|O<2>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.2840	0.000	1	119.0085	0.255	4	118.7480	0.269	8	119.4978	1.545	272	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]HO)(H)	C[6](C[5,6]C[5,6,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]HO)(H){1|C<3>,1|C<4>,2|H<1>}	C[6](C[5,6]C[5,6,6]C[5])(C[6]C[6]H)(H){1|C<3>,1|N<3>,1|O<2>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.7007	0.126	3	118.7007	0.016	3	118.7480	0.269	8	119.4978	1.545	272	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]OO)(H)	C[6](C[5,6]C[5,6]N[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]OO)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[5,6]C[5,6]N[5])(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|O<2>}	H(C[6]C[6]2)	117.8480	0.000	1	117.8480	0.000	1	118.7480	0.269	8	119.4978	1.545	272	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(C[6]C[6]HH)(H)	C[6](C[5a,6]C[5a,6]N[5a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)(C[6]C[6]HH)(H){1|C<3>,1|N<3>,2|H<1>}	C[6](C[5a,6]C[5a,6]N[5a])(C[6]C[6]H)(H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.2850	0.000	1	119.2850	0.000	1	119.2680	0.001	2	119.4978	1.545	272	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]H)(C[6]C[6]HO)(H)	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]H)(C[6]C[6]HO)(H){1|H<1>,3|C<3>}	C[6](C[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H){1|C<3>,1|C<4>,2|H<1>,2|O<2>}	H(C[6]C[6]2)	119.2510	0.000	1	119.2510	0.000	1	119.2680	0.001	2	119.4978	1.545	272	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]CH)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]CH)(H){1|C<3>,1|H<1>,2|C<4>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){3|H<1>,4|C<4>}	H(C[6]C[6]2)	117.9390	0.306	5	117.9390	0.094	5	119.6254	6.382	17	119.4978	1.545	272	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]CO)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]CO)(H){1|C<3>,1|C<4>,2|H<1>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|C<4>,2|O<2>}	H(C[6]C[6]2)	118.0990	0.000	1	118.0990	0.000	1	119.6254	6.382	17	119.4978	1.545	272	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H)	C[6](C[6,6]C[5,6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H){1|C<3>,1|C<4>,2|H<1>}	C[6](C[6,6]C[5,6,6]C[6])(C[6]C[6]H)(H){2|H<1>,5|C<4>}	H(C[6]C[6]2)	118.3620	0.000	1	118.3620	0.000	1	119.6254	6.382	17	119.4978	1.545	272	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H){1|C<3>,1|H<1>,2|C<4>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,3|C<4>,3|H<1>}	H(C[6]C[6]2)	118.7580	0.000	1	118.7580	0.000	1	119.6254	6.382	17	119.4978	1.545	272	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]HN)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]HN)(H){1|H<1>,2|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>,3|C<3>}	H(C[6]C[6]2)	126.7110	0.000	1	126.7110	0.000	1	119.6254	6.382	17	119.4978	1.545	272	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]OV)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]OV)(H){1|O<2>,2|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<4>,1|O<1>,1|O<2>,1|V<7>,2|C<3>}	H(C[6]C[6]2)	120.3160	0.000	1	120.3160	0.000	1	119.6254	6.382	17	119.4978	1.545	272	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]OW)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]OW)(H){1|O<2>,2|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|W<10>,1|C<4>,1|O<1>,1|O<2>,2|C<3>}	H(C[6]C[6]2)	120.3170	0.000	1	120.3170	0.000	1	119.6254	6.382	17	119.4978	1.545	272	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]CH)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]CH)(H){1|C<4>,2|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>,3|C<4>}	H(C[6]C[6]2)	119.0320	0.232	2	119.0320	0.054	2	119.6254	6.382	17	119.4978	1.545	272	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]N[6]HH)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]N[6]HH)(H){1|C<3>,2|C<4>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|N<3>,2|C<4>,4|H<1>}	H(C[6]C[6]2)	119.5140	0.000	1	119.5140	0.000	1	119.6254	6.382	17	119.4978	1.545	272	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]O[6]CC)(H)	C[6](C[6,6]C[6,6]2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]O[6]CC)(H){1|C<3>,1|C<4>}	C[6](C[6,6]C[6,6]2)(C[6]C[6]H)(H){1|Cr<9>,1|C<3>,1|O<2>,4|C<4>}	H(C[6]C[6]2)	125.1620	0.000	1	125.1620	0.000	1	119.6254	6.382	17	119.4978	1.545	272	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]O[6]CC)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]O[6]CC)(H){2|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|O<1>,1|O<2>,3|C<4>}	H(C[6]C[6]2)	119.1310	0.000	1	119.3170	0.069	2	119.6254	6.382	17	119.4978	1.545	272	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]O[6]CC)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]O[6]CC)(H){2|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|O<1>,1|O<2>,4|C<4>}	H(C[6]C[6]2)	119.5030	0.000	1	119.3170	0.069	2	119.6254	6.382	17	119.4978	1.545	272	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6,6a]Cl)(C[6]N[6]HH)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]Cl)(C[6]N[6]HH)(H){3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(Cl){1|N<3>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	120.1280	0.000	1	120.1280	0.000	1	120.1280	0.000	1	119.4978	1.545	272	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]2H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]2H)(H){1|N<3>,2|C<3>,2|C<4>,2|H<1>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){2|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.0105	0.346	2	118.9613	0.067	3	119.5280	1.288	239	119.4978	1.545	272	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]2H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]2H)(H){1|O<2>,2|C<3>,2|C<4>,2|H<1>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){2|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.8630	0.000	1	118.9613	0.067	3	119.5280	1.288	239	119.4978	1.545	272	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]Au2)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]Au2)(H){1|H<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){2|Au<3>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	118.9110	0.000	1	118.9110	0.000	1	119.5280	1.288	239	119.4978	1.545	272	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]CH)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]CH)(H){1|H<1>,1|N<3>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){2|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.3630	0.000	1	119.0907	0.466	3	119.5280	1.288	239	119.4978	1.545	272	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]CH)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]CH)(H){1|H<1>,1|O<2>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){2|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.9545	0.906	2	119.0907	0.466	3	119.5280	1.288	239	119.4978	1.545	272	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]CaN)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]CaN)(H){1|C<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Ca<8>,1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	119.0525	0.107	2	119.0525	0.011	2	119.5280	1.288	239	119.4978	1.545	272	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]CeO)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]CeO)(H){3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Ce<12>,1|H<1>,1|O<3>,3|C<3>}	H(C[6]C[6]2)	119.0487	0.402	6	119.5194	0.561	39	119.5280	1.288	239	119.4978	1.545	272	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]CeO)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]CeO)(H){3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Ce<13>,1|H<1>,1|O<3>,3|C<3>}	H(C[6]C[6]2)	119.8562	1.329	10	119.5194	0.561	39	119.5280	1.288	239	119.4978	1.545	272	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]CeO)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]CeO)(H){3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Ce<14>,1|H<1>,1|O<3>,3|C<3>}	H(C[6]C[6]2)	119.4957	0.313	23	119.5194	0.561	39	119.5280	1.288	239	119.4978	1.545	272	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]ClC)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]ClC)(H){1|O<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Cl<1>,1|H<1>,4|C<3>}	H(C[6]C[6]2)	119.1290	0.000	1	119.1290	0.000	1	119.5280	1.288	239	119.4978	1.545	272	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]CuH)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]CuH)(H){1|C<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Cu<5>,1|C<4>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.4380	0.000	1	119.4380	0.000	1	119.5280	1.288	239	119.4978	1.545	272	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]EuO)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]EuO)(H){3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Eu<12>,1|H<1>,1|O<2>,3|C<3>}	H(C[6]C[6]2)	119.2463	0.517	11	119.2755	0.185	17	119.5280	1.288	239	119.4978	1.545	272	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]EuO)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]EuO)(H){3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Eu<12>,1|H<1>,1|O<3>,3|C<3>}	H(C[6]C[6]2)	119.3290	0.224	6	119.2755	0.185	17	119.5280	1.288	239	119.4978	1.545	272	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]HH)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]HH)(H){1|C<4>,1|H<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|O<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.4130	0.000	1	119.5370	0.065	4	119.5280	1.288	239	119.4978	1.545	272	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]HH)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]HH)(H){1|H<1>,1|O<2>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	119.2910	0.000	1	119.5370	0.065	4	119.5280	1.288	239	119.4978	1.545	272	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]HH)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]HH)(H){1|H<1>,3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|O<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7220	0.226	2	119.5370	0.065	4	119.5280	1.288	239	119.4978	1.545	272	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]HH)(H)	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]HH)(H){2|C<3>,2|H<1>}	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.6850	0.000	1	119.6850	0.000	1	119.5280	1.288	239	119.4978	1.545	272	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]HN)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]HN)(H){1|H<1>,1|N<3>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.8150	0.000	1	119.7806	0.029	5	119.5280	1.288	239	119.4978	1.545	272	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]HN)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]HN)(H){1|H<1>,1|O<2>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7720	0.196	4	119.7806	0.029	5	119.5280	1.288	239	119.4978	1.545	272	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]HO)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]HO)(H){1|C<4>,1|H<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,2|C<3>,2|O<2>}	H(C[6]C[6]2)	119.7090	0.000	1	119.5411	0.231	9	119.5280	1.288	239	119.4978	1.545	272	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]HO)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]HO)(H){1|C<4>,1|S<2>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|O<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9230	0.000	1	119.5411	0.231	9	119.5280	1.288	239	119.4978	1.545	272	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]HO)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]HO)(H){1|H<1>,1|N<3>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|O<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	118.9320	0.000	1	119.5411	0.231	9	119.5280	1.288	239	119.4978	1.545	272	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]HO)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]HO)(H){1|H<1>,1|O<2>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|O<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7985	0.144	4	119.5411	0.231	9	119.5280	1.288	239	119.4978	1.545	272	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]HO)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]HO)(H){1|O<2>,3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|O<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	118.5530	0.000	1	119.5411	0.231	9	119.5280	1.288	239	119.4978	1.545	272	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]HO)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]HO)(H){2|C<3>,2|H<1>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|O<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.5590	0.000	1	119.5411	0.231	9	119.5280	1.288	239	119.4978	1.545	272	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]HO)(H)	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]HO)(H){1|H<1>,1|O<2>,2|C<3>}	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<2>,3|C<3>}	H(C[6]C[6]2)	120.9730	0.000	1	120.9730	0.000	1	119.5280	1.288	239	119.4978	1.545	272	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]HP)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]HP)(H){3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|P<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	118.6790	0.000	1	118.6790	0.000	1	119.5280	1.288	239	119.4978	1.545	272	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]HW)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]HW)(H){1|H<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|W<7>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	118.4440	0.000	1	118.4440	0.000	1	119.5280	1.288	239	119.4978	1.545	272	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]IrO)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]IrO)(H){3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Ir<9>,1|C<4>,1|H<1>,1|O<2>,2|C<3>}	H(C[6]C[6]2)	119.4090	0.017	2	119.4090	0.000	2	119.5280	1.288	239	119.4978	1.545	272	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]LaO)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]LaO)(H){3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|La<12>,1|H<1>,1|O<2>,3|C<3>}	H(C[6]C[6]2)	120.0010	0.030	6	119.6788	0.181	11	119.5280	1.288	239	119.4978	1.545	272	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]LaO)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]LaO)(H){3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|La<12>,1|H<1>,1|O<3>,3|C<3>}	H(C[6]C[6]2)	119.2922	0.331	5	119.6788	0.181	11	119.5280	1.288	239	119.4978	1.545	272	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]LuO)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]LuO)(H){3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Lu<12>,1|H<1>,1|O<3>,3|C<3>}	H(C[6]C[6]2)	119.5838	0.184	6	119.5838	0.034	6	119.5280	1.288	239	119.4978	1.545	272	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]MoH)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]MoH)(H){1|H<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Mo<7>,1|C<4>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.3110	0.000	1	119.3110	0.000	1	119.5280	1.288	239	119.4978	1.545	272	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]NiH)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]NiH)(H){1|H<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Ni<4>,1|C<4>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	118.4830	0.000	1	118.4830	0.000	1	119.5280	1.288	239	119.4978	1.545	272	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]OU)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]OU)(H){3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|U<13>,1|H<1>,1|O<3>,3|C<3>}	H(C[6]C[6]2)	119.3849	0.473	11	119.3849	0.224	11	119.5280	1.288	239	119.4978	1.545	272	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]OV)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]OV)(H){3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|O<2>,1|V<7>,3|C<3>}	H(C[6]C[6]2)	120.2540	0.000	1	119.6767	0.126	6	119.5280	1.288	239	119.4978	1.545	272	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]OV)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]OV)(H){3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|O<2>,1|V<9>,3|C<3>}	H(C[6]C[6]2)	119.7560	0.000	1	119.6767	0.126	6	119.5280	1.288	239	119.4978	1.545	272	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]OV)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]OV)(H){3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|V<10>,1|H<1>,1|O<2>,3|C<3>}	H(C[6]C[6]2)	119.5125	0.247	4	119.6767	0.126	6	119.5280	1.288	239	119.4978	1.545	272	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]OY)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]OY)(H){3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Y<12>,1|H<1>,1|O<2>,3|C<3>}	H(C[6]C[6]2)	119.3075	0.197	2	119.3075	0.039	2	119.5280	1.288	239	119.4978	1.545	272	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]Os2)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]Os2)(H){1|H<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Os<5>,1|Os<6>,1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	117.8420	0.000	3	117.8420	0.000	3	119.5280	1.288	239	119.4978	1.545	272	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]PdH)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]PdH)(H){3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Pd<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	118.8350	0.000	1	118.8350	0.000	1	119.5280	1.288	239	119.4978	1.545	272	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]Re2)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]Re2)(H){1|H<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Re<6>,1|Re<7>,1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	118.5250	0.000	1	118.5250	0.000	1	119.5280	1.288	239	119.4978	1.545	272	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]ReH)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]ReH)(H){1|H<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Re<7>,1|C<4>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	115.0810	0.000	1	115.0810	0.000	1	119.5280	1.288	239	119.4978	1.545	272	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]RhH)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]RhH)(H){1|Rh<7>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Rh<8>,1|C<4>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	118.8180	0.000	1	118.8180	0.000	1	119.5280	1.288	239	119.4978	1.545	272	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]RhO)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]RhO)(H){3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Rh<9>,1|C<4>,1|H<1>,1|O<2>,2|C<3>}	H(C[6]C[6]2)	119.1915	0.131	2	119.1915	0.017	2	119.5280	1.288	239	119.4978	1.545	272	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]RuH)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]RuH)(H){3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Ru<7>,1|C<4>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7370	0.000	1	119.7370	0.000	1	119.5280	1.288	239	119.4978	1.545	272	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]RuO)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]RuO)(H){1|C<4>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Ru<8>,1|C<4>,1|H<1>,1|O<2>,2|C<3>}	H(C[6]C[6]2)	119.6590	0.049	2	119.6590	0.002	2	119.5280	1.288	239	119.4978	1.545	272	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]RuP)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]RuP)(H){3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Ru<8>,1|C<4>,1|H<1>,1|P<5>,2|C<3>}	H(C[6]C[6]2)	119.8230	0.000	1	119.8230	0.000	1	119.5280	1.288	239	119.4978	1.545	272	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]C[6]YbO)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]C[6]YbO)(H){3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Yb<12>,1|H<1>,1|O<2>,3|C<3>}	H(C[6]C[6]2)	119.0545	0.074	2	119.0545	0.006	2	119.5280	1.288	239	119.4978	1.545	272	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]CH)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]CH)(H){1|Re<6>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0990	0.438	2	118.0555	8.923	8	119.5280	1.288	239	119.4978	1.545	272	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]CH)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]CH)(H){3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<2>,1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	115.1267	3.218	3	118.0555	8.923	8	119.5280	1.288	239	119.4978	1.545	272	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]CH)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]CH)(H){3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.6220	0.235	3	118.0555	8.923	8	119.5280	1.288	239	119.4978	1.545	272	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]HH)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]HH)(H){3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	119.3110	0.085	2	119.3110	0.007	2	119.5280	1.288	239	119.4978	1.545	272	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]NiO)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]NiO)(H){2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Ni<6>,1|H<1>,1|N<3>,1|O<2>,2|C<3>}	H(C[6]C[6]2)	120.7950	0.000	1	120.7950	0.000	1	119.5280	1.288	239	119.4978	1.545	272	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]ReO)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]ReO)(H){2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Re<8>,1|H<1>,1|N<3>,1|O<2>,2|C<3>}	H(C[6]C[6]2)	121.6625	0.317	2	121.6625	0.101	2	119.5280	1.288	239	119.4978	1.545	272	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]RuH)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]RuH)(H){1|Ru<8>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Ru<9>,1|N<4>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	121.8920	0.967	2	121.8920	0.936	2	119.5280	1.288	239	119.4978	1.545	272	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]N[6]RuO)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]N[6]RuO)(H){2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|Ru<7>,1|H<1>,1|N<3>,1|O<2>,2|C<3>}	H(C[6]C[6]2)	120.5120	0.000	1	120.5120	0.000	1	119.5280	1.288	239	119.4978	1.545	272	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]O[6]CC)(H)	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]O[6]CC)(H){2|C<3>}	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H){1|N<3>,1|O<2>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	119.8233	0.577	12	119.8233	0.333	12	119.5280	1.288	239	119.4978	1.545	272	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]O[6]CC)(H)	C[6](C[6,6a]C[6,6a]2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]O[6]CC)(H){2|C<3>}	C[6](C[6,6a]C[6,6a]2)(C[6]C[6]H)(H){2|C<3>,2|C<4>,2|O<2>}	H(C[6]C[6]2)	120.3673	2.039	6	120.3673	4.159	6	119.5280	1.288	239	119.4978	1.545	272	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]O[6]CC)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]O[6]CC)(H){2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<3>,1|O<1>,2|C<4>,2|O<2>}	H(C[6]C[6]2)	119.3600	0.000	1	119.5960	1.291	42	119.5280	1.288	239	119.4978	1.545	272	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]O[6]CC)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]O[6]CC)(H){2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|O<2>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	119.2403	0.474	9	119.5960	1.291	42	119.5280	1.288	239	119.4978	1.545	272	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]O[6]CC)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]O[6]CC)(H){2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,1|O<2>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	119.8680	0.000	1	119.5960	1.291	42	119.5280	1.288	239	119.4978	1.545	272	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]O[6]CC)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]O[6]CC)(H){2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|O<2>,2|C<4>,3|C<3>}	H(C[6]C[6]2)	119.1280	0.000	1	119.5960	1.291	42	119.5280	1.288	239	119.4978	1.545	272	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]O[6]CC)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]O[6]CC)(H){2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){2|C<3>,2|C<4>,2|O<2>}	H(C[6]C[6]2)	119.7171	1.302	30	119.5960	1.291	42	119.5280	1.288	239	119.4978	1.545	272	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]O[6]CC)(H)	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]O[6]CC)(H){2|C<3>}	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H){1|N<3>,1|O<2>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	120.1230	0.000	1	119.9581	2.330	16	119.5280	1.288	239	119.4978	1.545	272	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]O[6]CC)(H)	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]O[6]CC)(H){2|C<3>}	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H){1|O<2>,2|C<4>,3|C<3>}	H(C[6]C[6]2)	119.1082	0.681	4	119.9581	2.330	16	119.5280	1.288	239	119.4978	1.545	272	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]O[6]CC)(H)	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]O[6]CC)(H){2|C<3>}	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H){2|C<3>,2|C<4>,2|O<2>}	H(C[6]C[6]2)	120.2522	1.723	11	119.9581	2.330	16	119.5280	1.288	239	119.4978	1.545	272	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]O[6]CH)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]O[6]CH)(H){2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|O<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.4860	0.000	1	120.4860	0.000	1	119.5280	1.288	239	119.4978	1.545	272	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]H)(C[6]O[6]HH)(H)	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]H)(C[6]O[6]HH)(H){2|C<3>}	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H){1|O<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	121.3720	0.969	2	121.3720	0.938	2	119.5280	1.288	239	119.4978	1.545	272	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:1:	3:	C[6]-3:C[6]-4:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]CH)(H)	C[6](N[5,6]N[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]CH)(H){1|H<1>,1|N<3>,2|C<3>}	C[6](N[5,6]N[5,6]C[5])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>,3|C<4>}	H(C[6]C[6]2)	118.8350	0.000	1	118.8350	0.000	1	118.7245	0.024	2	119.4978	1.545	272	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:1:	3:	C[6]-3:C[6]-4:H-1:	N[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]H)(C[6]C[6]HH)(H)	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]H)(C[6]C[6]HH)(H){1|C<3>,1|C<4>,2|H<1>}	C[6](N[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|C<4>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	118.6140	0.000	1	118.6140	0.000	1	118.7245	0.024	2	119.4978	1.545	272	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:1:	3:	C[6]-3:C[6]-4:H-1:	N[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5a,6]H)(C[6]C[6]HH)(H)	C[6](N[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5a,6]H)(C[6]C[6]HH)(H){1|H<1>,1|O<2>,2|C<3>}	C[6](N[5a,6]C[5a,6]C[5a])(C[6]C[6]H)(H){1|C<4>,1|N<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	118.6160	0.000	1	118.6160	0.000	1	118.6160	0.000	1	119.4978	1.545	272	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:1:	3:	C[6]-3:C[6]-4:H-1:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]H)(C[6]C[6]HH)(H)	C[6](N[6,6]N[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]H)(C[6]C[6]HH)(H){1|C<3>,1|N<3>,2|H<1>}	C[6](N[6,6]N[6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|O<1>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.9335	0.018	2	118.9335	0.000	2	118.9335	0.000	2	119.4978	1.545	272	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:2:	3:	C[6]-3:C[6]-4:H-1:	C[5a]-3:C[6]-3:O[6]-2:	C[6]-3:	C[6](C[6]C[5a]O[6])(C[6]C[6]2H)(H)	C[6](C[5a]N[5a]S[5a])(C[6]C[6]H)(O[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[5a]O[6])(C[6]C[6]2H)(H){1|N<2>,1|O<2>,1|S<2>,2|C<4>,3|H<1>}	C[6](C[5a]N[5a]S[5a])(C[6]C[6]H)(O[6]C[6]){1|O<2>,2|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.1770	0.000	1	118.1770	0.000	1	118.1770	0.000	1	118.9644	1.979	9	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:2:	3:	C[6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]C[6]NiH)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CN)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]C[6]NiH)(H){1|C<2>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CN){1|Ni<4>,1|C<4>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	118.9895	0.100	2	118.9895	0.010	2	118.9895	0.010	2	118.9644	1.979	9	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:2:	3:	C[6]-3:C[6]-4:H-1:	C[6a]-3:C[6]-3:O[6]-2:	C[6]-3:	C[6](C[6]C[6a]O[6])(C[6]C[6]CH)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(O[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6a]O[6])(C[6]C[6]CH)(H){1|C<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(O[6]C[6]){1|C<4>,1|O<1>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	121.4370	0.000	1	119.7890	1.552	4	119.0873	3.021	6	118.9644	1.979	9	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:2:	3:	C[6]-3:C[6]-4:H-1:	C[6a]-3:C[6]-3:O[6]-2:	C[6]-3:	C[6](C[6]C[6a]O[6])(C[6]C[6]CH)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(O[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6a]O[6])(C[6]C[6]CH)(H){1|C<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(O[6]C[6]){1|O<1>,2|C<3>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	119.6780	0.000	1	119.7890	1.552	4	119.0873	3.021	6	118.9644	1.979	9	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:2:	3:	C[6]-3:C[6]-4:H-1:	C[6a]-3:C[6]-3:O[6]-2:	C[6]-3:	C[6](C[6]C[6a]O[6])(C[6]C[6]CH)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(O[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6a]O[6])(C[6]C[6]CH)(H){1|H<1>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(O[6]C[6]){1|C<4>,1|O<1>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.6320	0.000	1	119.7890	1.552	4	119.0873	3.021	6	118.9644	1.979	9	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:2:	3:	C[6]-3:C[6]-4:H-1:	C[6a]-3:C[6]-3:O[6]-2:	C[6]-3:	C[6](C[6]C[6a]O[6])(C[6]C[6]CH)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(O[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6a]O[6])(C[6]C[6]CH)(H){1|H<1>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(O[6]C[6]){1|O<1>,2|C<3>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	118.4090	0.000	1	119.7890	1.552	4	119.0873	3.021	6	118.9644	1.979	9	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:2:	3:	C[6]-3:C[6]-4:H-1:	C[6a]-3:C[6]-3:O[6]-2:	C[6]-3:	C[6](C[6]C[6a]O[6])(C[6]C[6]HH)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(O[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6a]O[6])(C[6]C[6]HH)(H){1|C<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(O[6]C[6]){1|C<4>,1|O<1>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	116.1770	0.000	1	116.1770	0.000	1	119.0873	3.021	6	118.9644	1.979	9	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:2:	3:	C[6]-3:C[6]-4:H-1:	C[6a]-3:C[6]-3:O[6]-2:	C[6]-3:	C[6](C[6]C[6a]O[6])(C[6]C[6]HP)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(O[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6a]O[6])(C[6]C[6]HP)(H){1|C<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(O[6]C[6]){1|C<4>,1|O<1>,1|P<4>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	119.1910	0.000	1	119.1910	0.000	1	119.0873	3.021	6	118.9644	1.979	9	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:3:	3:	C[6]-3:C[6]-4:H-1:	C[5,6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[6]HH)(H)	C[6](C[5,6]C[5,6]O[5])(C[6]C[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[6]HH)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[5,6]C[5,6]O[5])(C[6]C[6]H)(CNO){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.9170	0.000	1	118.9170	0.000	1	118.9170	0.000	1	118.5512	1.573	86	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:3:	3:	C[6]-3:C[6]-4:H-1:	C[5,6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5,6]C[6a])(C[6]C[6]HH)(H)	C[6](C[5,6]C[5,6]C[5])(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C[6a])(C[6]C[6]HH)(H){1|C<4>,2|H<1>,3|C<3>}	C[6](C[5,6]C[5,6]C[5])(C[6a]C[6a]2)(C[6]C[6]H){2|C<4>,4|C<3>,5|H<1>}	H(C[6]C[6]2)	117.4750	0.000	1	117.4750	0.000	1	117.4750	0.000	1	118.5512	1.573	86	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:3:	3:	C[6]-3:C[6]-4:H-1:	C[5]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[5]N[6])(C[6]C[6]CC)(H)	C[6](C[5]N[5]2)(C[6]C[6]H)(N[6]C[6]C)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6])(C[6]C[6]CC)(H){2|C<4>,2|H<1>,2|N<3>}	C[6](C[5]N[5]2)(C[6]C[6]H)(N[6]C[6]C){2|C<3>,7|C<4>}	H(C[6]C[6]2)	117.9290	0.000	1	117.9290	0.000	1	117.9290	0.000	1	118.5512	1.573	86	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:3:	3:	C[6]-3:C[6]-4:H-1:	C[5a,6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[5a,6]C)(C[6]O[6]CC)(H)	C[6](C[5a,6]C[5a,6]S[5a])(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]C)(C[6]O[6]CC)(H){1|C<3>,1|S<2>}	C[6](C[5a,6]C[5a,6]S[5a])(C[6]C[6]H)(COO){1|C<4>,1|O<2>,3|C<3>}	H(C[6]C[6]2)	119.3070	0.000	1	119.3070	0.000	1	119.3070	0.000	1	118.5512	1.573	86	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:3:	3:	C[6]-3:C[6]-4:H-1:	C[5a,6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a,6]C[6a])(C[6]C[6a]N[6]H)(H)	C[6](C[5a,6]C[5a,6]O[5a])(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]C[6a])(C[6]C[6a]N[6]H)(H){1|O<2>,1|S<4>,5|C<3>}	C[6](C[5a,6]C[5a,6]O[5a])(C[6a]C[6a]2)(C[6]C[6]H){1|N<3>,3|H<1>,5|C<3>}	H(C[6]C[6]2)	119.1360	0.000	1	119.1360	0.000	1	119.1360	0.000	1	118.5512	1.573	86	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:3:	3:	C[6]-3:C[6]-4:H-1:	C[6,6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6]C)(C[6]C[6]HO)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6,6]C)(C[6]C[6]HO)(H){1|C<3>,1|C<4>,2|H<1>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(COO){1|O<2>,3|C<4>,3|H<1>}	H(C[6]C[6]2)	119.2780	0.000	1	119.2780	0.000	1	119.2780	0.000	1	118.5512	1.573	86	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:3:	3:	C[6]-3:C[6]-4:H-1:	C[6,6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6]C[6a])(C[6]C[5,6]CC)(H)	C[6](C[6,6]C[5,6,6]C[6])(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]C[6a])(C[6]C[5,6]CC)(H){1|C<4>,1|N<2>,3|C<3>}	C[6](C[6,6]C[5,6,6]C[6])(C[6a]C[6a]2)(C[6]C[6]H){3|C<4>,4|C<3>,4|H<1>}	H(C[6]C[6]2)	118.5630	0.000	1	118.5630	0.000	1	118.5630	0.000	1	118.5512	1.573	86	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:3:	3:	C[6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]C[6]Co2)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]C[6]Co2)(H){2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CCH){2|Co<5>,1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.7290	0.000	1	119.7290	0.000	1	119.6753	1.368	10	118.5512	1.573	86	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:3:	3:	C[6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]C[6]HH)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CC[6a]O)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]C[6]HH)(H){2|C<3>,2|H<1>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CC[6a]O){1|C<4>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	118.9830	0.000	1	118.9830	0.000	1	119.6753	1.368	10	118.5512	1.573	86	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:3:	3:	C[6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]C[6]HH)(H)	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]C[6]HH)(H){2|C<3>,2|H<1>}	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(COO){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	121.5890	0.000	1	121.5890	0.000	1	119.6753	1.368	10	118.5512	1.573	86	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:3:	3:	C[6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]N[6]CC)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]N[6]CC)(H){1|H<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(COO){1|C<4>,1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	119.2542	0.790	5	119.4931	1.322	7	119.6753	1.368	10	118.5512	1.573	86	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:3:	3:	C[6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]N[6]CC)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]N[6]CC)(H){1|H<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(COO){1|C<4>,1|N<3>,1|O<2>,3|C<3>}	H(C[6]C[6]2)	118.6010	0.000	1	119.4931	1.322	7	119.6753	1.368	10	118.5512	1.573	86	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:3:	3:	C[6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]N[6]CC)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]N[6]CC)(H){1|H<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(COO){1|N<3>,2|C<4>,3|C<3>}	H(C[6]C[6]2)	121.5800	0.000	1	119.4931	1.322	7	119.6753	1.368	10	118.5512	1.573	86	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:3:	3:	C[6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]C[6])(C[6]N[6]HH)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6a]C[6])(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C[6])(C[6]N[6]HH)(H){1|S<4>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6a]C[6])(C[6]C[6]H){1|C<4>,1|N<3>,4|C<3>,4|H<1>}	H(C[6]C[6]2)	119.1670	0.000	1	119.1670	0.000	1	119.9567	0.475	3	118.5512	1.573	86	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:3:	3:	C[6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]C[6])(C[6]O[6]HH)(H)	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6,6a]C[6])(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C[6])(C[6]O[6]HH)(H){4|C<3>}	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6,6a]C[6])(C[6]C[6]H){1|C<4>,1|O<2>,3|H<1>,5|C<3>}	H(C[6]C[6]2)	120.3515	0.121	2	120.3515	0.015	2	119.9567	0.475	3	118.5512	1.573	86	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:3:	3:	C[6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]C[6a])(C[6]C[5,6]CH)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C[6a])(C[6]C[5,6]CH)(H){6|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2)(C[6]C[6]H){2|C<4>,4|C<3>,4|H<1>}	H(C[6]C[6]2)	118.7780	0.000	1	118.7780	0.000	1	118.9450	0.547	23	118.5512	1.573	86	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:3:	3:	C[6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]C[6a])(C[6]C[5,6]HH)(H)	C[6](C[6,6a]C[5,6,6a]C[6a])(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C[6a])(C[6]C[5,6]HH)(H){2|C<4>,4|C<3>}	C[6](C[6,6a]C[5,6,6a]C[6a])(C[6a]C[6a]2)(C[6]C[6]H){1|C<4>,4|C<3>,5|H<1>}	H(C[6]C[6]2)	117.7110	0.173	2	117.7110	0.030	2	118.9450	0.547	23	118.5512	1.573	86	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:3:	3:	C[6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]C[6a])(C[6]C[6]HH)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C[6a])(C[6]C[6]HH)(H){2|H<1>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2)(C[6]C[6]H){1|C<4>,4|C<3>,5|H<1>}	H(C[6]C[6]2)	118.0970	0.000	1	118.0970	0.000	1	118.9450	0.547	23	118.5512	1.573	86	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:3:	3:	C[6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]C[6a])(C[6]C[6]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]N[6a])(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C[6a])(C[6]C[6]N[6]C)(H){1|Fe<5>,1|N<2>,1|N<3>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]N[6a])(C[6]C[6]H){1|C<4>,1|N<3>,2|H<1>,5|C<3>}	H(C[6]C[6]2)	119.8530	0.643	2	119.8530	0.414	2	118.9450	0.547	23	118.5512	1.573	86	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:3:	3:	C[6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]C[6a])(C[6]C[6a]2N[6])(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C[6a])(C[6]C[6a]2N[6])(H){1|H<1>,8|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2)(C[6]C[6]H){1|N<3>,1|O<1>,1|O<2>,2|H<1>,5|C<3>}	H(C[6]C[6]2)	117.5490	0.000	1	118.4623	0.491	4	118.9450	0.547	23	118.5512	1.573	86	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:3:	3:	C[6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]C[6a])(C[6]C[6a]2N[6])(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C[6a])(C[6]C[6a]2N[6])(H){1|P<4>,8|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2)(C[6]C[6]H){1|N<3>,3|H<1>,6|C<3>}	H(C[6]C[6]2)	118.5945	0.428	2	118.4623	0.491	4	118.9450	0.547	23	118.5512	1.573	86	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:3:	3:	C[6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]C[6a])(C[6]C[6a]2N[6])(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C[6a])(C[6]C[6a]2N[6])(H){1|S<4>,8|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2)(C[6]C[6]H){1|N<3>,3|H<1>,6|C<3>}	H(C[6]C[6]2)	119.1110	0.000	1	118.4623	0.491	4	118.9450	0.547	23	118.5512	1.573	86	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:3:	3:	C[6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]C[6a])(C[6]C[6a]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C[6a])(C[6]C[6a]N[6]C)(H){1|H<1>,6|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2)(C[6]C[6]H){1|C<4>,1|N<2>,2|H<1>,2|N<3>,4|C<3>}	H(C[6]C[6]2)	118.9190	0.324	3	118.8355	0.098	4	118.9450	0.547	23	118.5512	1.573	86	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:3:	3:	C[6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]C[6a])(C[6]C[6a]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C[6a])(C[6]C[6a]N[6]C)(H){1|H<1>,6|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2)(C[6]C[6]H){1|C<4>,1|N<3>,3|H<1>,5|C<3>}	H(C[6]C[6]2)	118.5850	0.000	1	118.8355	0.098	4	118.9450	0.547	23	118.5512	1.573	86	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:3:	3:	C[6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]C[6a])(C[6]C[6a]N[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]N[6a])(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C[6a])(C[6]C[6a]N[6]C)(H){2|N<2>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]N[6a])(C[6]C[6]H){1|C<4>,1|N<2>,2|H<1>,5|C<3>}	H(C[6]C[6]2)	118.7170	0.000	1	118.7170	0.000	1	118.9450	0.547	23	118.5512	1.573	86	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:3:	3:	C[6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]C[6a])(C[6]C[6a]O[6]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C[6a])(C[6]C[6a]O[6]C)(H){6|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2)(C[6]C[6]H){1|C<4>,1|O<1>,2|H<1>,2|O<2>,4|C<3>}	H(C[6]C[6]2)	119.5750	0.000	1	119.5750	0.000	1	118.9450	0.547	23	118.5512	1.573	86	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:3:	3:	C[6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]C[6a])(C[6]N[6]HH)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C[6a])(C[6]N[6]HH)(H){1|S<4>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2)(C[6]C[6]H){1|N<3>,4|C<3>,5|H<1>}	H(C[6]C[6]2)	119.1763	0.345	3	119.2523	0.103	4	118.9450	0.547	23	118.5512	1.573	86	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:3:	3:	C[6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]C[6a])(C[6]N[6]HH)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C[6a])(C[6]N[6]HH)(H){1|S<4>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2)(C[6]C[6]H){1|N<3>,4|H<1>,5|C<3>}	H(C[6]C[6]2)	119.4800	0.000	1	119.2523	0.103	4	118.9450	0.547	23	118.5512	1.573	86	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:3:	3:	C[6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]C[6a])(C[6]O[6]CH)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C[6a])(C[6]O[6]CH)(H){4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2)(C[6]C[6]H){1|C<2>,1|O<2>,4|C<3>,4|H<1>}	H(C[6]C[6]2)	119.8610	0.000	1	119.8610	0.000	1	118.9450	0.547	23	118.5512	1.573	86	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:3:	3:	C[6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]C[6a])(C[6]O[6]CN)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C[6a])(C[6]O[6]CN)(H){4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2)(C[6]C[6]H){1|N<3>,1|O<2>,3|H<1>,5|C<3>}	H(C[6]C[6]2)	120.0900	0.000	1	120.0900	0.000	1	118.9450	0.547	23	118.5512	1.573	86	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:3:	3:	C[6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]C[6a])(C[6]O[6]CO)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C[6a])(C[6]O[6]CO)(H){4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2)(C[6]C[6]H){2|O<2>,3|H<1>,5|C<3>}	H(C[6]C[6]2)	119.2900	0.000	1	119.2900	0.000	1	118.9450	0.547	23	118.5512	1.573	86	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:3:	3:	C[6]-3:C[6]-4:H-1:	C[6]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]HH)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(N[6]C[6]2)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]HH)(H){1|O<1>,2|H<1>,3|C<4>}	C[6](C[6]C[6]H)(C[6]C[6]O)(N[6]C[6]2){3|C<4>,8|H<1>}	H(C[6]C[6]2)	117.8180	0.000	1	117.8180	0.000	1	117.8270	0.000	2	118.5512	1.573	86	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:3:	3:	C[6]-3:C[6]-4:H-1:	C[6]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]HH)(H)	C[6](C[6]C[6]N[6])(C[6]C[6]H)(N[6]C[6]C)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]HH)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(C[6]C[6]H)(N[6]C[6]C){1|C<4>,3|C<3>,4|H<1>}	H(C[6]C[6]2)	117.8360	0.000	1	117.8360	0.000	1	117.8270	0.000	2	118.5512	1.573	86	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:3:	3:	C[6]-3:C[6]-4:H-1:	C[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[5,6]HH)(H)	C[6](C[6]C[5,6]C)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[5,6]HH)(H){1|H<1>,2|C<4>,3|C<3>}	C[6](C[6]C[5,6]C)(C[6a]C[6a]2)(C[6]C[6]H){2|C<3>,2|C<4>,5|H<1>}	H(C[6]C[6]2)	117.9240	0.000	1	117.9240	0.000	1	118.4100	0.472	2	118.5512	1.573	86	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:3:	3:	C[6]-3:C[6]-4:H-1:	C[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[5,6]HH)(H)	C[6](C[6]C[5,6]C)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[5,6]HH)(H){1|C<4>,4|C<3>}	C[6](C[6]C[5,6]C)(C[6a]C[6a]2)(C[6]C[6]H){1|C<4>,1|N<3>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	118.8960	0.000	1	118.8960	0.000	1	118.4100	0.472	2	118.5512	1.573	86	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:3:	3:	C[6]-3:C[6]-4:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[5,6]CH)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]O[6]O)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[5,6]CH)(H){1|O<1>,1|O<2>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]O[6]O){2|C<3>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	118.5520	0.000	1	118.5520	0.000	1	118.6250	1.076	10	118.5512	1.573	86	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:3:	3:	C[6]-3:C[6]-4:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]CH)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]C[6]O)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]CH)(H){1|H<1>,1|O<1>,2|C<3>,2|C<4>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]C[6]O){1|N<3>,2|C<3>,2|C<4>,4|H<1>}	H(C[6]C[6]2)	118.0990	0.000	1	118.0990	0.000	1	118.6250	1.076	10	118.5512	1.573	86	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:3:	3:	C[6]-3:C[6]-4:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]HH)(H)	C[6](C[6a]C[5a,6a]C[6a])(C[6]C[6]H)(C[6]C[6]O)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]HH)(H){1|C<4>,1|O<1>,2|C<3>,2|H<1>}	C[6](C[6a]C[5a,6a]C[6a])(C[6]C[6]H)(C[6]C[6]O){1|Si<4>,2|C<4>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	121.3430	0.000	1	121.3430	0.000	1	118.6250	1.076	10	118.5512	1.573	86	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:3:	3:	C[6]-3:C[6]-4:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]HH)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]C[6]O)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]HH)(H){1|H<1>,1|O<1>,2|C<3>,2|C<4>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(C[6]C[6]O){1|C<4>,3|C<3>,5|H<1>}	H(C[6]C[6]2)	117.7540	0.444	2	117.7540	0.197	2	118.6250	1.076	10	118.5512	1.573	86	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:3:	3:	C[6]-3:C[6]-4:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]HH)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]HH)(H){2|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,3|C<3>,4|H<1>}	H(C[6]C[6]2)	118.3350	0.000	1	118.3350	0.000	1	118.6250	1.076	10	118.5512	1.573	86	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:3:	3:	C[6]-3:C[6]-4:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]CH)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]C)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]CH)(H){1|C<4>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]C)(C[6]C[6]H){1|C<4>,1|N<3>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	118.3910	0.163	2	118.6033	0.072	4	118.6250	1.076	10	118.5512	1.573	86	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:3:	3:	C[6]-3:C[6]-4:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]CH)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]C)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]CH)(H){1|C<4>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]C)(C[6]C[6]H){1|C<4>,1|N<3>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	118.8155	0.091	2	118.6033	0.072	4	118.6250	1.076	10	118.5512	1.573	86	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:3:	3:	C[6]-3:C[6]-4:H-1:	C[6a]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]CH)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]S)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]CH)(H){1|H<1>,1|S<4>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]S){1|C<4>,1|O<1>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.0280	0.000	1	120.0280	0.000	1	118.4915	4.722	2	118.5512	1.573	86	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:3:	3:	C[6]-3:C[6]-4:H-1:	C[6a]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]HH)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]S)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]HH)(H){1|C<4>,1|S<4>,2|C<3>,2|H<1>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]S){2|C<3>,2|C<4>,5|H<1>}	H(C[6]C[6]2)	116.9550	0.000	1	116.9550	0.000	1	118.4915	4.722	2	118.5512	1.573	86	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:3:	3:	C[6]-3:C[6]-4:H-1:	C[6a]-3:C[6]-3:S[6]-3:	C[6]-3:	C[6](C[6]C[6a]S[6])(C[6]C[6]CC)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(S[6]C[6]O)	H(C[6]C[6]2)	C[6](C[6]C[6a]S[6])(C[6]C[6]CC)(H){1|H<1>,1|O<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(S[6]C[6]O){2|C<4>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	115.6146	0.351	7	115.6146	0.123	7	115.6146	0.123	7	118.5512	1.573	86	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:3:	3:	C[6]-3:C[6]-4:H-1:	C[6a]-3:N[6,6]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[6,6]C[6a])(C[6]C[6,6]HH)(H)	C[6](C[6a]C[6a,6a]C[6a])(N[6,6]C[6,6]C[6])(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]C[6a])(C[6]C[6,6]HH)(H){1|H<1>,2|C<3>,3|C<4>}	C[6](C[6a]C[6a,6a]C[6a])(N[6,6]C[6,6]C[6])(C[6]C[6]H){2|C<4>,3|C<3>,7|H<1>}	H(C[6]C[6]2)	118.1050	0.352	2	118.1050	0.124	2	118.1050	0.124	2	118.5512	1.573	86	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:3:	3:	C[6]-3:C[6]-4:H-1:	N[6,6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[6,6]C[6a])(C[6]C[6a]C[6]H)(H)	C[6](N[6,6]C[6,6]S[6])(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]C[6a])(C[6]C[6a]C[6]H)(H){1|C<4>,1|S<4>,2|H<1>,4|C<3>}	C[6](N[6,6]C[6,6]S[6])(C[6a]C[6a]2)(C[6]C[6]H){1|C<4>,1|N<3>,2|O<1>,4|C<3>,4|H<1>}	H(C[6]C[6]2)	116.9260	0.000	1	116.9260	0.000	1	117.8737	0.880	3	118.5512	1.573	86	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:3:	3:	C[6]-3:C[6]-4:H-1:	N[6,6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[6,6]C[6a])(C[6]O[6]CO)(H)	C[6](N[6,6]C[6,6a]C[6,6])(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]C[6a])(C[6]O[6]CO)(H){1|C<4>,3|C<3>}	C[6](N[6,6]C[6,6a]C[6,6])(C[6a]C[6a]2)(C[6]C[6]H){1|C<4>,2|O<2>,3|H<1>,5|C<3>}	H(C[6]C[6]2)	118.3475	0.643	2	118.3475	0.413	2	117.8737	0.880	3	118.5512	1.573	86	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:3:	3:	C[6]-3:C[6]-4:H-1:	N[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(C[6]C[6]HH)(H)	C[6](N[6]B[5]C[6])(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6])(C[6]C[6]HH)(H){1|B<3>,1|H<1>,3|C<3>}	C[6](N[6]B[5]C[6])(C[6a]C[6a]2)(C[6]C[6]H){2|O<2>,3|C<3>,5|H<1>}	H(C[6]C[6]2)	118.4780	0.000	1	118.4780	0.000	1	118.4780	0.000	1	118.5512	1.573	86	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:3:	3:	C[6]-3:P[6]-4:H-1:	C[6,6a]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]C[6a])(P[6]C[6a]C[6]S)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2)(C[6]P[6]H)	H(C[6]C[6]P[6])	C[6](C[6]C[6,6a]C[6a])(P[6]C[6a]C[6]S)(H){1|H<1>,7|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2)(C[6]P[6]H){1|C<4>,1|S<1>,3|H<1>,5|C<3>}	H(C[6]C[6]P[6])	118.4420	0.503	2	118.4420	0.253	2	118.4420	0.253	2	118.5512	1.573	86	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:3:	3:	C[6]-3:S[6]-4:H-1:	C[5a]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[5a]N[6])(S[6]C[6]OO)(H)	C[6](C[5a]C[5a]N[5a])(C[6]S[6]H)(N[6]C[6]H)	H(C[6]C[6]S[6])	C[6](C[6]C[5a]N[6])(S[6]C[6]OO)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[5a]C[5a]N[5a])(C[6]S[6]H)(N[6]C[6]H){1|C<4>,1|H<1>,2|O<1>,4|C<3>}	H(C[6]C[6]S[6])	117.8800	0.000	1	117.8800	0.000	1	117.8800	0.000	1	118.5512	1.573	86	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:3:	3:	C[6]-3:S[6]-4:H-1:	C[6]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(S[6]C[6]OO)(H)	C[6](C[6]C[6]N[6])(C[6]S[6]H)(N[6]C[6]H)	H(C[6]C[6]S[6])	C[6](C[6]C[6]N[6])(S[6]C[6]OO)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]N[6])(C[6]S[6]H)(N[6]C[6]H){1|S<4>,2|H<1>,2|O<1>,3|C<3>}	H(C[6]C[6]S[6])	118.7185	0.541	2	118.4963	0.166	4	118.4963	0.166	4	118.5512	1.573	86	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:3:	3:	C[6]-3:S[6]-4:H-1:	C[6]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(S[6]C[6]OO)(H)	C[6](C[6]C[6]N[6])(C[6]S[6]H)(N[6]C[6]H)	H(C[6]C[6]S[6])	C[6](C[6]C[6]N[6])(S[6]C[6]OO)(H){1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6]N[6])(C[6]S[6]H)(N[6]C[6]H){1|S<4>,2|H<1>,2|O<1>,3|C<3>}	H(C[6]C[6]S[6])	118.2740	0.085	2	118.4963	0.166	4	118.4963	0.166	4	118.5512	1.573	86	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:3:	3:	C[6]-3:S[6]-4:H-1:	C[6a]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(S[6]C[6]OO)(H)	C[6](C[6a]C[6a]2)(C[6]S[6]H)(N[6]C[6]H)	H(C[6]C[6]S[6])	C[6](C[6]C[6a]N[6])(S[6]C[6]OO)(H){2|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]S[6]H)(N[6]C[6]H){2|H<1>,2|O<1>,4|C<3>}	H(C[6]C[6]S[6])	118.2690	0.331	2	118.2690	0.110	2	118.4536	0.128	5	118.5512	1.573	86	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:3:	3:	C[6]-3:S[6]-4:H-1:	C[6a]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(S[6]C[6]OO)(H)	C[6](C[6a]C[6a]N[6a])(C[6]S[6]H)(N[6]C[6]H)	H(C[6]C[6]S[6])	C[6](C[6]C[6a]N[6])(S[6]C[6]OO)(H){1|N<2>,2|C<3>,2|H<1>}	C[6](C[6a]C[6a]N[6a])(C[6]S[6]H)(N[6]C[6]H){1|C<4>,1|H<1>,2|O<1>,3|C<3>}	H(C[6]C[6]S[6])	118.1860	0.000	1	118.5767	0.145	3	118.4536	0.128	5	118.5512	1.573	86	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:3:	3:	C[6]-3:S[6]-4:H-1:	C[6a]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6])(S[6]C[6]OO)(H)	C[6](C[6a]C[6a]N[6a])(C[6]S[6]H)(N[6]C[6]H)	H(C[6]C[6]S[6])	C[6](C[6]C[6a]N[6])(S[6]C[6]OO)(H){1|N<2>,2|C<3>,2|H<1>}	C[6](C[6a]C[6a]N[6a])(C[6]S[6]H)(N[6]C[6]H){1|H<1>,2|O<1>,4|C<3>}	H(C[6]C[6]S[6])	118.7720	0.247	2	118.5767	0.145	3	118.4536	0.128	5	118.5512	1.573	86	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:3:	3:	C[6]-3:Si[6]-4:H-1:	C[6,6a]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]C[6a])(Si[6]C[6]CC)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2)(C[6]Si[6]H)	H(C[6]Si[6]C[6])	C[6](C[6]C[6,6a]C[6a])(Si[6]C[6]CC)(H){2|H<1>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6a]C[6a]2)(C[6]Si[6]H){3|C<4>,3|H<1>,4|C<3>}	H(C[6]Si[6]C[6])	119.0505	0.209	2	119.0505	0.044	2	119.0505	0.044	2	118.5512	1.573	86	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:4:	3:	C[6]-3:C[6]-4:H-1:	C[6,6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6]C)(C[6]C[6]HH)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(CC[6]HH)	H(C[6]C[6]2)	C[6](C[6]C[6,6]C)(C[6]C[6]HH)(H){1|C<3>,1|C<4>,2|H<1>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(CC[6]HH){1|C<3>,3|C<4>,3|H<1>}	H(C[6]C[6]2)	117.7420	0.000	1	117.7420	0.000	1	117.5925	0.094	4	118.1429	8.160	14	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:4:	3:	C[6]-3:C[6]-4:H-1:	C[6,6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6]C)(C[6]C[6]HH)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(CC[6a]HH)	H(C[6]C[6]2)	C[6](C[6]C[6,6]C)(C[6]C[6]HH)(H){1|C<3>,1|C<4>,2|H<1>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(CC[6a]HH){1|O<2>,3|C<4>,3|H<1>}	H(C[6]C[6]2)	117.1380	0.000	1	117.1380	0.000	1	117.5925	0.094	4	118.1429	8.160	14	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:4:	3:	C[6]-3:C[6]-4:H-1:	C[6,6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6]C)(C[6]C[6]HH)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6]C)(C[6]C[6]HH)(H){1|C<3>,1|C<4>,2|H<1>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(CH3){1|C<3>,3|C<4>,3|H<1>}	H(C[6]C[6]2)	117.6920	0.000	1	117.7450	0.006	2	117.5925	0.094	4	118.1429	8.160	14	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:4:	3:	C[6]-3:C[6]-4:H-1:	C[6,6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6]C)(C[6]C[6]HH)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6]C)(C[6]C[6]HH)(H){1|C<4>,1|H<1>,2|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(CH3){1|C<3>,2|C<4>,4|H<1>}	H(C[6]C[6]2)	117.7980	0.000	1	117.7450	0.006	2	117.5925	0.094	4	118.1429	8.160	14	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:4:	3:	C[6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]C[6]CC)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]C[6]CC)(H){2|C<3>,2|H<1>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CH3){2|C<4>,4|C<3>}	H(C[6]C[6]2)	118.9510	0.000	1	118.9510	0.000	1	119.3781	1.422	9	118.1429	8.160	14	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:4:	3:	C[6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]C[6]HH)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]C[6]HH)(H){2|C<3>,2|H<1>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CC3){1|C<4>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	119.0565	0.035	2	119.0565	0.001	2	119.3781	1.422	9	118.1429	8.160	14	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:4:	3:	C[6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]C[6]HH)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]C[6]HH)(H){2|C<3>,2|H<1>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CH3){1|C<4>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	119.2510	0.000	1	119.2510	0.000	1	119.3781	1.422	9	118.1429	8.160	14	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:4:	3:	C[6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]N[6]CC)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]N[6]CC)(H){1|H<1>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CH3){1|H<1>,1|N<3>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	119.3345	2.799	2	119.3345	7.837	2	119.3781	1.422	9	118.1429	8.160	14	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:4:	3:	C[6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]N[6]NiO)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CF3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]N[6]NiO)(H){2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CF3){1|Ni<6>,1|H<1>,1|N<3>,1|O<2>,2|C<3>}	H(C[6]C[6]2)	120.9570	0.000	1	120.9570	0.000	1	119.3781	1.422	9	118.1429	8.160	14	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:4:	3:	C[6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]N[6]NiO)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]N[6]NiO)(H){2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CH3){1|Ni<6>,1|H<1>,1|N<3>,1|O<2>,2|C<3>}	H(C[6]C[6]2)	119.7770	0.000	1	119.7770	0.000	1	119.3781	1.422	9	118.1429	8.160	14	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:4:	3:	C[6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]C)(C[6]O[6]CC)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C)(C[6]O[6]CC)(H){2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CH3){1|C<3>,1|O<1>,2|C<4>,2|O<2>}	H(C[6]C[6]2)	118.6850	0.000	1	118.6850	0.000	1	119.3781	1.422	9	118.1429	8.160	14	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:3:4:	3:	C[6]-3:C[6]-4:H-1:	N[6,6a]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6,6a]C)(C[6]S[6]CC)(H)	C[6](N[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6,6a]C)(C[6]S[6]CC)(H){2|C<3>}	C[6](N[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CH3){1|C<3>,1|N<2>,1|O<1>,1|S<2>,2|C<4>}	H(C[6]C[6]2)	109.2280	0.000	1	109.2280	0.000	1	109.2280	0.000	1	118.1429	8.160	14	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:4:3:	3:	C[6]-3:C[6]-4:H-1:	C[4]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[4]C[6])(C[6]C[6]HH)(H)	C[6](C[4]C[4]P[4])(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[4]C[6])(C[6]C[6]HH)(H){1|C<3>,1|C<4>,1|P<4>,4|H<1>}	C[6](C[4]C[4]P[4])(C[6]C[6]HH)(C[6]C[6]H){1|B<4>,1|C<4>,3|C<3>,4|H<1>}	H(C[6]C[6]2)	118.2720	0.511	2	118.2720	0.261	2	118.2720	0.261	2	118.1935	1.882	53	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:4:3:	3:	C[6]-3:C[6]-4:H-1:	C[5]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6]HH)(H)	C[6](C[5]C[5,6,6]C[5])(C[6]C[6]HO)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6]HH)(H){1|C<3>,1|O<2>,2|C<4>,3|H<1>}	C[6](C[5]C[5,6,6]C[5])(C[6]C[6]HO)(C[6]C[6]H){1|O<2>,4|C<4>,5|H<1>}	H(C[6]C[6]2)	117.2915	0.015	2	117.2915	0.000	2	117.2915	0.000	2	118.1935	1.882	53	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:4:3:	3:	C[6]-3:C[6]-4:H-1:	C[5a]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]CH)(H)	C[6](C[5a]N[5a]2)(C[6]C[6]CH)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]CH)(H){1|C<3>,1|C<4>,1|N<2>,1|N<3>,2|H<1>}	C[6](C[5a]N[5a]2)(C[6]C[6]CH)(C[6]C[6]H){2|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.4120	0.000	1	119.4120	0.000	1	118.8282	0.370	4	118.1935	1.882	53	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:4:3:	3:	C[6]-3:C[6]-4:H-1:	C[5a]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]HH)(H)	C[6](C[5a]C[5a]2)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]HH)(H){1|C<4>,2|C<3>,4|H<1>}	C[6](C[5a]C[5a]2)(C[6]C[6]HH)(C[6]C[6]H){1|C<4>,2|C<3>,2|N<3>,4|H<1>}	H(C[6]C[6]2)	118.1020	0.000	1	118.1020	0.000	1	118.8282	0.370	4	118.1935	1.882	53	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:4:3:	3:	C[6]-3:C[6]-4:H-1:	C[5a]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]HH)(H)	C[6](C[5a]C[5a]N[5a])(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]HH)(H){1|C<3>,1|C<4>,1|N<2>,4|H<1>}	C[6](C[5a]C[5a]N[5a])(C[6]C[6]HH)(C[6]C[6]H){1|C<4>,1|N<2>,1|N<3>,5|H<1>}	H(C[6]C[6]2)	119.2390	0.000	1	119.2390	0.000	1	118.8282	0.370	4	118.1935	1.882	53	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:4:3:	3:	C[6]-3:C[6]-4:H-1:	C[5a]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[6]HH)(H)	C[6](C[5a]C[5a]O[5a])(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[6]HH)(H){1|C<3>,1|C<4>,1|O<2>,4|H<1>}	C[6](C[5a]C[5a]O[5a])(C[6]C[6]HH)(C[6]C[6]H){1|C<3>,1|C<4>,1|N<2>,5|H<1>}	H(C[6]C[6]2)	118.5600	0.000	1	118.5600	0.000	1	118.8282	0.370	4	118.1935	1.882	53	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:4:3:	3:	C[6]-3:C[6]-4:H-1:	C[6,6a]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]C[6])(C[6]C[6]HO)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6a]C[6]H)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C[6])(C[6]C[6]HO)(H){1|C<4>,1|O<2>,2|H<1>,3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6a]C[6]H)(C[6]C[6]H){1|O<2>,2|C<4>,4|C<3>,4|H<1>}	H(C[6]C[6]2)	119.0400	0.000	1	119.0400	0.000	1	119.0400	0.000	1	118.1935	1.882	53	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:4:3:	3:	C[6]-3:C[6]-4:H-1:	C[6a]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]CC)(H)	C[6](C[6a]C[6a]2)(C[6]N[6]HH)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]CC)(H){1|N<3>,2|C<3>,4|H<1>}	C[6](C[6a]C[6a]2)(C[6]N[6]HH)(C[6]C[6]H){1|S<4>,2|C<3>,2|H<1>,3|C<4>}	H(C[6]C[6]2)	117.7380	0.000	1	117.7380	0.000	1	117.9356	2.261	36	118.1935	1.882	53	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:4:3:	3:	C[6]-3:C[6]-4:H-1:	C[6a]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]CH)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]CH)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]CH)(H){2|C<4>,2|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]CH)(C[6]C[6]H){2|C<3>,3|C<4>,4|H<1>}	H(C[6]C[6]2)	117.4270	0.000	1	117.4270	0.000	1	117.9356	2.261	36	118.1935	1.882	53	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:4:3:	3:	C[6]-3:C[6]-4:H-1:	C[6a]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]CH)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]CH)(H){1|C<4>,3|C<3>,3|H<1>}	C[6](C[6a]C[6a]2)(C[6]C[6]HH)(C[6]C[6]H){1|O<2>,2|C<3>,3|C<4>,3|H<1>}	H(C[6]C[6]2)	118.1250	0.000	1	117.9034	0.165	5	117.9356	2.261	36	118.1935	1.882	53	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:4:3:	3:	C[6]-3:C[6]-4:H-1:	C[6a]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]CH)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]CH)(H){1|C<4>,3|C<3>,3|H<1>}	C[6](C[6a]C[6a]2)(C[6]C[6]HH)(C[6]C[6]H){2|C<3>,3|C<4>,4|H<1>}	H(C[6]C[6]2)	117.8480	0.447	4	117.9034	0.165	5	117.9356	2.261	36	118.1935	1.882	53	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:4:3:	3:	C[6]-3:C[6]-4:H-1:	C[6a]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]HH)(H)	C[6](C[6a]C[6a,6a]C[6a])(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]HH)(H){1|C<4>,3|C<3>,3|H<1>}	C[6](C[6a]C[6a,6a]C[6a])(C[6]C[6]HH)(C[6]C[6]H){1|C<4>,3|C<3>,5|H<1>}	H(C[6]C[6]2)	120.3840	0.000	1	120.3840	0.000	1	117.9356	2.261	36	118.1935	1.882	53	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:4:3:	3:	C[6]-3:C[6]-4:H-1:	C[6a]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]HH)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]CH)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]HH)(H){2|C<3>,2|C<4>,3|H<1>}	C[6](C[6a]C[6a]2)(C[6]C[6]CH)(C[6]C[6]H){1|C<4>,2|C<3>,6|H<1>}	H(C[6]C[6]2)	117.2565	0.428	2	117.2565	0.183	2	117.9356	2.261	36	118.1935	1.882	53	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:4:3:	3:	C[6]-3:C[6]-4:H-1:	C[6a]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]HH)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]HH)(H){1|C<4>,1|N<3>,2|H<1>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]HH)(C[6]C[6]H){1|C<4>,2|C<3>,6|H<1>}	H(C[6]C[6]2)	123.9530	0.000	1	123.9530	0.000	1	117.9356	2.261	36	118.1935	1.882	53	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:4:3:	3:	C[6]-3:C[6]-4:H-1:	C[6a]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]HH)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]HN)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]HH)(H){1|C<4>,1|N<2>,2|C<3>,3|H<1>}	C[6](C[6a]C[6a]2)(C[6]C[6]HN)(C[6]C[6]H){1|C<4>,2|C<3>,6|H<1>}	H(C[6]C[6]2)	117.5970	0.226	4	117.5970	0.051	4	117.9356	2.261	36	118.1935	1.882	53	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:4:3:	3:	C[6]-3:C[6]-4:H-1:	C[6a]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]HH)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]HO)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]HH)(H){1|C<4>,1|O<2>,2|C<3>,3|H<1>}	C[6](C[6a]C[6a]2)(C[6]C[6]HO)(C[6]C[6]H){1|C<4>,2|C<3>,6|H<1>}	H(C[6]C[6]2)	117.6930	0.000	1	117.6930	0.000	1	117.9356	2.261	36	118.1935	1.882	53	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:4:3:	3:	C[6]-3:C[6]-4:H-1:	C[6a]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]HH)(H)	C[6](C[6a]C[6a]2)(C[6]O[6]HH)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]HH)(H){1|O<2>,3|C<3>,3|H<1>}	C[6](C[6a]C[6a]2)(C[6]O[6]HH)(C[6]C[6]H){1|C<4>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	118.4640	0.000	1	118.4640	0.000	1	117.9356	2.261	36	118.1935	1.882	53	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:4:3:	3:	C[6]-3:C[6]-4:H-1:	C[6a]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]HH)(H)	C[6](C[6a]C[6a]O[6a])(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]HH)(H){1|C<3>,1|C<4>,1|O<2>,4|H<1>}	C[6](C[6a]C[6a]O[6a])(C[6]C[6]HH)(C[6]C[6]H){1|C<4>,1|I<1>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	118.0030	0.000	1	118.0030	0.000	1	117.9356	2.261	36	118.1935	1.882	53	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:4:3:	3:	C[6]-3:C[6]-4:H-1:	C[6a]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]OO)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]OO)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]OO)(H){2|O<2>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]OO)(C[6]C[6]H){2|O<2>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	116.6780	0.092	3	116.6780	0.008	3	117.9356	2.261	36	118.1935	1.882	53	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:4:3:	3:	C[6]-3:C[6]-4:H-1:	C[6a]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]PdH)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]CH)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]PdH)(H){1|H<1>,2|C<3>,3|C<4>}	C[6](C[6a]C[6a]2)(C[6]C[6]CH)(C[6]C[6]H){1|Pd<5>,1|C<4>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	118.6345	0.022	2	118.6345	0.000	2	117.9356	2.261	36	118.1935	1.882	53	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:4:3:	3:	C[6]-3:C[6]-4:H-1:	C[6a]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]CH)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]CH)(H){1|C<4>,1|S<4>,2|C<3>,2|H<1>}	C[6](C[6a]C[6a]2)(C[6]C[6]HH)(C[6]C[6]H){1|C<4>,1|N<3>,3|C<3>,4|H<1>}	H(C[6]C[6]2)	116.7830	0.000	1	116.7830	0.000	1	117.9356	2.261	36	118.1935	1.882	53	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:4:3:	3:	C[6]-3:C[6]-4:H-1:	C[6a]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]HH)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]CH)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]HH)(H){1|C<4>,1|H<1>,1|S<4>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]CH)(C[6]C[6]H){1|N<3>,2|C<3>,6|H<1>}	H(C[6]C[6]2)	116.9040	0.000	1	117.7763	1.374	3	117.9356	2.261	36	118.1935	1.882	53	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:4:3:	3:	C[6]-3:C[6]-4:H-1:	C[6a]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]HH)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]CH)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]HH)(H){1|H<1>,1|S<4>,2|C<3>,2|C<4>}	C[6](C[6a]C[6a]2)(C[6]C[6]CH)(C[6]C[6]H){1|N<3>,2|C<3>,6|H<1>}	H(C[6]C[6]2)	117.3160	0.000	1	117.7763	1.374	3	117.9356	2.261	36	118.1935	1.882	53	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:4:3:	3:	C[6]-3:C[6]-4:H-1:	C[6a]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]HH)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]CH)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]HH)(H){1|H<1>,2|C<4>,3|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]CH)(C[6]C[6]H){1|N<2>,1|N<3>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	119.1090	0.000	1	117.7763	1.374	3	117.9356	2.261	36	118.1935	1.882	53	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:4:3:	3:	C[6]-3:C[6]-4:H-1:	C[6a]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]HH)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]HH)(H){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	C[6](C[6a]C[6a]2)(C[6]C[6]HH)(C[6]C[6]H){1|N<3>,3|C<3>,5|H<1>}	H(C[6]C[6]2)	118.2260	0.000	1	117.7238	5.848	5	117.9356	2.261	36	118.1935	1.882	53	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:4:3:	3:	C[6]-3:C[6]-4:H-1:	C[6a]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]HH)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]HH)(H){1|C<4>,2|C<3>,4|H<1>}	C[6](C[6a]C[6a]2)(C[6]C[6]HH)(C[6]C[6]H){1|C<4>,1|N<4>,2|C<3>,5|H<1>}	H(C[6]C[6]2)	119.0200	0.000	1	117.7238	5.848	5	117.9356	2.261	36	118.1935	1.882	53	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:4:3:	3:	C[6]-3:C[6]-4:H-1:	C[6a]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]HH)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]HH)(H){1|C<4>,2|C<3>,4|H<1>}	C[6](C[6a]C[6a]2)(C[6]C[6]HH)(C[6]C[6]H){1|N<4>,2|C<3>,2|F<1>,4|H<1>}	H(C[6]C[6]2)	115.2815	0.059	2	117.7238	5.848	5	117.9356	2.261	36	118.1935	1.882	53	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:4:3:	3:	C[6]-3:C[6]-4:H-1:	C[6a]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]HH)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]HH)(H){2|C<3>,2|C<4>,2|H<1>}	C[6](C[6a]C[6a]2)(C[6]C[6]HH)(C[6]C[6]H){1|N<3>,2|C<3>,6|H<1>}	H(C[6]C[6]2)	120.8100	0.000	1	117.7238	5.848	5	117.9356	2.261	36	118.1935	1.882	53	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:4:3:	3:	C[6]-3:C[6]-4:H-1:	C[6a]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]O[6]CC)(H)	C[6](C[6a]C[6a]2)(C[6]N[6]HO)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]O[6]CC)(H){1|H<1>,1|N<3>,1|O<2>,2|C<3>}	C[6](C[6a]C[6a]2)(C[6]N[6]HO)(C[6]C[6]H){1|O<2>,2|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	118.1310	0.000	1	118.1310	0.000	1	117.9356	2.261	36	118.1935	1.882	53	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:4:3:	3:	C[6]-3:C[6]-4:H-1:	C[6a]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]O[6]CH)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]O[6]CH)(H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6a]C[6a]2)(C[6]C[6]HH)(C[6]C[6]H){1|C<4>,1|O<2>,2|C<3>,5|H<1>}	H(C[6]C[6]2)	117.3540	0.000	1	117.6505	0.176	2	117.9356	2.261	36	118.1935	1.882	53	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:4:3:	3:	C[6]-3:C[6]-4:H-1:	C[6a]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]O[6]CH)(H)	C[6](C[6a]C[6a]2)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]O[6]CH)(H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6a]C[6a]2)(C[6]C[6]HH)(C[6]C[6]H){1|C<4>,1|O<2>,3|C<3>,4|H<1>}	H(C[6]C[6]2)	117.9470	0.000	1	117.6505	0.176	2	117.9356	2.261	36	118.1935	1.882	53	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:4:3:	3:	C[6]-3:C[6]-4:H-1:	C[6a]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]O[6]HH)(H)	C[6](C[6a]C[6a,6a]C[6a])(C[6]C[6]CH)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]O[6]HH)(H){1|C<4>,1|H<1>,3|C<3>}	C[6](C[6a]C[6a,6a]C[6a])(C[6]C[6]CH)(C[6]C[6]H){2|O<2>,3|C<3>,4|H<1>}	H(C[6]C[6]2)	118.1360	0.000	1	118.1360	0.000	1	117.9356	2.261	36	118.1935	1.882	53	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:4:3:	3:	C[6]-3:C[6]-4:H-1:	N[5]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[5])(C[6]N[6]HH)(H)	C[6](N[5]C[5,6a]C[5])(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[5])(C[6]N[6]HH)(H){2|C<3>,2|C<4>,2|H<1>}	C[6](N[5]C[5,6a]C[5])(C[6]C[6]HH)(C[6]C[6]H){1|N<2>,1|N<3>,1|O<1>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	118.3070	0.000	1	118.3070	0.000	1	118.3070	0.000	1	118.1935	1.882	53	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:4:3:	3:	C[6]-3:C[6]-4:H-1:	N[5]-3:N[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]N[5]N[6])(C[6]C[6]HH)(H)	C[6](N[5]C[5]N[5])(N[6]C[6]RuB)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[5]N[6])(C[6]C[6]HH)(H){1|Ru<7>,1|B<5>,1|H<1>,1|N<3>,2|C<3>}	C[6](N[5]C[5]N[5])(N[6]C[6]RuB)(C[6]C[6]H){2|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.2730	0.000	1	119.2730	0.000	1	119.2730	0.000	1	118.1935	1.882	53	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:4:3:	3:	C[6]-3:C[6]-4:H-1:	N[5a]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]N[5a]C[6])(C[6]C[6]HH)(H)	C[6](N[5a]C[5a,6a]C[5a])(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[5a]C[6])(C[6]C[6]HH)(H){1|C<4>,2|C<3>,4|H<1>}	C[6](N[5a]C[5a,6a]C[5a])(C[6]C[6]HH)(C[6]C[6]H){1|C<4>,1|N<3>,1|O<1>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	118.7710	0.000	1	118.7710	0.000	1	119.2523	0.619	6	118.1935	1.882	53	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	3:4:3:	3:	C[6]-3:C[6]-4:H-1:	N[5a]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]N[5a]C[6])(C[6]N[6]HH)(H)	C[6](N[5a]C[5a,6a]C[5a])(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[5a]C[6])(C[6]N[6]HH)(H){2|C<3>,2|C<4>,2|H<1>}	C[6](N[5a]C[5a,6a]C[5a])(C[6]C[6]HH)(C[6]C[6]H){1|O<1>,2|C<3>,2|N<3>,4|H<1>}	H(C[6]C[6]2)	119.3486	0.839	5	119.3486	0.704	5	119.2523	0.619	6	118.1935	1.882	53	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[3x6]-4:H-1:	C[4,5,6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[4,5,6,6]H)(C[3x6]C[3x6]2H)(H)	C[6](C[4,5,6,6]C[4,5,5,6]C[4,5,6,6]C[5,6])(C[6]C[3x6]H)(H)	H(C[6]C[3x6]C[6])	C[6](C[6]C[4,5,6,6]H)(C[3x6]C[3x6]2H)(H){2|C<3>,2|H<1>,4|C<4>}	C[6](C[4,5,6,6]C[4,5,5,6]C[4,5,6,6]C[5,6])(C[6]C[3x6]H)(H){1|O<1>,1|O<2>,2|H<1>,5|C<4>}	H(C[6]C[3x6]C[6])	116.7090	0.000	1	116.7090	0.000	1	116.5110	0.078	2	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[3x6]-4:H-1:	C[4,5,6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[4,5,6,6]H)(C[3x6]C[3x6]2H)(H)	C[6](C[4,5,6,6]C[4,5,6,6]2C[5,6])(C[6]C[3x6]H)(H)	H(C[6]C[3x6]C[6])	C[6](C[6]C[4,5,6,6]H)(C[3x6]C[3x6]2H)(H){2|C<3>,2|H<1>,4|C<4>}	C[6](C[4,5,6,6]C[4,5,6,6]2C[5,6])(C[6]C[3x6]H)(H){1|O<1>,1|O<2>,2|H<1>,5|C<4>}	H(C[6]C[3x6]C[6])	116.3130	0.000	1	116.3130	0.000	1	116.5110	0.078	2	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[3,5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[3,5,6]H)(C[6]N[6,6]HH)(H)	C[6](C[3,5,6]C[5,6,6]C[3,5]C[3])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[3,5,6]H)(C[6]N[6,6]HH)(H){4|C<4>}	C[6](C[3,5,6]C[5,6,6]C[3,5]C[3])(C[6]C[6]H)(H){1|N<3>,3|C<4>,5|H<1>}	H(C[6]C[6]2)	117.4550	0.000	1	117.4550	0.000	1	120.2140	15.224	2	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[3,5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[3,5,6]H)(C[6]N[6]HH)(H)	C[6](C[3,5,6]C[3,5]C[5,6]C[3])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[3,5,6]H)(C[6]N[6]HH)(H){1|C<3>,3|C<4>}	C[6](C[3,5,6]C[3,5]C[5,6]C[3])(C[6]C[6]H)(H){1|N<3>,3|C<3>,5|H<1>}	H(C[6]C[6]2)	122.9730	0.000	1	122.9730	0.000	1	120.2140	15.224	2	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[3,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[3,6]H)(C[6]C[6]HH)(H)	C[6](C[3,6]C[3,5,6]C[3,5]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[3,6]H)(C[6]C[6]HH)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[3,6]C[3,5,6]C[3,5]C[6a])(C[6]C[6]H)(H){2|C<3>,3|C<4>,3|H<1>}	H(C[6]C[6]2)	118.5155	0.226	2	118.6177	0.057	3	118.6990	0.064	4	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[3,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[3,6]H)(C[6]C[6]HH)(H)	C[6](C[3,6]C[3,5,6]C[3,5]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[3,6]H)(C[6]C[6]HH)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[3,6]C[3,5,6]C[3,5]C[6a])(C[6]C[6]H)(H){2|C<4>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	118.8220	0.000	1	118.6177	0.057	3	118.6990	0.064	4	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[3,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[3,6]H)(C[6]C[6]HH)(H)	C[6](C[3,6]C[3,6]N[3]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[3,6]H)(C[6]C[6]HH)(H){1|C<4>,1|N<3>,3|H<1>}	C[6](C[3,6]C[3,6]N[3]H)(C[6]C[6]H)(H){1|C<4>,1|N<3>,3|H<1>}	H(C[6]C[6]2)	118.9430	0.000	1	118.9430	0.000	1	118.6990	0.064	4	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[3x6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[3x6]H)(C[6]C[6]HH)(H)	C[6](C[3x6]C[3x6]2H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[3x6]H)(C[6]C[6]HH)(H){2|C<4>,3|H<1>}	C[6](C[3x6]C[3x6]2H)(C[6]C[6]H)(H){2|C<4>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	118.1370	0.000	1	118.1370	0.000	1	118.1625	0.001	2	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[3x6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[3x6]H)(C[6]C[6]HH)(H)	C[6](C[3x6]C[3x6]C[6]O[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[3x6]H)(C[6]C[6]HH)(H){1|H<1>,1|O<2>,3|C<4>}	C[6](C[3x6]C[3x6]C[6]O[6])(C[6]C[6]H)(H){4|H<1>,5|C<4>}	H(C[6]C[6]2)	118.1880	0.000	1	118.1880	0.000	1	118.1625	0.001	2	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[4,5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[4,5,6]H)(C[6]C[6]HO)(H)	C[6](C[4,5,6]C[4,5]C[5,6]N[4])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[4,5,6]H)(C[6]C[6]HO)(H){1|N<3>,2|C<4>,2|H<1>}	C[6](C[4,5,6]C[4,5]C[5,6]N[4])(C[6]C[6]H)(H){1|C<3>,2|O<2>,3|C<4>,3|H<1>}	H(C[6]C[6]2)	118.7510	0.000	1	118.7510	0.000	1	118.7510	0.000	1	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[4,5,6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[4,5,6]O)(C[6]C[6]HH)(H)	C[6](C[4,5,6]C[4,5]C[4,6]C[5])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[4,5,6]O)(C[6]C[6]HH)(H){2|H<1>,3|C<4>}	C[6](C[4,5,6]C[4,5]C[4,6]C[5])(C[6]C[6]H)(O){1|O<2>,4|C<4>,5|H<1>}	H(C[6]C[6]2)	123.7820	0.000	1	123.7820	0.000	1	123.7820	0.000	1	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[4,6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[4,6,6]H)(C[6]N[6,6]HH)(H)	C[6](C[4,6,6]C[4,3x6]C[4]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[4,6,6]H)(C[6]N[6,6]HH)(H){4|C<4>}	C[6](C[4,6,6]C[4,3x6]C[4]C[6])(C[6]C[6]H)(H){1|C<3>,1|N<3>,4|C<4>,4|H<1>}	H(C[6]C[6]2)	118.2180	0.000	1	118.2180	0.000	1	118.2180	0.000	1	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[4,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[4,6]H)(C[6]C[6]HH)(H)	C[6](C[4,6]C[4,5,6]C[4,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[4,6]H)(C[6]C[6]HH)(H){2|C<4>,3|H<1>}	C[6](C[4,6]C[4,5,6]C[4,6]H)(C[6]C[6]H)(H){3|H<1>,4|C<4>}	H(C[6]C[6]2)	122.1220	0.000	1	122.1220	0.000	1	119.4370	5.804	3	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[4,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[4,6]H)(C[6]C[6]HH)(H)	C[6](C[4,6]C[4,6]C[4]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[4,6]H)(C[6]C[6]HH)(H){1|Br<1>,1|C<3>,1|C<4>,2|H<1>}	C[6](C[4,6]C[4,6]C[4]H)(C[6]C[6]H)(H){1|C<4>,1|O<1>,1|O<2>,3|H<1>}	H(C[6]C[6]2)	118.7250	0.000	1	118.0945	0.795	2	119.4370	5.804	3	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[4,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[4,6]H)(C[6]C[6]HH)(H)	C[6](C[4,6]C[4,6]C[4]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[4,6]H)(C[6]C[6]HH)(H){1|C<4>,1|H<1>,2|C<3>}	C[6](C[4,6]C[4,6]C[4]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,4|H<1>}	H(C[6]C[6]2)	117.4640	0.000	1	118.0945	0.795	2	119.4370	5.804	3	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[4x6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[4x6]H)(C[6]C[6]HO)(H)	C[6](C[4x6]C[3x6]2C[6,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[4x6]H)(C[6]C[6]HO)(H){5|C<4>}	C[6](C[4x6]C[3x6]2C[6,6])(C[6]C[6]H)(H){2|O<2>,4|C<4>,5|H<1>}	H(C[6]C[6]2)	119.8110	0.000	1	119.8110	0.000	1	119.8110	0.000	1	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[5,3x6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,3x6]H)(C[6]C[6]HH)(H)	C[6](C[5,3x6]C[5,3x6]C[3x6]N[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,3x6]H)(C[6]C[6]HH)(H){1|N<3>,2|C<4>,2|H<1>}	C[6](C[5,3x6]C[5,3x6]C[3x6]N[5])(C[6]C[6]H)(H){1|C<3>,4|C<4>,5|H<1>}	H(C[6]C[6]2)	118.0970	0.000	1	118.0970	0.000	1	118.1955	0.019	2	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[5,3x6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,3x6]H)(C[6]C[6]HO)(H)	C[6](C[5,3x6]C[3x6]C[5,6]2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,3x6]H)(C[6]C[6]HO)(H){1|C<3>,1|H<1>,3|C<4>}	C[6](C[5,3x6]C[3x6]C[5,6]2)(C[6]C[6]H)(H){1|O<2>,4|C<4>,6|H<1>}	H(C[6]C[6]2)	118.2940	0.000	1	118.2940	0.000	1	118.1955	0.019	2	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[5,5,6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,5,6,6]H)(C[6]C[6]HH)(H)	C[6](C[5,5,6,6]C[5,6,6]C[5,5]C[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,5,6,6]H)(C[6]C[6]HH)(H){2|H<1>,3|C<4>}	C[6](C[5,5,6,6]C[5,6,6]C[5,5]C[5,6])(C[6]C[6]H)(H){1|O<2>,2|C<3>,3|C<4>,5|H<1>}	H(C[6]C[6]2)	117.1590	0.000	1	117.1590	0.000	1	117.1590	0.000	1	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[5,5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,5,6]H)(C[6]C[5,6]CH)(H)	C[6](C[5,5,6]C[5,5,6]C[5,5]O[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,5,6]H)(C[6]C[5,6]CH)(H){1|H<1>,1|O<2>,3|C<4>}	C[6](C[5,5,6]C[5,5,6]C[5,5]O[5])(C[6]C[6]H)(H){1|C<3>,1|O<2>,2|H<1>,5|C<4>}	H(C[6]C[6]2)	119.5122	0.167	4	119.5122	0.028	4	118.8613	0.433	13	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[5,5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,5,6]H)(C[6]C[5,6]HO)(H)	C[6](C[5,5,6]C[5,5,6]C[5,6]O[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,5,6]H)(C[6]C[5,6]HO)(H){1|C<3>,1|O<2>,3|C<4>}	C[6](C[5,5,6]C[5,5,6]C[5,6]O[5])(C[6]C[6]H)(H){1|C<3>,1|O<2>,3|H<1>,4|C<4>}	H(C[6]C[6]2)	118.4473	0.207	3	118.4473	0.043	3	118.8613	0.433	13	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[5,5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,5,6]H)(C[6]C[5,6]HO)(H)	C[6](C[5,5,6]C[5,5]C[5,6]O[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,5,6]H)(C[6]C[5,6]HO)(H){1|C<3>,1|H<1>,1|O<2>,2|C<4>}	C[6](C[5,5,6]C[5,5]C[5,6]O[5,6])(C[6]C[6]H)(H){1|C<3>,1|O<2>,3|H<1>,4|C<4>}	H(C[6]C[6]2)	119.3440	0.000	1	119.3440	0.000	1	118.8613	0.433	13	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[5,5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,5,6]H)(C[6]C[6]HH)(H)	C[6](C[5,5,6]C[5,5,6]C[5,6a]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,5,6]H)(C[6]C[6]HH)(H){1|C<3>,1|H<1>,1|N<2>,2|C<4>}	C[6](C[5,5,6]C[5,5,6]C[5,6a]C[5])(C[6]C[6]H)(H){1|N<3>,1|O<2>,2|C<3>,2|C<4>,4|H<1>}	H(C[6]C[6]2)	118.9720	0.529	2	118.9720	0.280	2	118.8613	0.433	13	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[5,5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,5,6]H)(C[6]C[6]HH)(H)	C[6](C[5,5,6]C[5,5]C[5,6]O[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,5,6]H)(C[6]C[6]HH)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[5,5,6]C[5,5]C[5,6]O[5])(C[6]C[6]H)(H){1|C<3>,1|N<3>,3|C<4>,4|H<1>}	H(C[6]C[6]2)	117.5380	0.000	1	117.5380	0.000	1	118.8613	0.433	13	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[5,5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,5,6]H)(C[6]N[5,6]HH)(H)	C[6](C[5,5,6]C[3x5,6]C[5]2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,5,6]H)(C[6]N[5,6]HH)(H){4|C<4>}	C[6](C[5,5,6]C[3x5,6]C[5]2)(C[6]C[6]H)(H){1|C<3>,1|N<3>,1|O<2>,3|C<4>,5|H<1>}	H(C[6]C[6]2)	118.4900	0.501	2	118.4900	0.251	2	118.8613	0.433	13	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[5,6,6]-4:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[5,6,6]Cl)(C[6]C[6]CH)(H)	C[6](C[5,6,6]C[5,6]2C[6])(C[6]C[6]H)(Cl)	H(C[6]C[6]2)	C[6](C[6]C[5,6,6]Cl)(C[6]C[6]CH)(H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[5,6,6]C[5,6]2C[6])(C[6]C[6]H)(Cl){2|C<4>,3|H<1>,4|C<3>}	H(C[6]C[6]2)	118.7270	0.000	1	118.7270	0.000	1	118.7270	0.000	1	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[5,6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6,6]H)(C[6]C[3x6]HO)(H)	C[6](C[5,6,6]N[5,6]O[6,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6,6]H)(C[6]C[3x6]HO)(H){1|C<3>,1|N<3>,1|O<2>,2|C<4>}	C[6](C[5,6,6]N[5,6]O[6,6]C[5])(C[6]C[6]H)(H){1|O<2>,2|C<3>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	118.7100	0.000	1	118.7100	0.000	1	118.0455	1.167	17	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[5,6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6,6]H)(C[6]C[6]CH)(H)	C[6](C[5,6,6]C[5,5,6]C[5,6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6,6]H)(C[6]C[6]CH)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[5,6,6]C[5,5,6]C[5,6,6]H)(C[6]C[6]H)(H){1|C<3>,1|O<2>,3|C<4>,3|H<1>}	H(C[6]C[6]2)	118.7040	0.000	1	118.7040	0.000	1	118.0455	1.167	17	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[5,6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6,6]H)(C[6]C[6]HH)(H)	C[6](C[5,6,6]C[5,4x6]C[5,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6,6]H)(C[6]C[6]HH)(H){5|C<4>}	C[6](C[5,6,6]C[5,4x6]C[5,6]C[6])(C[6]C[6]H)(H){1|C<3>,2|O<2>,3|C<4>,5|H<1>}	H(C[6]C[6]2)	116.7470	0.133	2	116.7470	0.018	2	118.0455	1.167	17	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[5,6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6,6]H)(C[6]C[6]HH)(H)	C[6](C[5,6,6]C[5,6,6]C[5]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6,6]H)(C[6]C[6]HH)(H){2|H<1>,3|C<4>}	C[6](C[5,6,6]C[5,6,6]C[5]C[6])(C[6]C[6]H)(H){1|C<3>,1|O<2>,4|C<4>,5|H<1>}	H(C[6]C[6]2)	117.5910	0.000	1	117.6310	0.009	3	118.0455	1.167	17	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[5,6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6,6]H)(C[6]C[6]HH)(H)	C[6](C[5,6,6]C[5,6,6]C[5]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6,6]H)(C[6]C[6]HH)(H){2|H<1>,3|C<4>}	C[6](C[5,6,6]C[5,6,6]C[5]C[6])(C[6]C[6]H)(H){1|C<3>,1|O<2>,4|H<1>,5|C<4>}	H(C[6]C[6]2)	117.6510	0.122	2	117.6310	0.009	3	118.0455	1.167	17	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[5,6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6,6]H)(C[6]C[6]HH)(H)	C[6](C[5,6,6]C[5,6,6]C[6]O[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6,6]H)(C[6]C[6]HH)(H){1|H<1>,1|O<2>,3|C<4>}	C[6](C[5,6,6]C[5,6,6]C[6]O[5])(C[6]C[6]H)(H){1|C<3>,1|O<2>,3|H<1>,4|C<4>}	H(C[6]C[6]2)	117.8340	0.000	1	117.8340	0.000	1	118.0455	1.167	17	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[5,6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6,6]H)(C[6]C[6]HH)(H)	C[6](C[5,6,6]C[5,6]2C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6,6]H)(C[6]C[6]HH)(H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[5,6,6]C[5,6]2C[6])(C[6]C[6]H)(H){1|Cl<1>,2|C<4>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	118.4790	0.000	1	118.0070	0.446	2	118.0455	1.167	17	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[5,6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6,6]H)(C[6]C[6]HH)(H)	C[6](C[5,6,6]C[5,6]2C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6,6]H)(C[6]C[6]HH)(H){2|C<4>,3|C<3>}	C[6](C[5,6,6]C[5,6]2C[6])(C[6]C[6]H)(H){2|C<3>,3|C<4>,5|H<1>}	H(C[6]C[6]2)	117.5350	0.000	1	118.0070	0.446	2	118.0455	1.167	17	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[5,6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6,6]H)(C[6]C[6]HH)(H)	C[6](C[5,6,6]C[6,6a]C[5,6]2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6,6]H)(C[6]C[6]HH)(H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[5,6,6]C[6,6a]C[5,6]2)(C[6]C[6]H)(H){2|C<4>,3|H<1>,4|C<3>}	H(C[6]C[6]2)	119.0190	0.000	1	119.0190	0.000	1	118.0455	1.167	17	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[5,6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6,6]H)(C[6]C[6]HO)(H)	C[6](C[5,6,6]C[5,6,6]C[6,6a]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6,6]H)(C[6]C[6]HO)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[5,6,6]C[5,6,6]C[6,6a]C[5])(C[6]C[6]H)(H){1|N<4>,2|C<3>,2|C<4>,2|O<2>,3|H<1>}	H(C[6]C[6]2)	117.8630	1.187	2	117.5647	0.971	3	118.0455	1.167	17	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[5,6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6,6]H)(C[6]C[6]HO)(H)	C[6](C[5,6,6]C[5,6,6]C[6,6a]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6,6]H)(C[6]C[6]HO)(H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[5,6,6]C[5,6,6]C[6,6a]C[5])(C[6]C[6]H)(H){1|N<3>,1|O<2>,2|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	116.9680	0.000	1	117.5647	0.971	3	118.0455	1.167	17	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[5,6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6,6]H)(C[6]C[6]HO)(H)	C[6](C[5,6,6]C[6,6a]C[5,6]2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6,6]H)(C[6]C[6]HO)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[5,6,6]C[6,6a]C[5,6]2)(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|C<4>,2|H<1>,3|O<2>}	H(C[6]C[6]2)	118.1210	0.127	2	119.1373	3.107	3	118.0455	1.167	17	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[5,6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6,6]H)(C[6]C[6]HO)(H)	C[6](C[5,6,6]C[6,6a]C[5,6]2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6,6]H)(C[6]C[6]HO)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[5,6,6]C[6,6a]C[5,6]2)(C[6]C[6]H)(H){1|N<4>,2|C<3>,2|C<4>,2|H<1>,3|O<2>}	H(C[6]C[6]2)	121.1700	0.000	1	119.1373	3.107	3	118.0455	1.167	17	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[5,6]-4:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[5,6]Br)(C[6]C[6]CH)(H)	C[6](C[5,6]C[5,6]O[5]H)(C[6]C[6]H)(Br)	H(C[6]C[6]2)	C[6](C[6]C[5,6]Br)(C[6]C[6]CH)(H){1|C<4>,2|H<1>,2|O<2>}	C[6](C[5,6]C[5,6]O[5]H)(C[6]C[6]H)(Br){1|O<2>,2|H<1>,3|C<4>}	H(C[6]C[6]2)	119.5740	0.000	1	119.5740	0.000	1	118.7743	0.274	10	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[5,6]-4:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[5,6]Br)(C[6]C[6]HH)(H)	C[6](C[5,6]C[5,6]O[5]H)(C[6]C[6]H)(Br)	H(C[6]C[6]2)	C[6](C[6]C[5,6]Br)(C[6]C[6]HH)(H){1|C<4>,1|O<2>,3|H<1>}	C[6](C[5,6]C[5,6]O[5]H)(C[6]C[6]H)(Br){1|C<3>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	119.1960	0.000	1	119.1960	0.000	1	118.7743	0.274	10	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[5,6]-4:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[5,6]Br)(C[6]C[6]HH)(H)	C[6](C[5,6]C[6]O[5]2)(C[6]C[6]H)(Br)	H(C[6]C[6]2)	C[6](C[6]C[5,6]Br)(C[6]C[6]HH)(H){1|C<4>,1|H<1>,3|O<2>}	C[6](C[5,6]C[6]O[5]2)(C[6]C[6]H)(Br){3|H<1>,4|C<4>}	H(C[6]C[6]2)	118.3948	0.372	4	118.3948	0.139	4	118.7743	0.274	10	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[5,6]-4:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[5,6]Br)(C[6]C[6]HO)(H)	C[6](C[5,6]C[5,6]O[5]H)(C[6]C[6]H)(Br)	H(C[6]C[6]2)	C[6](C[6]C[5,6]Br)(C[6]C[6]HO)(H){1|C<4>,1|N<3>,1|O<2>,2|H<1>}	C[6](C[5,6]C[5,6]O[5]H)(C[6]C[6]H)(Br){2|C<4>,2|H<1>,2|O<2>}	H(C[6]C[6]2)	119.0990	0.099	2	118.8485	0.211	4	118.7743	0.274	10	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[5,6]-4:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[5,6]Br)(C[6]C[6]HO)(H)	C[6](C[5,6]C[5,6]O[5]H)(C[6]C[6]H)(Br)	H(C[6]C[6]2)	C[6](C[6]C[5,6]Br)(C[6]C[6]HO)(H){1|C<4>,2|H<1>,2|O<2>}	C[6](C[5,6]C[5,6]O[5]H)(C[6]C[6]H)(Br){2|C<4>,2|H<1>,2|O<2>}	H(C[6]C[6]2)	118.5980	0.611	2	118.8485	0.211	4	118.7743	0.274	10	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[5,6]-4:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[5,6]Cl)(C[6]C[6]HH)(H)	C[6](C[5,6]C[5,6]O[5]H)(C[6]C[6]H)(Cl)	H(C[6]C[6]2)	C[6](C[6]C[5,6]Cl)(C[6]C[6]HH)(H){1|C<4>,1|O<2>,3|H<1>}	C[6](C[5,6]C[5,6]O[5]H)(C[6]C[6]H)(Cl){1|C<4>,1|O<2>,1|S<4>,3|H<1>}	H(C[6]C[6]2)	118.8510	0.000	1	118.8510	0.000	1	118.8510	0.000	1	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]2H)(H)	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]2H)(H){2|C<3>,3|C<4>,3|H<1>}	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H){1|C<3>,1|O<2>,2|C<4>,4|H<1>}	H(C[6]C[6]2)	116.7930	0.017	2	116.7930	0.000	2	118.3938	3.031	95	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]2H)(H)	C[6](C[5,6]C[5x3,6x5,20x6]C[5]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]2H)(H){1|C<6>,2|H<1>,4|C<3>}	C[6](C[5,6]C[5x3,6x5,20x6]C[5]C[6])(C[6]C[6]H)(H){1|C<6>,2|C<3>,2|C<4>,2|H<1>,4|B<6>}	H(C[6]C[6]2)	117.5805	0.175	4	117.5805	0.031	4	118.3938	3.031	95	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]CC)(H)	C[6](C[5,6]C[5,6]C[5]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]CC)(H){1|H<1>,4|C<4>}	C[6](C[5,6]C[5,6]C[5]C)(C[6]C[6]H)(H){2|C<3>,3|C<4>,3|H<1>}	H(C[6]C[6]2)	116.9630	0.000	1	116.9630	0.000	1	118.3938	3.031	95	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]CH)(H)	C[6](C[5,6]C[5,6]2H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]CH)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[5,6]C[5,6]2H)(C[6]C[6]H)(H){1|C<3>,3|H<1>,4|C<4>}	H(C[6]C[6]2)	117.1190	0.000	1	117.1190	0.000	1	118.3938	3.031	95	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]CH)(H)	C[6](C[5,6]C[5,6]C[5]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]CH)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[5,6]C[5,6]C[5]C)(C[6]C[6]H)(H){2|C<3>,2|C<4>,4|H<1>}	H(C[6]C[6]2)	117.3490	0.000	1	117.3490	0.000	1	118.3938	3.031	95	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]CH)(H)	C[6](C[5,6]C[5,6]C[5]Fe)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]CH)(H){1|Fe<8>,2|C<4>,2|H<1>}	C[6](C[5,6]C[5,6]C[5]Fe)(C[6]C[6]H)(H){2|H<1>,4|C<4>}	H(C[6]C[6]2)	124.1643	5.206	3	124.1643	27.099	3	118.3938	3.031	95	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]CH)(H)	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]CH)(H){1|C<3>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,5|C<4>}	H(C[6]C[6]2)	117.1730	0.000	1	117.8670	2.171	6	118.3938	3.031	95	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]CH)(H)	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]CH)(H){1|C<3>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H){1|C<3>,1|N<3>,2|C<4>,4|H<1>}	H(C[6]C[6]2)	117.2890	0.088	2	117.8670	2.171	6	118.3938	3.031	95	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]CH)(H)	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]CH)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H){1|O<2>,3|C<4>,4|H<1>}	H(C[6]C[6]2)	117.0900	0.000	1	117.8670	2.171	6	118.3938	3.031	95	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]CH)(H)	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]CH)(H){2|C<4>,3|H<1>}	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H){1|C<3>,1|N<3>,3|C<4>,3|H<1>}	H(C[6]C[6]2)	120.8600	0.000	1	117.8670	2.171	6	118.3938	3.031	95	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]CH)(H)	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]CH)(H){2|C<4>,3|H<1>}	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H){1|N<3>,3|C<4>,4|H<1>}	H(C[6]C[6]2)	117.5010	0.000	1	117.8670	2.171	6	118.3938	3.031	95	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]CH)(H)	C[6](C[5,6]C[5,6]O[5]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]CH)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[5,6]C[5,6]O[5]C)(C[6]C[6]H)(H){2|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	117.7140	0.226	2	117.7140	0.051	2	118.3938	3.031	95	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]CO)(H)	C[6](C[5,6]C[5]2C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]CO)(H){1|C<4>,1|H<1>,2|C<3>}	C[6](C[5,6]C[5]2C[6])(C[6]C[6]H)(H){1|C<4>,2|O<2>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	121.1517	0.143	4	121.1517	0.020	4	118.3938	3.031	95	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]CO)(H)	C[6](C[5,6]C[6]N[5]2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]CO)(H){1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[5,6]C[6]N[5]2)(C[6]C[6]H)(H){1|H<1>,1|O<2>,2|C<4>,3|C<3>}	H(C[6]C[6]2)	117.9271	0.179	7	117.9271	0.032	7	118.3938	3.031	95	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H)	C[6](C[5,6]C[5,3x6]C[5]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H){5|C<4>}	C[6](C[5,6]C[5,3x6]C[5]C[6])(C[6]C[6]H)(H){1|C<3>,2|O<2>,3|C<4>,5|H<1>}	H(C[6]C[6]2)	117.9540	0.587	2	117.9540	0.344	2	118.3938	3.031	95	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H)	C[6](C[5,6]C[5,5]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H){2|C<4>,3|H<1>}	C[6](C[5,6]C[5,5]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|O<2>,2|C<4>,4|H<1>}	H(C[6]C[6]2)	117.7643	0.195	4	117.7643	0.038	4	118.3938	3.031	95	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H)	C[6](C[5,6]C[5,6,6]C[5]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H){2|C<4>,3|H<1>}	C[6](C[5,6]C[5,6,6]C[5]H)(C[6]C[6]H)(H){1|C<4>,1|N<3>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	118.5530	0.000	1	118.3945	0.050	2	118.3938	3.031	95	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H)	C[6](C[5,6]C[5,6,6]C[5]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H){2|C<4>,3|H<1>}	C[6](C[5,6]C[5,6,6]C[5]H)(C[6]C[6]H)(H){1|C<4>,1|N<3>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	118.2360	0.000	1	118.3945	0.050	2	118.3938	3.031	95	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H)	C[6](C[5,6]C[5,6,6]C[5]O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[5,6]C[5,6,6]C[5]O)(C[6]C[6]H)(H){4|C<4>,4|H<1>}	H(C[6]C[6]2)	117.4370	0.000	1	117.4370	0.000	1	118.3938	3.031	95	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H)	C[6](C[5,6]C[5,6]2H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H){2|C<4>,3|H<1>}	C[6](C[5,6]C[5,6]2H)(C[6]C[6]H)(H){1|C<3>,1|O<2>,3|C<4>,3|H<1>}	H(C[6]C[6]2)	118.5400	0.000	1	118.5400	0.000	1	118.3938	3.031	95	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H)	C[6](C[5,6]C[5,6]C[5]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H){2|H<1>,3|C<4>}	C[6](C[5,6]C[5,6]C[5]C)(C[6]C[6]H)(H){1|O<2>,1|S<3>,2|C<4>,4|H<1>}	H(C[6]C[6]2)	117.7670	0.198	3	117.7670	0.039	3	118.3938	3.031	95	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H)	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H){1|C<3>,1|C<4>,3|H<1>}	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H){1|C<3>,3|C<4>,3|H<1>}	H(C[6]C[6]2)	116.9690	0.000	1	118.5694	3.073	14	118.3938	3.031	95	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H)	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H){1|C<3>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>,4|H<1>}	H(C[6]C[6]2)	118.4360	0.000	1	118.5694	3.073	14	118.3938	3.031	95	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H)	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H){1|C<2>,1|N<3>,2|C<4>,4|H<1>}	H(C[6]C[6]2)	118.1400	0.000	1	118.5694	3.073	14	118.3938	3.031	95	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H)	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H){1|C<3>,3|C<4>,4|H<1>}	H(C[6]C[6]2)	117.7430	0.098	2	118.5694	3.073	14	118.3938	3.031	95	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H)	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H){1|C<4>,2|C<3>,5|H<1>}	H(C[6]C[6]2)	118.3750	0.000	1	118.5694	3.073	14	118.3938	3.031	95	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H)	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H){3|C<4>,5|H<1>}	H(C[6]C[6]2)	117.6410	0.000	1	118.5694	3.073	14	118.3938	3.031	95	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H)	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H){2|C<4>,3|H<1>}	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H){1|C<2>,1|N<3>,2|C<4>,4|H<1>}	H(C[6]C[6]2)	117.7430	0.000	1	118.5694	3.073	14	118.3938	3.031	95	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H)	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H){2|C<4>,3|H<1>}	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H){1|C<3>,1|N<3>,2|C<4>,4|H<1>}	H(C[6]C[6]2)	118.0525	0.199	2	118.5694	3.073	14	118.3938	3.031	95	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H)	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H){2|C<4>,3|H<1>}	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|O<2>,3|H<1>}	H(C[6]C[6]2)	117.8950	0.000	1	118.5694	3.073	14	118.3938	3.031	95	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H)	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H){2|C<4>,3|H<1>}	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H){1|C<4>,1|N<3>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	118.3640	0.000	1	118.5694	3.073	14	118.3938	3.031	95	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H)	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H){2|C<4>,3|H<1>}	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	121.0530	0.000	1	118.5694	3.073	14	118.3938	3.031	95	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H)	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H){2|H<1>,3|C<4>}	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H){1|C<4>,1|N<3>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	123.7650	0.000	1	118.5694	3.073	14	118.3938	3.031	95	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H)	C[6](C[5,6]C[5,6]C[5]S)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H){1|H<1>,1|O<2>,1|S<4>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]S)(C[6]C[6]H)(H){1|O<2>,3|C<4>,4|H<1>}	H(C[6]C[6]2)	118.0430	0.516	2	118.3388	0.214	4	118.3938	3.031	95	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H)	C[6](C[5,6]C[5,6]C[5]S)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H){1|H<1>,1|O<2>,1|S<4>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]S)(C[6]C[6]H)(H){4|C<4>,4|H<1>}	H(C[6]C[6]2)	118.7480	0.000	1	118.3388	0.214	4	118.3938	3.031	95	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H)	C[6](C[5,6]C[5,6]C[5]S)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H){1|S<4>,2|C<4>,2|H<1>}	C[6](C[5,6]C[5,6]C[5]S)(C[6]C[6]H)(H){1|C<3>,1|N<4>,2|C<4>,4|H<1>}	H(C[6]C[6]2)	118.5210	0.000	1	118.3388	0.214	4	118.3938	3.031	95	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H)	C[6](C[5,6]C[5,6]C[6a]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[5,6]C[5,6]C[6a]C[5])(C[6]C[6]H)(H){1|N<3>,2|C<4>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	118.1690	0.000	1	118.1690	0.000	1	118.3938	3.031	95	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H)	C[6](C[5,6]C[5,6]N[5,5]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H){1|C<4>,1|N<3>,3|H<1>}	C[6](C[5,6]C[5,6]N[5,5]H)(C[6]C[6]H)(H){1|C<4>,1|S<4>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	118.0360	0.000	1	118.0360	0.000	1	118.3938	3.031	95	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H)	C[6](C[5,6]C[5,6]N[5]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H){1|C<4>,1|N<3>,3|H<1>}	C[6](C[5,6]C[5,6]N[5]H)(C[6]C[6]H)(H){1|C<3>,2|H<1>,4|C<4>}	H(C[6]C[6]2)	118.0870	0.168	2	118.0870	0.028	2	118.3938	3.031	95	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H)	C[6](C[5,6]C[5]2C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[5,6]C[5]2C[6])(C[6]C[6]H)(H){1|C<3>,1|N<3>,2|C<4>,6|H<1>}	H(C[6]C[6]2)	117.9607	0.182	3	118.0083	0.055	8	118.3938	3.031	95	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H)	C[6](C[5,6]C[5]2C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[5,6]C[5]2C[6])(C[6]C[6]H)(H){1|C<3>,3|C<4>,6|H<1>}	H(C[6]C[6]2)	118.3395	0.006	2	118.0083	0.055	8	118.3938	3.031	95	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H)	C[6](C[5,6]C[5]2C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[5,6]C[5]2C[6])(C[6]C[6]H)(H){1|O<1>,2|C<4>,2|O<2>,5|H<1>}	H(C[6]C[6]2)	117.8350	0.027	3	118.0083	0.055	8	118.3938	3.031	95	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H)	C[6](C[5,6]N[5,6]C[5]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H){1|N<3>,2|C<4>,2|H<1>}	C[6](C[5,6]N[5,6]C[5]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<2>,4|H<1>}	H(C[6]C[6]2)	117.7020	0.542	2	117.7020	0.293	2	118.3938	3.031	95	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]HO)(H)	C[6](C[5,6]C[5,6]2O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]HO)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[5,6]C[5,6]2O)(C[6]C[6]H)(H){1|C<3>,1|N<3>,1|O<2>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	118.4150	0.000	1	118.4150	0.000	1	118.3938	3.031	95	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]HO)(H)	C[6](C[5,6]C[5,6]C[5]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]HO)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[5,6]C[5,6]C[5]C)(C[6]C[6]H)(H){1|C<4>,1|O<2>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	118.4330	0.000	1	118.4330	0.000	1	118.3938	3.031	95	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]HO)(H)	C[6](C[5,6]C[5,6]C[5]S)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]HO)(H){1|S<2>,2|C<4>,2|H<1>}	C[6](C[5,6]C[5,6]C[5]S)(C[6]C[6]H)(H){1|C<3>,1|N<3>,1|O<2>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	118.3570	0.000	1	118.3570	0.000	1	118.3938	3.031	95	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]HO)(H)	C[6](C[5,6]C[5,6]C[6a]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]HO)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[5,6]C[5,6]C[6a]C[5])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|C<4>,2|O<2>,3|H<1>}	H(C[6]C[6]2)	118.1020	1.355	5	118.1020	1.837	5	118.3938	3.031	95	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]HO)(H)	C[6](C[5,6]C[5,6]O[5]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]HO)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[5,6]C[5,6]O[5]C)(C[6]C[6]H)(H){1|O<2>,2|H<1>,3|C<4>}	H(C[6]C[6]2)	118.2940	0.000	1	118.2940	0.000	1	118.3938	3.031	95	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]HO)(H)	C[6](C[5,6]C[5,6]O[5]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]HO)(H){1|C<4>,1|H<1>,1|O<2>,2|F<1>}	C[6](C[5,6]C[5,6]O[5]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,2|C<3>,2|O<2>}	H(C[6]C[6]2)	118.0710	0.000	1	119.0075	1.754	2	118.3938	3.031	95	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]HO)(H)	C[6](C[5,6]C[5,6]O[5]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]HO)(H){1|C<4>,1|N<3>,1|O<2>,2|H<1>}	C[6](C[5,6]C[5,6]O[5]H)(C[6]C[6]H)(H){2|C<4>,2|H<1>,2|O<2>}	H(C[6]C[6]2)	119.9440	0.000	1	119.0075	1.754	2	118.3938	3.031	95	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]HO)(H)	C[6](C[5,6]C[5,6a]C[5,6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]HO)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[5,6]C[5,6a]C[5,6]C)(C[6]C[6]H)(H){1|C<4>,2|C<3>,2|H<1>,2|O<2>}	H(C[6]C[6]2)	115.5840	0.000	1	115.5840	0.000	1	118.3938	3.031	95	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]C[6]HO)(H)	C[6](C[5,6]C[5,6a]C[5]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]C[6]HO)(H){1|C<4>,1|H<1>,1|O<2>,2|C<3>}	C[6](C[5,6]C[5,6a]C[5]C[6])(C[6]C[6]H)(H){1|C<4>,1|N<3>,1|O<1>,1|O<2>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	118.5820	0.000	1	118.5820	0.000	1	118.3938	3.031	95	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]N[6]CH)(H)	C[6](C[5,6]C[4,5]C[5]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]N[6]CH)(H){1|C<3>,3|C<4>}	C[6](C[5,6]C[4,5]C[5]C[6])(C[6]C[6]H)(H){1|C<3>,1|N<3>,1|O<1>,1|O<2>,3|C<4>,3|H<1>}	H(C[6]C[6]2)	119.9530	0.000	1	119.9530	0.000	1	118.3938	3.031	95	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]N[6]CH)(H)	C[6](C[5,6]C[5]2C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]N[6]CH)(H){2|C<3>,2|C<4>}	C[6](C[5,6]C[5]2C[6])(C[6]C[6]H)(H){1|C<3>,1|N<3>,1|O<1>,1|O<2>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	119.6800	0.000	1	119.6800	0.000	1	118.3938	3.031	95	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]N[6]CH)(H)	C[6](C[5,6]N[5,6]C[5]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]N[6]CH)(H){1|C<3>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[5,6]N[5,6]C[5]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<2>,2|H<1>,2|N<3>}	H(C[6]C[6]2)	117.4640	0.000	1	117.7225	0.134	2	118.3938	3.031	95	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]N[6]CH)(H)	C[6](C[5,6]N[5,6]C[5]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]N[6]CH)(H){1|C<4>,1|N<3>,2|H<1>}	C[6](C[5,6]N[5,6]C[5]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>,1|O<2>,3|H<1>}	H(C[6]C[6]2)	117.9810	0.000	1	117.7225	0.134	2	118.3938	3.031	95	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]N[6]HH)(H)	C[6](C[5,6]N[5,6]C[5]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]N[6]HH)(H){1|C<3>,1|N<3>,2|C<4>}	C[6](C[5,6]N[5,6]C[5]C[6])(C[6]C[6]H)(H){1|C<4>,1|O<1>,2|C<3>,2|N<3>,3|H<1>}	H(C[6]C[6]2)	118.7280	0.000	1	118.7280	0.000	1	118.3938	3.031	95	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]H)(C[6]O[6]HH)(H)	C[6](C[5,6]C[5,6]O[5]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]H)(C[6]O[6]HH)(H){1|C<4>,1|H<1>,1|O<2>}	C[6](C[5,6]C[5,6]O[5]H)(C[6]C[6]H)(H){1|O<2>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	118.6440	0.000	1	118.6440	0.000	1	118.3938	3.031	95	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[5,6]-4:C[6]-3:I-1:	C[6]-3:	C[6](C[6]C[5,6]I)(C[6]C[6]HO)(H)	C[6](C[5,6]C[5,6]O[5]H)(C[6]C[6]H)(I)	H(C[6]C[6]2)	C[6](C[6]C[5,6]I)(C[6]C[6]HO)(H){1|C<4>,2|H<1>,2|O<2>}	C[6](C[5,6]C[5,6]O[5]H)(C[6]C[6]H)(I){2|C<4>,2|H<1>,2|O<2>}	H(C[6]C[6]2)	119.6595	0.179	2	119.6595	0.032	2	119.6595	0.032	2	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6,6]Br)(C[6]C[6]HH)(H)	C[6](C[6,6]C[6,6a]C[6,6]H)(C[6]C[6]H)(Br)	H(C[6]C[6]2)	C[6](C[6]C[6,6]Br)(C[6]C[6]HH)(H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6,6]C[6,6a]C[6,6]H)(C[6]C[6]H)(Br){1|C<4>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	118.6230	0.000	1	118.6230	0.000	1	118.6230	0.000	1	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6,6]Cl)(C[6]C[6]HH)(H)	C[6](C[6,6]C[6,6a]C[6]N[6])(C[6]C[6]H)(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6,6]Cl)(C[6]C[6]HH)(H){1|C<3>,1|C<4>,1|N<3>,2|H<1>}	C[6](C[6,6]C[6,6a]C[6]N[6])(C[6]C[6]H)(Cl){2|C<3>,3|C<4>,4|H<1>}	H(C[6]C[6]2)	119.7570	0.000	1	119.7570	0.000	1	119.7570	0.000	1	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]CH)(H)	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]CH)(H){1|C<3>,1|H<1>,3|C<4>}	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H){1|C<3>,3|C<4>,4|H<1>}	H(C[6]C[6]2)	117.8490	0.269	2	117.9402	1.099	17	118.3945	1.684	83	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]CH)(H)	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]CH)(H){1|C<3>,1|H<1>,3|C<4>}	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H){4|C<4>,4|H<1>}	H(C[6]C[6]2)	117.3480	0.000	1	117.9402	1.099	17	118.3945	1.684	83	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]CH)(H)	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]CH)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H){1|C<3>,3|C<4>,4|H<1>}	H(C[6]C[6]2)	117.6778	0.350	4	117.9402	1.099	17	118.3945	1.684	83	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]CH)(H)	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]CH)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H){4|C<4>,4|H<1>}	H(C[6]C[6]2)	117.9200	0.935	8	117.9402	1.099	17	118.3945	1.684	83	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]CH)(H)	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]CH)(H){2|C<4>,3|H<1>}	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H){1|C<2>,1|O<2>,2|C<4>,4|H<1>}	H(C[6]C[6]2)	120.9830	0.000	1	117.9402	1.099	17	118.3945	1.684	83	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]CH)(H)	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]CH)(H){2|H<1>,3|C<4>}	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H){1|C<3>,3|C<4>,4|H<1>}	H(C[6]C[6]2)	116.8840	0.000	1	117.9402	1.099	17	118.3945	1.684	83	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]CH)(H)	C[6](C[6,6]C[6,6]O[6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]CH)(H){1|C<4>,1|O<1>,1|O<2>,2|H<1>}	C[6](C[6,6]C[6,6]O[6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>,3|C<4>}	H(C[6]C[6]2)	119.9640	0.000	1	119.9640	0.000	1	118.3945	1.684	83	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]CH)(H)	C[6](C[6,6]C[6]O[6]2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]CH)(H){1|H<1>,2|C<4>,2|O<2>}	C[6](C[6,6]C[6]O[6]2)(C[6]C[6]H)(H){3|H<1>,4|C<4>}	H(C[6]C[6]2)	118.3677	0.255	3	118.3677	0.065	3	118.3945	1.684	83	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]CO)(H)	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]CO)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H){2|H<1>,2|O<2>,4|C<4>}	H(C[6]C[6]2)	117.2444	0.234	5	117.3310	0.089	6	118.3945	1.684	83	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]CO)(H)	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]CO)(H){2|H<1>,3|C<4>}	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H){1|O<2>,7|C<4>}	H(C[6]C[6]2)	117.7640	0.000	1	117.3310	0.089	6	118.3945	1.684	83	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]CO)(H)	C[6](C[6,6]C[6]3)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]CO)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6,6]C[6]3)(C[6]C[6]H)(H){1|C<3>,1|O<2>,2|H<1>,6|C<4>}	H(C[6]C[6]2)	117.4665	0.260	2	117.4665	0.067	2	118.3945	1.684	83	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H)	C[6](C[6,6]C[3x6]C[6]O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[6,6]C[3x6]C[6]O)(C[6]C[6]H)(H){4|C<4>,4|H<1>}	H(C[6]C[6]2)	117.6990	0.000	1	117.6990	0.000	1	118.3945	1.684	83	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H)	C[6](C[6,6]C[5,6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H){2|C<4>,3|H<1>}	C[6](C[6,6]C[5,6]C[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|O<2>,2|C<4>,4|H<1>}	H(C[6]C[6]2)	118.2157	0.344	3	118.1937	0.081	4	118.3945	1.684	83	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H)	C[6](C[6,6]C[5,6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H){2|C<4>,3|H<1>}	C[6](C[6,6]C[5,6]C[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|O<2>,3|C<4>,3|H<1>}	H(C[6]C[6]2)	118.1280	0.000	1	118.1937	0.081	4	118.3945	1.684	83	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H)	C[6](C[6,6]C[6,6]2C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H){5|C<4>}	C[6](C[6,6]C[6,6]2C)(C[6]C[6]H)(H){4|C<4>,4|H<1>}	H(C[6]C[6]2)	117.3400	0.000	1	117.3400	0.000	1	118.3945	1.684	83	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H)	C[6](C[6,6]C[6,6]2H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6,6]C[6,6]2H)(C[6]C[6]H)(H){2|C<3>,2|C<4>,4|H<1>}	H(C[6]C[6]2)	117.8225	0.115	2	117.8225	0.013	2	118.3945	1.684	83	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H)	C[6](C[6,6]C[6,6]C[6]2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H){1|C<3>,4|C<4>}	C[6](C[6,6]C[6,6]C[6]2)(C[6]C[6]H)(H){1|C<3>,1|O<2>,3|C<4>,5|H<1>}	H(C[6]C[6]2)	118.2600	0.000	1	118.2600	0.000	1	118.3945	1.684	83	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H)	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H){1|C<3>,3|C<4>}	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(H){1|C<3>,2|C<4>,5|H<1>}	H(C[6]C[6]2)	118.3470	0.000	1	118.3470	0.000	1	118.3945	1.684	83	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H)	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H){1|C<3>,1|H<1>,2|C<4>}	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H){1|C<3>,2|C<4>,5|H<1>}	H(C[6]C[6]2)	120.7230	0.000	1	118.6866	0.982	17	118.3945	1.684	83	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H)	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H){1|C<3>,1|H<1>,3|C<4>}	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H){1|C<3>,2|C<4>,4|H<1>}	H(C[6]C[6]2)	118.2230	0.000	1	118.6866	0.982	17	118.3945	1.684	83	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H)	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H){1|C<3>,1|H<1>,3|C<4>}	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H){1|C<3>,2|C<4>,5|H<1>}	H(C[6]C[6]2)	118.9990	0.000	1	118.6866	0.982	17	118.3945	1.684	83	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H)	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H){1|C<3>,2|C<4>,5|H<1>}	H(C[6]C[6]2)	118.4435	1.573	4	118.6866	0.982	17	118.3945	1.684	83	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H)	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H){2|C<3>,2|C<4>,4|H<1>}	H(C[6]C[6]2)	119.8340	0.000	1	118.6866	0.982	17	118.3945	1.684	83	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H)	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H){2|C<4>,3|H<1>}	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H){1|C<3>,2|C<4>,5|H<1>}	H(C[6]C[6]2)	119.4470	0.000	1	118.6866	0.982	17	118.3945	1.684	83	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H)	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H){2|C<4>,3|H<1>}	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H){1|C<3>,3|C<4>,4|H<1>}	H(C[6]C[6]2)	118.6660	0.000	1	118.6866	0.982	17	118.3945	1.684	83	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H)	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H){2|C<4>,3|H<1>}	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H){3|C<4>,5|H<1>}	H(C[6]C[6]2)	118.1510	0.028	2	118.6866	0.982	17	118.3945	1.684	83	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H)	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H){2|C<4>,3|H<1>}	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H){4|C<4>,4|H<1>}	H(C[6]C[6]2)	118.4922	0.143	4	118.6866	0.982	17	118.3945	1.684	83	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H)	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H){2|H<1>,3|C<4>}	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H){1|B<3>,2|C<4>,5|H<1>}	H(C[6]C[6]2)	117.7350	0.000	1	118.6866	0.982	17	118.3945	1.684	83	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H)	C[6](C[6,6]C[6,6]N[6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H){1|C<4>,1|N<3>,1|O<2>,2|H<1>}	C[6](C[6,6]C[6,6]N[6]H)(C[6]C[6]H)(H){1|C<3>,3|C<4>,3|H<1>}	H(C[6]C[6]2)	117.8880	0.000	1	118.2917	0.074	4	118.3945	1.684	83	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H)	C[6](C[6,6]C[6,6]N[6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H){1|C<4>,1|N<3>,3|H<1>}	C[6](C[6,6]C[6,6]N[6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>,1|S<4>,3|H<1>}	H(C[6]C[6]2)	118.4263	0.052	3	118.2917	0.074	4	118.3945	1.684	83	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H)	C[6](C[6,6]C[6,6a]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H){1|C<3>,1|C<4>,3|H<1>}	C[6](C[6,6]C[6,6a]C[6,6]H)(C[6]C[6]H)(H){1|C<4>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	117.9710	0.000	1	118.5887	0.771	9	118.3945	1.684	83	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H)	C[6](C[6,6]C[6,6a]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H){1|C<3>,1|C<4>,3|H<1>}	C[6](C[6,6]C[6,6a]C[6,6]H)(C[6]C[6]H)(H){2|C<3>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	118.2210	0.263	2	118.5887	0.771	9	118.3945	1.684	83	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H)	C[6](C[6,6]C[6,6a]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6,6]C[6,6a]C[6,6]H)(C[6]C[6]H)(H){1|C<4>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.2660	0.716	2	118.5887	0.771	9	118.3945	1.684	83	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H)	C[6](C[6,6]C[6,6a]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6,6]C[6,6a]C[6,6]H)(C[6]C[6]H)(H){1|C<4>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	118.5883	1.157	4	118.5887	0.771	9	118.3945	1.684	83	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H)	C[6](C[6,6]C[6]O[6]2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H){1|H<1>,2|C<4>,2|O<2>}	C[6](C[6,6]C[6]O[6]2)(C[6]C[6]H)(H){1|O<2>,3|C<4>,3|H<1>}	H(C[6]C[6]2)	119.1730	0.000	1	119.1730	0.000	1	118.3945	1.684	83	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H)	C[6](C[6,6]N[6,6]C[6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H){1|C<4>,1|H<1>,1|N<3>,1|O<1>}	C[6](C[6,6]N[6,6]C[6]H)(C[6]C[6]H)(H){2|C<3>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	123.8080	0.000	1	123.8080	0.000	1	118.3945	1.684	83	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]HO)(H)	C[6](C[6,6]C[5,6,6]O[6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]HO)(H){1|Br<1>,1|C<4>,1|O<2>,2|H<1>}	C[6](C[6,6]C[5,6,6]O[6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>,1|O<2>,2|C<4>}	H(C[6]C[6]2)	117.6800	0.000	1	117.6800	0.000	1	118.3945	1.684	83	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]HO)(H)	C[6](C[6,6]C[6,6]2C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]HO)(H){2|H<1>,3|C<4>}	C[6](C[6,6]C[6,6]2C)(C[6]C[6]H)(H){2|H<1>,2|O<2>,4|C<4>}	H(C[6]C[6]2)	117.9810	0.000	1	117.9810	0.000	1	118.3945	1.684	83	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]HO)(H)	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]HO)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H){1|C<4>,2|C<3>,2|O<2>,3|H<1>}	H(C[6]C[6]2)	117.8960	0.000	1	117.8960	0.000	1	118.3945	1.684	83	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]HO)(H)	C[6](C[6,6]C[6,6]C[6]O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]HO)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[6,6]C[6,6]C[6]O)(C[6]C[6]H)(H){1|C<3>,1|C<4>,2|O<2>,4|H<1>}	H(C[6]C[6]2)	125.2320	0.000	1	125.2320	0.000	1	118.3945	1.684	83	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]C[6]HO)(H)	C[6](C[6,6]C[6,6a]C[6,6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]C[6]HO)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6,6]C[6,6a]C[6,6]C)(C[6]C[6]H)(H){1|C<4>,1|N<3>,1|O<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	117.7770	0.000	1	117.7770	0.000	1	118.3945	1.684	83	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]O[6]CH)(H)	C[6](C[6,6]C[6,6]O[6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]O[6]CH)(H){1|C<4>,1|H<1>,1|O<2>}	C[6](C[6,6]C[6,6]O[6]H)(C[6]C[6]H)(H){1|C<2>,1|O<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.1440	0.000	1	118.5726	0.126	5	118.3945	1.684	83	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]O[6]CH)(H)	C[6](C[6,6]C[6,6]O[6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]O[6]CH)(H){1|C<4>,1|H<1>,1|O<2>}	C[6](C[6,6]C[6,6]O[6]H)(C[6]C[6]H)(H){1|C<4>,1|O<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	118.3740	0.000	1	118.5726	0.126	5	118.3945	1.684	83	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]O[6]CH)(H)	C[6](C[6,6]C[6,6]O[6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]O[6]CH)(H){1|C<4>,1|H<1>,1|O<2>}	C[6](C[6,6]C[6,6]O[6]H)(C[6]C[6]H)(H){1|O<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	118.5920	0.000	1	118.5726	0.126	5	118.3945	1.684	83	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]O[6]CH)(H)	C[6](C[6,6]C[6,6]O[6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]O[6]CH)(H){1|C<4>,1|H<1>,1|O<2>}	C[6](C[6,6]C[6,6]O[6]H)(C[6]C[6]H)(H){1|O<2>,2|H<1>,3|C<4>}	H(C[6]C[6]2)	118.2040	0.000	1	118.5726	0.126	5	118.3945	1.684	83	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]O[6]CH)(H)	C[6](C[6,6]C[6,6]O[6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]O[6]CH)(H){1|C<4>,1|H<1>,1|O<2>}	C[6](C[6,6]C[6,6]O[6]H)(C[6]C[6]H)(H){1|Si<4>,1|O<2>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.5490	0.000	1	118.5726	0.126	5	118.3945	1.684	83	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]O[6]HH)(H)	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]O[6]HH)(H){1|H<1>,2|C<4>}	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H){1|C<4>,1|O<2>,1|S<4>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	118.4420	0.000	1	118.4420	0.000	1	118.3945	1.684	83	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:1:	3:	C[6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]H)(C[6]O[6]HH)(H)	C[6](C[6,6]C[6,6]O[6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]H)(C[6]O[6]HH)(H){1|C<4>,1|H<1>,1|O<2>}	C[6](C[6,6]C[6,6]O[6]H)(C[6]C[6]H)(H){1|O<2>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	118.7180	0.000	1	118.7180	0.000	1	118.3945	1.684	83	118.4678	2.210	244	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:2:	3:	C[6]-3:C[6]-4:H-1:	C[5,6,6]-4:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[5,6,6]O)(C[6]C[6,6]HH)(H)	C[6](C[5,6,6]C[5,6,6]C[5,6]O)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[5,6,6]O)(C[6]C[6,6]HH)(H){1|C<3>,1|H<1>,1|O<2>,2|C<4>}	C[6](C[5,6,6]C[5,6,6]C[5,6]O)(C[6]C[6]H)(OC){1|C<3>,3|C<4>,4|H<1>}	H(C[6]C[6]2)	119.3370	0.000	1	119.3370	0.000	1	119.0870	0.125	2	118.2696	3.604	5	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:2:	3:	C[6]-3:C[6]-4:H-1:	C[5,6,6]-4:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[5,6,6]O)(C[6]C[6]HH)(H)	C[6](C[5,6,6]C[5,5,6,6]C[5,6]C)(C[6]C[6]H)(OS)	H(C[6]C[6]2)	C[6](C[6]C[5,6,6]O)(C[6]C[6]HH)(H){1|Br<1>,1|H<1>,3|C<4>}	C[6](C[5,6,6]C[5,5,6,6]C[5,6]C)(C[6]C[6]H)(OS){1|O<2>,3|C<4>,4|H<1>}	H(C[6]C[6]2)	118.8370	0.000	1	118.8370	0.000	1	119.0870	0.125	2	118.2696	3.604	5	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:2:	3:	C[6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]CC)(H)	C[6](C[6,6]C[6,6]2H)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]CC)(H){1|C<3>,1|C<4>,3|H<1>}	C[6](C[6,6]C[6,6]2H)(C[6]C[6]H)(OC){1|Br<1>,2|C<3>,4|C<4>}	H(C[6]C[6]2)	116.9490	0.000	1	117.7247	6.033	3	117.7247	6.033	3	118.2696	3.604	5	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:2:	3:	C[6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6,6]O)(C[6]C[6]CC)(H)	C[6](C[6,6]C[6,6]2H)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6,6]O)(C[6]C[6]CC)(H){1|C<3>,1|C<4>,3|H<1>}	C[6](C[6,6]C[6,6]2H)(C[6]C[6]H)(OC){1|H<1>,2|C<3>,4|C<4>}	H(C[6]C[6]2)	118.1125	3.341	2	117.7247	6.033	3	117.7247	6.033	3	118.2696	3.604	5	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:3:	3:	C[6]-3:As[6]-4:H-1:	As[6]-4:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]As[6]C[6a])(As[6]C[6]CuC)(H)	C[6](As[6]C[6]CuC)(C[6a]C[6a]2)(C[6]As[6]H)	H(C[6]As[6]C[6])	C[6](C[6]As[6]C[6a])(As[6]C[6]CuC)(H){1|Cu<4>,1|C<4>,4|C<3>}	C[6](As[6]C[6]CuC)(C[6a]C[6a]2)(C[6]As[6]H){1|Cu<4>,1|C<4>,3|C<3>,3|H<1>}	H(C[6]As[6]C[6])	116.0658	0.439	6	116.0658	0.193	6	116.0658	0.193	6	117.4395	1.616	64	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:3:	3:	C[6]-3:C[6]-4:H-1:	C[3x6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[3x6]C[6])(C[6]C[6]HH)(H)	C[6](C[3x6]C[6,6]3)(C[6]C[6]H)(C[6]C[6]O)	H(C[6]C[6]2)	C[6](C[6]C[3x6]C[6])(C[6]C[6]HH)(H){1|O<1>,2|C<3>,2|C<4>,2|H<1>}	C[6](C[3x6]C[6,6]3)(C[6]C[6]H)(C[6]C[6]O){1|C<3>,1|O<1>,5|C<4>,5|H<1>}	H(C[6]C[6]2)	117.7160	0.113	2	117.7160	0.013	2	117.7160	0.013	2	117.4395	1.616	64	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:3:	3:	C[6]-3:C[6]-4:H-1:	C[3x6]-4:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[3x6]C[6a])(C[6]C[3x6]HH)(H)	C[6](C[3x6]C[4x6]C[6,6]H)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[3x6]C[6a])(C[6]C[3x6]HH)(H){2|C<4>,2|H<1>,3|C<3>}	C[6](C[3x6]C[4x6]C[6,6]H)(C[6a]C[6a]2)(C[6]C[6]H){2|C<4>,4|C<3>,6|H<1>}	H(C[6]C[6]2)	117.2440	0.000	1	117.2440	0.000	1	117.2440	0.000	1	117.4395	1.616	64	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:3:	3:	C[6]-3:C[6]-4:H-1:	C[5,6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[6]CH)(H)	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(CHO)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[6]CH)(H){2|C<4>,3|H<1>}	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(CHO){4|C<4>,4|H<1>}	H(C[6]C[6]2)	118.1750	0.000	1	118.1750	0.000	1	117.9263	0.035	4	117.4395	1.616	64	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:3:	3:	C[6]-3:C[6]-4:H-1:	C[5,6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[6]HH)(H)	C[6](C[5,6]C[5,6a]C[5]C[6])(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[6]HH)(H){1|C<4>,1|H<1>,3|C<3>}	C[6](C[5,6]C[5,6a]C[5]C[6])(C[6]C[6]H)(COO){1|C<4>,1|N<3>,1|O<1>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	117.7180	0.000	1	117.7180	0.000	1	117.9263	0.035	4	117.4395	1.616	64	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:3:	3:	C[6]-3:C[6]-4:H-1:	C[5,6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[6]HH)(H)	C[6](C[5,6]C[5]2C[6])(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[6]HH)(H){1|C<4>,1|H<1>,3|C<3>}	C[6](C[5,6]C[5]2C[6])(C[6]C[6]H)(COO){1|C<4>,2|O<1>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	117.9060	0.004	2	117.9060	0.000	2	117.9263	0.035	4	117.4395	1.616	64	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:3:	3:	C[6]-3:C[6]-4:H-1:	C[5,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5,6]C[6])(C[6]C[6]HH)(H)	C[6](C[5,6]C[5,6]C[5]C[6])(C[6]C[6]H)(C[6]C[6]O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C[6])(C[6]C[6]HH)(H){1|C<3>,1|O<1>,2|H<1>,3|C<4>}	C[6](C[5,6]C[5,6]C[5]C[6])(C[6]C[6]H)(C[6]C[6]O){1|C<3>,1|O<1>,5|C<4>,6|H<1>}	H(C[6]C[6]2)	117.2560	0.000	1	117.2560	0.000	1	117.6543	0.138	3	117.4395	1.616	64	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:3:	3:	C[6]-3:C[6]-4:H-1:	C[5,6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5,6]C[6])(C[6]C[6]HH)(H)	C[6](C[5,6]C[5,6]O[5]H)(C[6]C[5,6]C[6])(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C[6])(C[6]C[6]HH)(H){1|C<3>,1|O<2>,2|C<4>,3|H<1>}	C[6](C[5,6]C[5,6]O[5]H)(C[6]C[5,6]C[6])(C[6]C[6]H){2|O<2>,4|C<4>,5|H<1>}	H(C[6]C[6]2)	117.8535	0.193	2	117.8535	0.037	2	117.6543	0.138	3	117.4395	1.616	64	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:3:	3:	C[6]-3:C[6]-4:H-1:	C[5,6]-4:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5,6]C[6a])(C[6]C[5,6]HH)(H)	C[6](C[5,6]C[5,5,6]C[5]H)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C[6a])(C[6]C[5,6]HH)(H){2|C<4>,2|H<1>,3|C<3>}	C[6](C[5,6]C[5,5,6]C[5]H)(C[6a]C[6a]2)(C[6]C[6]H){2|C<4>,3|C<3>,7|H<1>}	H(C[6]C[6]2)	119.3850	0.000	1	119.3850	0.000	1	117.3173	0.607	21	117.4395	1.616	64	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:3:	3:	C[6]-3:C[6]-4:H-1:	C[5,6]-4:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5,6]C[6a])(C[6]C[5,6]HH)(H)	C[6](C[5,6]C[5,6]C[5]H)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C[6a])(C[6]C[5,6]HH)(H){1|H<1>,2|C<4>,4|C<3>}	C[6](C[5,6]C[5,6]C[5]H)(C[6a]C[6a]2)(C[6]C[6]H){1|C<4>,1|O<1>,3|C<3>,6|H<1>}	H(C[6]C[6]2)	117.9900	0.000	1	117.9900	0.000	1	117.3173	0.607	21	117.4395	1.616	64	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:3:	3:	C[6]-3:C[6]-4:H-1:	C[5,6]-4:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5,6]C[6a])(C[6]C[6]CC)(H)	C[6](C[5,6]C[5,6]C[5]C)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C[6a])(C[6]C[6]CC)(H){1|H<1>,2|C<4>,3|C<3>}	C[6](C[5,6]C[5,6]C[5]C)(C[6a]C[6a]2)(C[6]C[6]H){2|C<4>,4|H<1>,5|C<3>}	H(C[6]C[6]2)	116.9040	0.000	1	116.9040	0.000	1	117.3173	0.607	21	117.4395	1.616	64	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:3:	3:	C[6]-3:C[6]-4:H-1:	C[5,6]-4:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5,6]C[6a])(C[6]C[6]CH)(H)	C[6](C[5,6]C[5,6]O[5]H)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C[6a])(C[6]C[6]CH)(H){1|C<4>,1|O<2>,2|C<3>,3|H<1>}	C[6](C[5,6]C[5,6]O[5]H)(C[6a]C[6a]2)(C[6]C[6]H){1|O<2>,2|C<3>,3|C<4>,4|H<1>}	H(C[6]C[6]2)	117.0825	0.245	2	117.0825	0.060	2	117.3173	0.607	21	117.4395	1.616	64	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:3:	3:	C[6]-3:C[6]-4:H-1:	C[5,6]-4:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5,6]C[6a])(C[6]C[6]CH)(H)	C[6](C[5,6]C[5]2C[6])(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C[6a])(C[6]C[6]CH)(H){1|H<1>,2|C<4>,4|C<3>}	C[6](C[5,6]C[5]2C[6])(C[6a]C[6a]2)(C[6]C[6]H){1|N<2>,1|N<3>,1|O<1>,1|O<2>,2|C<4>,3|C<3>,4|H<1>}	H(C[6]C[6]2)	117.2400	0.000	1	117.2400	0.000	1	117.3173	0.607	21	117.4395	1.616	64	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:3:	3:	C[6]-3:C[6]-4:H-1:	C[5,6]-4:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5,6]C[6a])(C[6]C[6]HH)(H)	C[6](C[5,6]C[5,6]C[5]C)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C[6a])(C[6]C[6]HH)(H){2|C<4>,5|C<3>}	C[6](C[5,6]C[5,6]C[5]C)(C[6a]C[6a]2)(C[6]C[6]H){1|O<1>,2|C<3>,3|C<4>,5|H<1>}	H(C[6]C[6]2)	116.7430	0.000	1	116.7430	0.000	1	117.3173	0.607	21	117.4395	1.616	64	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:3:	3:	C[6]-3:C[6]-4:H-1:	C[5,6]-4:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5,6]C[6a])(C[6]C[6]HH)(H)	C[6](C[5,6]C[5,6]C[5]H)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C[6a])(C[6]C[6]HH)(H){2|C<3>,2|C<4>,3|H<1>}	C[6](C[5,6]C[5,6]C[5]H)(C[6a]C[6a]2)(C[6]C[6]H){1|C<4>,1|N<3>,1|O<2>,3|C<3>,6|H<1>}	H(C[6]C[6]2)	117.2140	0.244	3	117.4290	0.200	5	117.3173	0.607	21	117.4395	1.616	64	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:3:	3:	C[6]-3:C[6]-4:H-1:	C[5,6]-4:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5,6]C[6a])(C[6]C[6]HH)(H)	C[6](C[5,6]C[5,6]C[5]H)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C[6a])(C[6]C[6]HH)(H){2|C<3>,2|C<4>,3|H<1>}	C[6](C[5,6]C[5,6]C[5]H)(C[6a]C[6a]2)(C[6]C[6]H){1|N<3>,1|O<2>,2|C<3>,2|C<4>,6|H<1>}	H(C[6]C[6]2)	118.1600	0.000	1	117.4290	0.200	5	117.3173	0.607	21	117.4395	1.616	64	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:3:	3:	C[6]-3:C[6]-4:H-1:	C[5,6]-4:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5,6]C[6a])(C[6]C[6]HH)(H)	C[6](C[5,6]C[5,6]C[5]H)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C[6a])(C[6]C[6]HH)(H){2|C<4>,2|H<1>,3|C<3>}	C[6](C[5,6]C[5,6]C[5]H)(C[6a]C[6a]2)(C[6]C[6]H){2|C<4>,3|C<3>,7|H<1>}	H(C[6]C[6]2)	117.3430	0.000	1	117.4290	0.200	5	117.3173	0.607	21	117.4395	1.616	64	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:3:	3:	C[6]-3:C[6]-4:H-1:	C[5,6]-4:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5,6]C[6a])(C[6]C[6]HO)(H)	C[6](C[5,6]C[5,6]O[5]H)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C[6a])(C[6]C[6]HO)(H){1|C<4>,2|C<3>,2|H<1>,2|O<2>}	C[6](C[5,6]C[5,6]O[5]H)(C[6a]C[6a]2)(C[6]C[6]H){2|C<3>,2|C<4>,3|H<1>,3|O<2>}	H(C[6]C[6]2)	118.0025	1.773	2	118.0025	3.143	2	117.3173	0.607	21	117.4395	1.616	64	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:3:	3:	C[6]-3:C[6]-4:H-1:	C[5,6]-4:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5,6]C[6a])(C[6]C[6a]C[6]H)(H)	C[6](C[5,6]C[5,6a]C[5]C[6])(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C[6a])(C[6]C[6a]C[6]H)(H){1|C<4>,2|H<1>,6|C<3>}	C[6](C[5,6]C[5,6a]C[5]C[6])(C[6a]C[6a]2)(C[6]C[6]H){1|C<4>,1|N<3>,1|O<1>,1|O<2>,3|H<1>,6|C<3>}	H(C[6]C[6]2)	116.4240	0.000	1	116.4240	0.000	1	117.3173	0.607	21	117.4395	1.616	64	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:3:	3:	C[6]-3:C[6]-4:H-1:	C[5,6]-4:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5,6]C[6a])(C[6]C[6a]C[6]H)(H)	C[6](C[5,6]C[5]2C[6])(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C[6a])(C[6]C[6a]C[6]H)(H){1|C<2>,7|C<3>}	C[6](C[5,6]C[5]2C[6])(C[6a]C[6a]2)(C[6]C[6]H){1|C<4>,1|N<2>,1|O<1>,2|N<3>,3|H<1>,4|C<3>}	H(C[6]C[6]2)	116.8785	0.033	2	116.9437	0.032	6	117.3173	0.607	21	117.4395	1.616	64	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:3:	3:	C[6]-3:C[6]-4:H-1:	C[5,6]-4:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5,6]C[6a])(C[6]C[6a]C[6]H)(H)	C[6](C[5,6]C[5]2C[6])(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C[6a])(C[6]C[6a]C[6]H)(H){1|C<2>,7|C<3>}	C[6](C[5,6]C[5]2C[6])(C[6a]C[6a]2)(C[6]C[6]H){1|N<2>,1|O<1>,2|N<3>,3|H<1>,5|C<3>}	H(C[6]C[6]2)	117.0270	0.257	2	116.9437	0.032	6	117.3173	0.607	21	117.4395	1.616	64	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:3:	3:	C[6]-3:C[6]-4:H-1:	C[5,6]-4:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5,6]C[6a])(C[6]C[6a]C[6]H)(H)	C[6](C[5,6]C[5]2C[6])(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C[6a])(C[6]C[6a]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,6|C<3>}	C[6](C[5,6]C[5]2C[6])(C[6a]C[6a]2)(C[6]C[6]H){1|C<4>,1|N<2>,1|N<3>,1|O<1>,4|C<3>,5|H<1>}	H(C[6]C[6]2)	117.1130	0.000	1	116.9437	0.032	6	117.3173	0.607	21	117.4395	1.616	64	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:3:	3:	C[6]-3:C[6]-4:H-1:	C[5,6]-4:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5,6]C[6a])(C[6]C[6a]C[6]H)(H)	C[6](C[5,6]C[5]2C[6])(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C[6a])(C[6]C[6a]C[6]H)(H){1|C<4>,2|H<1>,6|C<3>}	C[6](C[5,6]C[5]2C[6])(C[6a]C[6a]2)(C[6]C[6]H){1|C<4>,1|N<2>,1|N<3>,1|O<1>,1|O<2>,4|C<3>,4|H<1>}	H(C[6]C[6]2)	116.7380	0.000	1	116.9437	0.032	6	117.3173	0.607	21	117.4395	1.616	64	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:3:	3:	C[6]-3:C[6]-4:H-1:	C[5]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6]HH)(H)	C[6](C[5]C[5,6]C[5]Rh)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6]HH)(H){1|Rh<8>,1|C<3>,2|C<4>,2|H<1>}	C[6](C[5]C[5,6]C[5]Rh)(C[6]C[6]H)2{1|C<3>,3|C<4>,4|H<1>}	H(C[6]C[6]2)	119.9320	0.000	1	119.9320	0.000	1	119.0720	1.479	2	117.4395	1.616	64	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:3:	3:	C[6]-3:C[6]-4:H-1:	C[5]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6]HH)(H)	C[6](C[5]C[5,6a]C[5]O)(C[6]C[6]H)(C[6]C[6]O)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6]HH)(H){1|C<4>,1|O<1>,1|O<2>,2|C<3>,2|H<1>}	C[6](C[5]C[5,6a]C[5]O)(C[6]C[6]H)(C[6]C[6]O){1|C<4>,1|N<3>,1|O<1>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	118.2120	0.000	1	118.2120	0.000	1	119.0720	1.479	2	117.4395	1.616	64	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:3:	3:	C[6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6]C)(C[6]C[6]HH)(H)	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6,6]C)(C[6]C[6]HH)(H){2|H<1>,3|C<4>}	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(COO){1|O<2>,3|C<4>,4|H<1>}	H(C[6]C[6]2)	117.1240	0.000	1	117.1240	0.000	1	117.5620	0.665	3	117.4395	1.616	64	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:3:	3:	C[6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6]C)(C[6]C[6]HH)(H)	C[6](C[6,6]C[6]3)(C[6]C[6]H)(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6,6]C)(C[6]C[6]HH)(H){2|H<1>,3|C<4>}	C[6](C[6,6]C[6]3)(C[6]C[6]H)(CCH){1|C<3>,2|C<4>,2|O<2>,6|H<1>}	H(C[6]C[6]2)	117.0590	0.000	1	117.0590	0.000	1	117.5620	0.665	3	117.4395	1.616	64	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:3:	3:	C[6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6]C)(C[6]O[6]HH)(H)	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(CC[6a]O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]C)(C[6]O[6]HH)(H){1|H<1>,2|C<4>}	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(CC[6a]O){1|C<4>,1|O<2>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	118.5030	0.000	1	118.5030	0.000	1	117.5620	0.665	3	117.4395	1.616	64	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:3:	3:	C[6]-3:C[6]-4:H-1:	C[6,6]-4:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6]C[6a])(C[6]C[5,6]HH)(H)	C[6](C[6,6]C[5,6,6]C[6]H)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]C[6a])(C[6]C[5,6]HH)(H){1|O<2>,2|C<3>,2|C<4>,2|H<1>}	C[6](C[6,6]C[5,6,6]C[6]H)(C[6a]C[6a]2)(C[6]C[6]H){1|O<2>,2|C<3>,3|C<4>,6|H<1>}	H(C[6]C[6]2)	119.0780	0.000	1	119.0780	0.000	1	117.7507	1.616	3	117.4395	1.616	64	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:3:	3:	C[6]-3:C[6]-4:H-1:	C[6,6]-4:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6]C[6a])(C[6]C[6,6]HH)(H)	C[6](C[6,6]C[6,6]C[6]C)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]C[6a])(C[6]C[6,6]HH)(H){3|C<4>,4|C<3>}	C[6](C[6,6]C[6,6]C[6]C)(C[6a]C[6a]2)(C[6]C[6]H){1|O<1>,2|C<3>,2|C<4>,6|H<1>}	H(C[6]C[6]2)	116.5440	0.000	1	116.5440	0.000	1	117.7507	1.616	3	117.4395	1.616	64	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:3:	3:	C[6]-3:C[6]-4:H-1:	C[6,6]-4:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6]C[6a])(C[6]N[6]HH)(H)	C[6](C[6,6]C[6,6]C[6]C)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]C[6a])(C[6]N[6]HH)(H){1|C<4>,4|C<3>}	C[6](C[6,6]C[6,6]C[6]C)(C[6a]C[6a]2)(C[6]C[6]H){1|N<2>,2|C<3>,2|C<4>,6|H<1>}	H(C[6]C[6]2)	117.6300	0.000	1	117.6300	0.000	1	117.7507	1.616	3	117.4395	1.616	64	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:3:	3:	C[6]-3:C[6]-4:H-1:	C[6]-4:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6]HH)(H)	C[6](C[6]C[6]HH)(C[5]C[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6]HH)(H){3|C<3>,3|H<1>}	C[6](C[6]C[6]HH)(C[5]C[5]2)(C[6]C[6]H){1|N<3>,1|O<1>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	118.2580	0.000	1	118.2580	0.000	1	118.1720	0.015	3	117.4395	1.616	64	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:3:	3:	C[6]-3:C[6]-4:H-1:	C[6]-4:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5]C[6])(C[6]C[6]HH)(H)	C[6](C[6]C[6a]O[6]H)(C[5]C[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6])(C[6]C[6]HH)(H){1|C<4>,1|O<2>,2|C<3>,3|H<1>}	C[6](C[6]C[6a]O[6]H)(C[5]C[5]2)(C[6]C[6]H){2|C<3>,3|C<4>,5|H<1>}	H(C[6]C[6]2)	118.1290	0.140	2	118.1290	0.020	2	118.1720	0.015	3	117.4395	1.616	64	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:3:	3:	C[6]-3:C[6]-4:H-1:	C[6]-4:C[5a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5a]C[6])(C[6]C[5,6]HH)(H)	C[6](C[6]C[5,6]HH)(C[5a]C[5a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6])(C[6]C[5,6]HH)(H){1|C<4>,3|C<3>,3|H<1>}	C[6](C[6]C[5,6]HH)(C[5a]C[5a]2)(C[6]C[6]H){1|C<4>,1|O<2>,2|C<3>,5|H<1>}	H(C[6]C[6]2)	118.5650	0.000	1	118.5650	0.000	1	118.5650	0.000	1	117.4395	1.616	64	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:3:	3:	C[6]-3:C[6]-4:H-1:	C[6]-4:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6])(C[6]C[6]HH)(H)	C[6](C[6]C[5]C[6]H)(C[6]C[6]H)(N[6]C[6]2)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6])(C[6]C[6]HH)(H){3|H<1>,4|C<4>}	C[6](C[6]C[5]C[6]H)(C[6]C[6]H)(N[6]C[6]2){1|N<3>,4|C<4>,9|H<1>}	H(C[6]C[6]2)	117.7810	0.000	1	117.7810	0.000	1	117.7810	0.000	1	117.4395	1.616	64	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:3:	3:	C[6]-3:C[6]-4:H-1:	C[6]-4:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[5,6]HH)(H)	C[6](C[6]C[5,6]HH)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[5,6]HH)(H){1|C<4>,3|C<3>,3|H<1>}	C[6](C[6]C[5,6]HH)(C[6a]C[6a]2)(C[6]C[6]H){1|C<4>,1|F<1>,3|C<3>,4|H<1>}	H(C[6]C[6]2)	120.1050	0.000	1	120.1050	0.000	1	118.1671	1.156	12	117.4395	1.616	64	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:3:	3:	C[6]-3:C[6]-4:H-1:	C[6]-4:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[5,6]HH)(H)	C[6](C[6]C[5,6]N[5]H)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[5,6]HH)(H){1|C<4>,1|N<3>,2|H<1>,3|C<3>}	C[6](C[6]C[5,6]N[5]H)(C[6a]C[6a]2)(C[6]C[6]H){2|C<4>,4|C<3>,5|H<1>}	H(C[6]C[6]2)	118.5705	0.682	2	118.5705	0.466	2	118.1671	1.156	12	117.4395	1.616	64	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:3:	3:	C[6]-3:C[6]-4:H-1:	C[6]-4:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[5,6]HH)(H)	C[6](C[6]N[5,6]CH)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[5,6]HH)(H){1|C<4>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6]N[5,6]CH)(C[6a]C[6a]2)(C[6]C[6]H){1|C<4>,3|C<3>,4|H<1>}	H(C[6]C[6]2)	118.2680	0.093	2	118.2680	0.009	2	118.1671	1.156	12	117.4395	1.616	64	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:3:	3:	C[6]-3:C[6]-4:H-1:	C[6]-4:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6,6]HH)(H)	C[6](C[6]C[6,6]HH)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6,6]HH)(H){1|C<4>,3|C<3>,3|H<1>}	C[6](C[6]C[6,6]HH)(C[6a]C[6a]2)(C[6]C[6]H){2|C<3>,2|C<4>,5|H<1>}	H(C[6]C[6]2)	116.0590	0.000	1	116.0590	0.000	1	118.1671	1.156	12	117.4395	1.616	64	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:3:	3:	C[6]-3:C[6]-4:H-1:	C[6]-4:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]CH)(H)	C[6](C[6]C[6]N[5]H)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]CH)(H){1|C<4>,1|N<3>,2|H<1>,3|C<3>}	C[6](C[6]C[6]N[5]H)(C[6a]C[6a]2)(C[6]C[6]H){1|N<3>,2|C<3>,4|C<4>,4|H<1>}	H(C[6]C[6]2)	117.6970	0.000	1	117.6970	0.000	1	118.1671	1.156	12	117.4395	1.616	64	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:3:	3:	C[6]-3:C[6]-4:H-1:	C[6]-4:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]HH)(H)	C[6](C[6]N[5a]C[6]H)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]HH)(H){1|C<4>,1|N<3>,2|C<3>,3|H<1>}	C[6](C[6]N[5a]C[6]H)(C[6a]C[6a]2)(C[6]C[6]H){1|C<4>,1|N<2>,3|C<3>,6|H<1>}	H(C[6]C[6]2)	117.3250	0.000	1	117.3250	0.000	1	118.1671	1.156	12	117.4395	1.616	64	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:3:	3:	C[6]-3:C[6]-4:H-1:	C[6]-4:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]HO)(H)	C[6](C[6]C[6a]C[6]H)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]HO)(H){1|C<4>,1|H<1>,1|O<2>,4|C<3>}	C[6](C[6]C[6a]C[6]H)(C[6a]C[6a]2)(C[6]C[6]H){1|C<4>,1|O<2>,4|H<1>,5|C<3>}	H(C[6]C[6]2)	118.4330	0.000	1	118.4330	0.000	1	118.1671	1.156	12	117.4395	1.616	64	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:3:	3:	C[6]-3:C[6]-4:H-1:	C[6]-4:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]C[6]NiH)(H)	C[6](C[6]C[6]NiH)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]C[6]NiH)(H){1|Ni<5>,1|C<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]NiH)(C[6a]C[6a]2)(C[6]C[6]H){1|Ni<5>,1|C<4>,1|P<4>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	119.5220	0.000	1	119.5220	0.000	1	118.1671	1.156	12	117.4395	1.616	64	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:3:	3:	C[6]-3:C[6]-4:H-1:	C[6]-4:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]HH)(H)	C[6](C[6]C[6]BrH)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]HH)(H){1|Br<1>,1|C<4>,1|S<4>,2|C<3>,2|H<1>}	C[6](C[6]C[6]BrH)(C[6a]C[6a]2)(C[6]C[6]H){1|N<4>,2|C<3>,6|H<1>}	H(C[6]C[6]2)	117.9080	0.000	1	117.9080	0.000	1	118.1671	1.156	12	117.4395	1.616	64	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:3:	3:	C[6]-3:C[6]-4:H-1:	C[6]-4:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6])(C[6]N[6]HH)(H)	C[6](C[6]C[6]SiH)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6])(C[6]N[6]HH)(H){1|Si<3>,1|C<4>,1|H<1>,1|S<4>,2|C<3>}	C[6](C[6]C[6]SiH)(C[6a]C[6a]2)(C[6]C[6]H){1|N<3>,2|C<3>,6|H<1>}	H(C[6]C[6]2)	117.2790	0.000	1	117.2790	0.000	1	118.1671	1.156	12	117.4395	1.616	64	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:3:	3:	C[6]-3:Ge[6]-4:H-1:	Ge[4,6]-4:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]Ge[4,6]C[6a])(Ge[6]Si[6]Si2)(H)	C[6](Ge[4,6]Ge[4]Si[6]C[4])(C[6a]C[6a]2)(C[6]Ge[6]H)	H(C[6]Ge[6]C[6])	C[6](C[6]Ge[4,6]C[6a])(Ge[6]Si[6]Si2)(H){1|Ge<4>,1|Si<4>,2|C<4>,3|C<3>}	C[6](Ge[4,6]Ge[4]Si[6]C[4])(C[6a]C[6a]2)(C[6]Ge[6]H){5|Si<4>,2|C<4>,2|H<1>,4|C<3>}	H(C[6]Ge[6]C[6])	113.1740	0.000	1	113.1740	0.000	1	113.1740	0.000	1	117.4395	1.616	64	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:3:	3:	C[6]-3:Si[6]-4:H-1:	Ge[4,6]-4:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]Ge[4,6]C[6a])(Si[6]Si[6]Si2)(H)	C[6](Ge[4,6]Si[4]Si[6]C[4])(C[6a]C[6a]2)(C[6]Si[6]H)	H(C[6]Si[6]C[6])	C[6](C[6]Ge[4,6]C[6a])(Si[6]Si[6]Si2)(H){2|Si<4>,2|C<4>,3|C<3>}	C[6](Ge[4,6]Si[4]Si[6]C[4])(C[6a]C[6a]2)(C[6]Si[6]H){5|Si<4>,2|C<4>,2|H<1>,4|C<3>}	H(C[6]Si[6]C[6])	112.6000	0.000	1	112.6000	0.000	1	112.6000	0.000	1	117.4395	1.616	64	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:4:	3:	C[6]-3:C[6]-4:H-1:	C[3,5,6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[3,5,6]C)(C[6]C[6]HH)(H)	C[6](C[3,5,6]C[3,5]C[3,6]C[5])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[3,5,6]C)(C[6]C[6]HH)(H){5|C<4>}	C[6](C[3,5,6]C[3,5]C[3,6]C[5])(C[6]C[6]H)(CH3){3|C<4>,6|H<1>}	H(C[6]C[6]2)	118.7450	0.000	1	118.7450	0.000	1	118.7450	0.000	1	117.2693	1.112	65	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:4:	3:	C[6]-3:C[6]-4:H-1:	C[3,6,6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[3,6,6]C)(C[6]C[6]HH)(H)	C[6](C[3,6,6]C[3,6]C[6,6]O[3])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[3,6,6]C)(C[6]C[6]HH)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[3,6,6]C[3,6]C[6,6]O[3])(C[6]C[6]H)(CH3){1|C<3>,3|C<4>,3|H<1>}	H(C[6]C[6]2)	117.2320	0.213	3	117.2320	0.045	3	117.2320	0.045	3	117.2693	1.112	65	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:4:	3:	C[6]-3:C[6]-4:H-1:	C[3,6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[3,6]C)(C[6]C[6]HH)(H)	C[6](C[3,6]C[3,6]C[3]H)(C[6]C[6]H)(CC[6]HH)	H(C[6]C[6]2)	C[6](C[6]C[3,6]C)(C[6]C[6]HH)(H){2|C<4>,3|H<1>}	C[6](C[3,6]C[3,6]C[3]H)(C[6]C[6]H)(CC[6]HH){3|C<4>,3|H<1>}	H(C[6]C[6]2)	119.4860	0.000	1	119.4860	0.000	1	119.4860	0.000	1	117.2693	1.112	65	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:4:	3:	C[6]-3:C[6]-4:H-1:	C[3x6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[3x6]C)(C[6]C[6]CH)(H)	C[6](C[3x6]C[3x6]C[6,6]O[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[3x6]C)(C[6]C[6]CH)(H){1|H<1>,1|O<2>,3|C<4>}	C[6](C[3x6]C[3x6]C[6,6]O[6])(C[6]C[6]H)(CH3){2|C<3>,2|H<1>,5|C<4>}	H(C[6]C[6]2)	117.3470	0.000	1	117.3470	0.000	1	117.3470	0.000	1	117.2693	1.112	65	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:4:	3:	C[6]-3:C[6]-4:H-1:	C[4,6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[4,6]C)(C[6]C[6]HH)(H)	C[6](C[4,6]C[4,5]C[4,6]H)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[4,6]C)(C[6]C[6]HH)(H){2|H<1>,3|C<4>}	C[6](C[4,6]C[4,5]C[4,6]H)(C[6]C[6]H)(CH3){1|C<3>,1|O<2>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	117.3775	0.368	2	117.3775	0.136	2	117.3775	0.136	2	117.2693	1.112	65	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:4:	3:	C[6]-3:C[6]-4:H-1:	C[5,6,6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6,6]C)(C[6]O[6]HH)(H)	C[6](C[5,6,6]C[5,6,6]C[5,6a]O[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5,6,6]C)(C[6]O[6]HH)(H){1|C<3>,1|C<4>,1|O<2>}	C[6](C[5,6,6]C[5,6,6]C[5,6a]O[6])(C[6]C[6]H)(CH3){2|H<1>,2|O<2>,4|C<3>}	H(C[6]C[6]2)	117.8170	0.000	1	117.8170	0.000	1	117.8170	0.000	1	117.2693	1.112	65	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:4:	3:	C[6]-3:C[6]-4:H-1:	C[5,6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[6]CC)(H)	C[6](C[5,6]C[5,6]2H)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[6]CC)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[5,6]C[5,6]2H)(C[6]C[6]H)(CH3){1|C<3>,1|H<1>,6|C<4>}	H(C[6]C[6]2)	117.2870	0.000	1	117.2870	0.000	1	117.3257	0.553	21	117.2693	1.112	65	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:4:	3:	C[6]-3:C[6]-4:H-1:	C[5,6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[6]CH)(H)	C[6](C[5,6]C[5,6]2H)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[6]CH)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[5,6]C[5,6]2H)(C[6]C[6]H)(CH3){1|C<3>,2|H<1>,5|C<4>}	H(C[6]C[6]2)	116.7900	0.000	1	116.7900	0.000	1	117.3257	0.553	21	117.2693	1.112	65	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:4:	3:	C[6]-3:C[6]-4:H-1:	C[5,6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[6]HH)(H)	C[6](C[5,6]C[5,6]2H)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[6]HH)(H){2|H<1>,3|C<4>}	C[6](C[5,6]C[5,6]2H)(C[6]C[6]H)(CH3){1|C<3>,1|O<2>,2|C<4>,4|H<1>}	H(C[6]C[6]2)	115.3580	0.000	1	116.7590	3.926	2	117.3257	0.553	21	117.2693	1.112	65	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:4:	3:	C[6]-3:C[6]-4:H-1:	C[5,6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[6]HH)(H)	C[6](C[5,6]C[5,6]2H)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[6]HH)(H){2|H<1>,3|C<4>}	C[6](C[5,6]C[5,6]2H)(C[6]C[6]H)(CH3){1|O<2>,3|C<4>,4|H<1>}	H(C[6]C[6]2)	118.1600	0.000	1	116.7590	3.926	2	117.3257	0.553	21	117.2693	1.112	65	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:4:	3:	C[6]-3:C[6]-4:H-1:	C[5,6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[6]HH)(H)	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[6]HH)(H){1|C<3>,1|H<1>,1|O<2>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(CH3){3|C<4>,5|H<1>}	H(C[6]C[6]2)	117.1344	0.310	8	117.3554	0.413	14	117.3257	0.553	21	117.2693	1.112	65	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:4:	3:	C[6]-3:C[6]-4:H-1:	C[5,6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[6]HH)(H)	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[6]HH)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(CH3){1|O<2>,3|C<4>,4|H<1>}	H(C[6]C[6]2)	116.8170	0.000	1	117.3554	0.413	14	117.3257	0.553	21	117.2693	1.112	65	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:4:	3:	C[6]-3:C[6]-4:H-1:	C[5,6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[6]HH)(H)	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[6]HH)(H){2|H<1>,3|C<4>}	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(CH3){1|O<2>,3|C<4>,4|H<1>}	H(C[6]C[6]2)	117.8168	0.859	5	117.3554	0.413	14	117.3257	0.553	21	117.2693	1.112	65	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:4:	3:	C[6]-3:C[6]-4:H-1:	C[5,6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[6]HH)(H)	C[6](C[5,6]C[5,6]O[5]C)(C[6]C[6]H)(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[6]HH)(H){1|C<3>,1|O<2>,3|C<4>}	C[6](C[5,6]C[5,6]O[5]C)(C[6]C[6]H)(CHHO){1|C<3>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	118.1730	0.000	1	118.1730	0.000	1	117.3257	0.553	21	117.2693	1.112	65	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:4:	3:	C[6]-3:C[6]-4:H-1:	C[5,6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[6]HH)(H)	C[6](C[5,6]C[5,6a]C[5]C[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[6]HH)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[5,6]C[5,6a]C[5]C[6])(C[6]C[6]H)(CH3){2|C<3>,4|C<4>,4|H<1>}	H(C[6]C[6]2)	117.4660	0.000	1	117.4660	0.000	1	117.3257	0.553	21	117.2693	1.112	65	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:4:	3:	C[6]-3:C[6]-4:H-1:	C[5,6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]C)(C[6]C[6]HO)(H)	C[6](C[5,6]C[5,6]O[5]H)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C)(C[6]C[6]HO)(H){1|C<4>,2|H<1>,2|O<2>}	C[6](C[5,6]C[5,6]O[5]H)(C[6]C[6]H)(CH3){2|C<4>,2|H<1>,2|O<2>}	H(C[6]C[6]2)	117.6300	0.000	1	117.6300	0.000	1	117.3257	0.553	21	117.2693	1.112	65	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:4:	3:	C[6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6]C)(C[6]C[6]CO)(H)	C[6](C[6,6]C[6,6]C[6]O)(C[6]C[6]H)(CCCH)	H(C[6]C[6]2)	C[6](C[6]C[6,6]C)(C[6]C[6]CO)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[6,6]C[6,6]C[6]O)(C[6]C[6]H)(CCCH){1|C<3>,1|O<2>,2|H<1>,4|C<4>}	H(C[6]C[6]2)	119.0860	0.000	1	119.0860	0.000	1	117.5602	0.368	29	117.2693	1.112	65	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:4:	3:	C[6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6]C)(C[6]C[6]HH)(H)	C[6](C[6,6]C[5,6,6]C[6]H)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6]C)(C[6]C[6]HH)(H){2|C<4>,3|H<1>}	C[6](C[6,6]C[5,6,6]C[6]H)(C[6]C[6]H)(CH3){1|N<3>,1|O<2>,2|C<4>,4|H<1>}	H(C[6]C[6]2)	117.6420	0.669	2	117.6420	0.447	2	117.5602	0.368	29	117.2693	1.112	65	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:4:	3:	C[6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6]C)(C[6]C[6]HH)(H)	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6]C)(C[6]C[6]HH)(H){2|H<1>,3|C<4>}	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(CH3){1|O<2>,3|C<4>,4|H<1>}	H(C[6]C[6]2)	116.9390	0.051	2	117.1741	0.074	9	117.5602	0.368	29	117.2693	1.112	65	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:4:	3:	C[6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6]C)(C[6]C[6]HH)(H)	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6]C)(C[6]C[6]HH)(H){2|H<1>,3|C<4>}	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(CH3){3|C<4>,5|H<1>}	H(C[6]C[6]2)	117.2413	0.272	7	117.1741	0.074	9	117.5602	0.368	29	117.2693	1.112	65	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:4:	3:	C[6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6]C)(C[6]C[6]HH)(H)	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6,6]C)(C[6]C[6]HH)(H){2|H<1>,3|C<4>}	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(CHHO){3|C<4>,5|H<1>}	H(C[6]C[6]2)	117.1270	0.617	4	117.1270	0.380	4	117.5602	0.368	29	117.2693	1.112	65	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:4:	3:	C[6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6]C)(C[6]C[6]HH)(H)	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6,6]C)(C[6]C[6]HH)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(CCHH){2|C<3>,2|C<4>,4|H<1>}	H(C[6]C[6]2)	118.9430	0.000	1	118.9430	0.000	1	117.5602	0.368	29	117.2693	1.112	65	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:4:	3:	C[6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6]C)(C[6]C[6]HH)(H)	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6]C)(C[6]C[6]HH)(H){1|C<3>,1|H<1>,3|C<4>}	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(CH3){1|C<3>,2|C<4>,4|H<1>}	H(C[6]C[6]2)	117.9630	0.345	2	117.5880	0.086	8	117.5602	0.368	29	117.2693	1.112	65	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:4:	3:	C[6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6]C)(C[6]C[6]HH)(H)	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6]C)(C[6]C[6]HH)(H){2|C<4>,3|H<1>}	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(CH3){4|C<4>,4|H<1>}	H(C[6]C[6]2)	117.4630	0.148	6	117.5880	0.086	8	117.5602	0.368	29	117.2693	1.112	65	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:4:	3:	C[6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6]C)(C[6]C[6]HH)(H)	C[6](C[6,6]N[6,6]O[6]H)(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6,6]C)(C[6]C[6]HH)(H){1|N<3>,1|O<2>,3|H<1>}	C[6](C[6,6]N[6,6]O[6]H)(C[6]C[6]H)(CCHH){2|H<1>,3|C<4>}	H(C[6]C[6]2)	118.1645	0.255	2	118.1645	0.065	2	117.5602	0.368	29	117.2693	1.112	65	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:4:	3:	C[6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6]C)(C[6]C[6]HO)(H)	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6]C)(C[6]C[6]HO)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(CH3){1|C<3>,1|O<2>,3|C<4>,3|H<1>}	H(C[6]C[6]2)	117.6660	0.000	1	117.9125	0.122	2	117.5602	0.368	29	117.2693	1.112	65	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:4:	3:	C[6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6]C)(C[6]C[6]HO)(H)	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6]C)(C[6]C[6]HO)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(CH3){1|O<2>,3|H<1>,4|C<4>}	H(C[6]C[6]2)	118.1590	0.000	1	117.9125	0.122	2	117.5602	0.368	29	117.2693	1.112	65	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:4:	3:	C[6]-3:C[6]-4:H-1:	C[6,6]-4:C[6]-3:Si-4:	C[6]-3:	C[6](C[6]C[6,6]Si)(C[6]C[6]HH)(H)	C[6](C[6,6]C[6,6a]C[6,6]H)(C[6]C[6]H)(SiC3)	H(C[6]C[6]2)	C[6](C[6]C[6,6]Si)(C[6]C[6]HH)(H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6,6]C[6,6a]C[6,6]H)(C[6]C[6]H)(SiC3){1|C<4>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	116.3235	0.030	2	116.3235	0.001	2	116.3235	0.001	2	117.2693	1.112	65	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:4:	3:	C[6]-3:C[6]-4:H-1:	Ga[6]-4:C[6]-3:Si-4:	C[6]-3:	C[6](C[6]Ga[6]Si)(C[6]C[6]HH)(H)	C[6](Ga[6]C[6]N[6]Cl)(C[6]C[6]H)(SiC3)	H(C[6]C[6]2)	C[6](C[6]Ga[6]Si)(C[6]C[6]HH)(H){1|Cl<1>,1|C<3>,1|H<1>,1|N<3>}	C[6](Ga[6]C[6]N[6]Cl)(C[6]C[6]H)(SiC3){1|Si<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	114.6295	0.383	2	114.6295	0.146	2	114.6295	0.146	2	117.2693	1.112	65	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:3:4:	3:	C[6]-3:C[6]-4:H-1:	In[6]-4:C[6]-3:Si-4:	C[6]-3:	C[6](C[6]In[6]Si)(C[6]C[6]HH)(H)	C[6](In[6]C[6]N[6]C)(C[6]C[6]H)(SiC3)	H(C[6]C[6]2)	C[6](C[6]In[6]Si)(C[6]C[6]HH)(H){1|C<3>,1|C<4>,1|H<1>,1|N<3>}	C[6](In[6]C[6]N[6]C)(C[6]C[6]H)(SiC3){1|Si<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	113.8330	0.338	2	113.8330	0.114	2	113.8330	0.114	2	117.2693	1.112	65	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:4:3:	3:	C[6]-3:C[6]-4:H-1:	C[3,5,5]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[3,5,5]C[6])(C[6]C[6]HH)(H)	C[6](C[3,5,5]C[3,5]2C[5,5])(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[3,5,5]C[6])(C[6]C[6]HH)(H){4|C<4>,4|H<1>}	C[6](C[3,5,5]C[3,5]2C[5,5])(C[6]C[6]HH)(C[6]C[6]H){1|O<2>,2|C<3>,3|C<4>,6|H<1>}	H(C[6]C[6]2)	118.2840	0.228	4	118.2840	0.052	4	118.2840	0.052	4	118.1452	0.353	6	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:4:3:	3:	C[6]-3:C[6]-4:H-1:	C[5,6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[5,6]C[6])(C[6]C[5,6]HO)(H)	C[6](C[5,6]O[5,6]C[5]H)(C[6]C[6]2H)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C[6])(C[6]C[5,6]HO)(H){1|O<2>,3|H<1>,4|C<4>}	C[6](C[5,6]O[5,6]C[5]H)(C[6]C[6]2H)(C[6]C[6]H){2|O<2>,4|H<1>,6|C<4>}	H(C[6]C[6]2)	118.6980	0.000	1	118.6980	0.000	1	118.6980	0.000	1	118.1452	0.353	6	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	3:4:1:	4:4:3:	3:	C[6]-3:C[6]-4:H-1:	C[6,6]-4:C[5]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6]C[5])(C[6]C[6]HH)(H)	C[6](C[6,6]C[6,6]C[6]C)(C[5]C[5]O[5]H)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]C[5])(C[6]C[6]HH)(H){1|O<2>,3|H<1>,4|C<4>}	C[6](C[6,6]C[6,6]C[6]C)(C[5]C[5]O[5]H)(C[6]C[6]H){1|C<3>,2|O<2>,4|C<4>,5|H<1>}	H(C[6]C[6]2)	117.0370	0.000	1	117.0370	0.000	1	117.0370	0.000	1	118.1452	0.353	6	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	2:3:1:	3:	C[6]-4:C[6]-3:H-1:	O[6]-2:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]C[5]H)(C[6]O[6]H)(H)	C[6](O[6]C[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C[5]H)(C[6]O[6]H)(H){1|C<2>,1|S<2>,2|C<3>}	C[6](O[6]C[5,6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	115.8220	0.000	1	115.8220	0.000	1	118.5934	5.186	9	118.0312	7.771	10	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	2:3:1:	3:	C[6]-4:C[6]-3:H-1:	O[6]-2:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]HH)(C[6]O[6]H)(H)	C[6](O[6]C[5,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]HH)(C[6]O[6]H)(H){1|C<4>,1|H<1>,1|O<2>}	C[6](O[6]C[5,6])(C[6]C[6]H)(H){2|C<4>,3|H<1>}	H(C[6]C[6]2)	118.8360	0.000	1	118.8360	0.000	1	118.5934	5.186	9	118.0312	7.771	10	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	2:3:1:	3:	C[6]-4:C[6]-3:H-1:	O[6]-2:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]C[6a]H)(C[6]O[6]H)(H)	C[6](O[6]C[5a,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]C[6a]H)(C[6]O[6]H)(H){4|C<3>}	C[6](O[6]C[5a,6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	117.3860	0.000	1	117.3860	0.000	1	118.5934	5.186	9	118.0312	7.771	10	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	2:3:1:	3:	C[6]-4:C[6]-3:H-1:	O[6]-2:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]HO)(C[6]O[6]H)(H)	C[6](O[6]C[6,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]HO)(C[6]O[6]H)(H){1|C<4>,1|H<1>,1|O<2>}	C[6](O[6]C[6,6])(C[6]C[6]H)(H){1|O<2>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.6810	0.000	1	118.6810	0.000	1	118.5934	5.186	9	118.0312	7.771	10	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	2:3:1:	3:	C[6]-4:C[6]-3:H-1:	O[6]-2:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]C[6a]H)(C[6]O[6]H)(H)	C[6](O[6]C[6,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C[6a]H)(C[6]O[6]H)(H){4|C<3>}	C[6](O[6]C[6,6a])(C[6]C[6]H)(H){1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.3232	2.721	5	119.3232	7.404	5	118.5934	5.186	9	118.0312	7.771	10	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	2:3:1:	3:	C[6]-4:C[6]-3:H-1:	S[6]-2:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]CC)(C[6]S[6]H)(H)	C[6](S[6]C[5a,6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]CC)(C[6]S[6]H)(H){2|C<3>}	C[6](S[6]C[5a,6])(C[6]C[6]H)(H){1|C<4>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	112.9710	0.000	1	112.9710	0.000	1	112.9710	0.000	1	118.0312	7.771	10	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	2:3:3:	3:	C[6]-4:C[6]-3:H-1:	N[6]-2:C[6]-3:C-3:	C[6]-3:	C[6](C[6]N[5,6]C[6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[5,6])(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]N[5,6]C[6a]H)(C[6]N[6]C)(H){4|C<3>}	C[6](N[6]C[5,6])(C[6]C[6]H)(COO){1|C<3>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	118.0140	0.000	1	118.0140	0.000	1	118.0140	0.000	1	118.3719	0.202	8	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	2:3:3:	3:	C[6]-4:C[6]-3:H-1:	O[6]-2:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[5,6]C[6a]H)(C[6]O[6]C)(H)	C[6](O[6]C[5,6])(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C[6a]H)(C[6]O[6]C)(H){1|H<1>,2|C<3>,2|C<4>}	C[6](O[6]C[5,6])(C[6]C[6]H)(COO){1|C<3>,1|C<4>,1|O<2>,2|H<1>}	H(C[6]C[6]2)	118.1190	0.000	1	118.1190	0.000	1	118.2777	0.077	6	118.3719	0.202	8	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	2:3:3:	3:	C[6]-4:C[6]-3:H-1:	O[6]-2:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[5,6]C[6a]H)(C[6]O[6]C)(H)	C[6](O[6]C[5,6])(C[6]C[6]H)(COS)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C[6a]H)(C[6]O[6]C)(H){1|H<1>,2|C<3>,2|C<4>}	C[6](O[6]C[5,6])(C[6]C[6]H)(COS){1|C<4>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	118.5470	0.000	1	118.5470	0.000	1	118.2777	0.077	6	118.3719	0.202	8	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	2:3:3:	3:	C[6]-4:C[6]-3:H-1:	O[6]-2:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6]C[6a]H)(C[6]O[6]C)(H)	C[6](O[6]C[6,6])(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6,6]C[6a]H)(C[6]O[6]C)(H){1|H<1>,2|C<3>,2|C<4>}	C[6](O[6]C[6,6])(C[6]C[6]H)(COO){1|C<3>,1|C<4>,1|O<2>,2|H<1>}	H(C[6]C[6]2)	118.5110	0.008	2	118.5110	0.000	2	118.2777	0.077	6	118.3719	0.202	8	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	2:3:3:	3:	C[6]-4:C[6]-3:H-1:	O[6]-2:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]C[6a]H)(C[6]O[6]C)(H)	C[6](O[6]C[6,6a])(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C[6a]H)(C[6]O[6]C)(H){4|C<3>}	C[6](O[6]C[6,6a])(C[6]C[6]H)(COO){1|H<1>,3|C<3>}	H(C[6]C[6]2)	118.0580	0.000	1	118.0580	0.000	1	118.2777	0.077	6	118.3719	0.202	8	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	2:3:3:	3:	C[6]-4:C[6]-3:H-1:	O[6]-2:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6a]HH)(C[6]O[6]C)(H)	C[6](O[6]C[6,6a])(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]HH)(C[6]O[6]C)(H){2|C<3>}	C[6](O[6]C[6,6a])(C[6]C[6]H)(COO){2|C<3>,2|H<1>}	H(C[6]C[6]2)	117.9200	0.000	1	117.9200	0.000	1	118.2777	0.077	6	118.3719	0.202	8	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	2:3:3:	3:	C[6]-4:C[6]-3:H-1:	O[6]-2:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6,6a]C[6a]H)(C[6]O[6]N)(H)	C[6](O[6]C[6,6a])(C[6]C[6]H)(NCS)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C[6a]H)(C[6]O[6]N)(H){4|C<3>}	C[6](O[6]C[6,6a])(C[6]C[6]H)(NCS){1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.2950	0.000	1	119.2950	0.000	1	119.2950	0.000	1	118.3719	0.202	8	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	2:3:4:	3:	C[6]-4:C[6]-3:H-1:	O[6]-2:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]C[6a]H)(C[6]O[6]C)(H)	C[6](O[6]C[5,6])(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C[6a]H)(C[6]O[6]C)(H){1|C<4>,3|C<3>}	C[6](O[6]C[5,6])(C[6]C[6]H)(CCHH){1|H<1>,3|C<3>}	H(C[6]C[6]2)	117.3440	0.000	1	117.3440	0.000	1	117.3880	0.004	2	117.3880	0.004	2	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	2:3:4:	3:	C[6]-4:C[6]-3:H-1:	O[6]-2:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5a,6]CC)(C[6]O[6]C)(H)	C[6](O[6]C[5a,6])(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]CC)(C[6]O[6]C)(H){2|C<3>}	C[6](O[6]C[5a,6])(C[6]C[6]H)(CCHH){1|N<3>,3|C<3>}	H(C[6]C[6]2)	117.4320	0.000	1	117.4320	0.000	1	117.3880	0.004	2	117.3880	0.004	2	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:2:1:	3:	C[3,6]-4:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[3,6]C[3,6]C[3]H)(C[6]N[6]H)(H)	C[6](C[6]C[3,6]H)(N[6]C[6])(H)	H(C[6]C[3,6]C[6])	C[6](C[3,6]C[3,6]C[3]H)(C[6]N[6]H)(H){1|C<4>,3|C<3>}	C[6](C[6]C[3,6]H)(N[6]C[6])(H){1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[3,6]C[6])	119.5590	0.000	1	119.5590	0.000	1	119.5590	0.000	1	119.4944	0.615	28	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:2:1:	3:	C[3,6]-4:C[6]-3:H-1:	C[6]-3:O[6]-2:H-1:	C[6]-3:	C[6](C[3,6]C[3,6,6]C[3,6]C[6a])(C[6]O[6]H)(H)	C[6](C[6]C[3,6]H)(O[6]C[6])(H)	H(C[6]C[3,6]C[6])	C[6](C[3,6]C[3,6,6]C[3,6]C[6a])(C[6]O[6]H)(H){1|H<1>,1|O<2>,2|C<3>,2|C<4>}	C[6](C[6]C[3,6]H)(O[6]C[6])(H){2|C<4>,3|C<3>}	H(C[6]C[3,6]C[6])	119.4990	0.000	1	119.4990	0.000	1	119.3185	0.065	2	119.4944	0.615	28	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:2:1:	3:	C[3,6]-4:C[6]-3:H-1:	C[6]-3:O[6]-2:H-1:	C[6]-3:	C[6](C[3,6]C[3,6]C[6a]C[3])(C[6]O[6]H)(H)	C[6](C[6]C[3,6]H)(O[6]C[6])(H)	H(C[6]C[3,6]C[6])	C[6](C[3,6]C[3,6]C[6a]C[3])(C[6]O[6]H)(H){1|C<4>,2|H<1>,3|C<3>}	C[6](C[6]C[3,6]H)(O[6]C[6])(H){1|C<3>,1|H<1>,3|C<4>}	H(C[6]C[3,6]C[6])	119.1380	0.000	1	119.1380	0.000	1	119.3185	0.065	2	119.4944	0.615	28	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:2:1:	3:	C[5,6,6]-4:C[6]-3:H-1:	C[6]-3:O[6]-2:H-1:	C[6]-3:	C[6](C[5,6,6]C[5,3x6]C[6]O[5])(C[6]O[6]H)(H)	C[6](C[6]C[5,6,6]H)(O[6]C[6,6])(H)	H(C[6]C[5,6,6]C[6])	C[6](C[5,6,6]C[5,3x6]C[6]O[5])(C[6]O[6]H)(H){2|H<1>,5|C<4>}	C[6](C[6]C[5,6,6]H)(O[6]C[6,6])(H){1|C<3>,1|O<2>,3|C<4>}	H(C[6]C[5,6,6]C[6])	119.1030	0.000	1	119.1030	0.000	1	120.0540	0.195	7	119.4944	0.615	28	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:2:1:	3:	C[5,6,6]-4:C[6]-3:H-1:	C[6]-3:O[6]-2:H-1:	C[6]-3:	C[6](C[5,6,6]C[5,6]O[5,6]C[6])(C[6]O[6]H)(H)	C[6](C[6]C[5,6,6]H)(O[6]C[5,6])(H)	H(C[6]C[5,6,6]C[6])	C[6](C[5,6,6]C[5,6]O[5,6]C[6])(C[6]O[6]H)(H){2|H<1>,5|C<4>}	C[6](C[6]C[5,6,6]H)(O[6]C[5,6])(H){1|H<1>,1|O<2>,3|C<4>}	H(C[6]C[5,6,6]C[6])	120.2125	0.152	6	120.2125	0.023	6	120.0540	0.195	7	119.4944	0.615	28	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:2:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:O[6]-2:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]O[5]H)(C[6]O[6]H)(H)	C[6](C[6]C[5,6]H)(O[6]C[6])(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]O[5]H)(C[6]O[6]H)(H){1|C<4>,1|H<1>,2|C<3>}	C[6](C[6]C[5,6]H)(O[6]C[6])(H){1|C<4>,1|O<2>,3|H<1>}	H(C[6]C[5,6]C[6])	119.4570	0.000	1	119.4570	0.000	1	119.4570	0.000	1	119.4944	0.615	28	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:2:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:N[6]-2:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]Mo)(C[6]N[6]H)(H)	C[6](C[6]C[6,6]H)(N[6]C[6])(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]Mo)(C[6]N[6]H)(H){1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[6,6]H)(N[6]C[6])(H){1|Mo<9>,1|H<1>,2|C<4>}	H(C[6]C[6,6]C[6])	119.3430	0.000	1	119.3430	0.000	1	119.3430	0.000	1	119.4944	0.615	28	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:2:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:O[6]-2:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]2H)(C[6]O[6]H)(H)	C[6](C[6]C[6,6]H)(O[6]C[6,6])(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2H)(C[6]O[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|O<1>,1|O<2>}	C[6](C[6]C[6,6]H)(O[6]C[6,6])(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6,6]C[6])	119.8120	0.000	1	119.8120	0.000	1	119.1545	0.805	6	119.4944	0.615	28	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:2:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:O[6]-2:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]2O)(C[6]O[6]H)(H)	C[6](C[6]C[6,6]H)(O[6]C[6,6])(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2O)(C[6]O[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|O<1>,1|O<2>}	C[6](C[6]C[6,6]H)(O[6]C[6,6])(H){1|C<3>,1|O<2>,3|C<4>}	H(C[6]C[6,6]C[6])	119.9545	0.223	2	119.9545	0.050	2	119.1545	0.805	6	119.4944	0.615	28	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:2:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:O[6]-2:H-1:	C[6]-3:	C[6](C[6,6]C[6,6a]2C[6])(C[6]O[6]H)(H)	C[6](C[6]C[6,6]H)(O[6]C[6,6a])(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]2C[6])(C[6]O[6]H)(H){1|C<4>,1|H<1>,1|O<2>,4|C<3>}	C[6](C[6]C[6,6]H)(O[6]C[6,6a])(H){1|C<4>,3|C<3>}	H(C[6]C[6,6]C[6])	117.8250	0.000	1	117.8250	0.000	1	119.1545	0.805	6	119.4944	0.615	28	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:2:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:O[6]-2:H-1:	C[6]-3:	C[6](C[6,6]C[6]3)(C[6]O[6]H)(H)	C[6](C[6]C[6,6]H)(O[6]C[6])(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6]3)(C[6]O[6]H)(H){1|C<4>,1|N<3>,2|C<3>,4|H<1>}	C[6](C[6]C[6,6]H)(O[6]C[6])(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6,6]C[6])	118.6905	0.257	2	118.6905	0.066	2	119.1545	0.805	6	119.4944	0.615	28	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:2:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:O[6]-2:H-1:	C[6]-3:	C[6](C[6]C[5]C[6]H)(C[6]O[6]H)(H)	C[6](C[6]C[6]H)(O[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6]H)(C[6]O[6]H)(H){1|C<3>,1|C<4>,1|O<2>,3|H<1>}	C[6](C[6]C[6]H)(O[6]C[6])(H){2|H<1>,3|C<4>}	H(C[6]C[6]2)	119.9240	0.000	1	119.9240	0.000	1	119.5883	0.405	9	119.4944	0.615	28	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:2:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:O[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]GdO)(C[6]O[6]H)(H)	C[6](C[6]C[6]H)(O[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]GdO)(C[6]O[6]H)(H){1|C<3>,1|O<3>}	C[6](C[6]C[6]H)(O[6]C[6])(H){1|Gd<16>,1|O<2>,2|C<4>}	H(C[6]C[6]2)	120.0807	0.400	4	120.0807	0.160	4	119.5883	0.405	9	119.4944	0.615	28	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:2:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:O[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]HO)(C[6]O[6]H)(H)	C[6](C[6]C[6]H)(O[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HO)(C[6]O[6]H)(H){1|C<4>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(O[6]C[6])(H){1|O<2>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.9545	0.559	2	118.9545	0.313	2	119.5883	0.405	9	119.4944	0.615	28	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:2:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:O[6]-2:H-1:	C[6]-3:	C[6](C[6]C[6]HS)(C[6]O[6]H)(H)	C[6](C[6]C[6]H)(O[6]C[6])(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HS)(C[6]O[6]H)(H){1|C<4>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(O[6]C[6])(H){1|S<2>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.0695	0.153	2	119.0695	0.024	2	119.5883	0.405	9	119.4944	0.615	28	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:2:1:	3:	S[6]-4:C[6]-3:H-1:	C[6]-3:S[6]-2:H-1:	C[6]-3:	C[6](S[6]C[6]OO)(C[6]S[6]H)(H)	C[6](C[6]S[6]H)(S[6]C[6])(H)	H(C[6]C[6]S[6])	C[6](S[6]C[6]OO)(C[6]S[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]S[6]H)(S[6]C[6])(H){1|Si<4>,1|C<3>,2|O<1>}	H(C[6]C[6]S[6])	117.2470	0.000	1	117.2470	0.000	1	117.2470	0.000	1	119.4944	0.615	28	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:2:2:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:O[6]-2:O-2:	C[6]-3:	C[6](C[6]C[5,6]CH)(C[6]O[6]O)(H)	C[6](C[6]C[6]H)(O[6]Ge[6])(OC)	H(C[6]C[6]2)	C[6](C[6]C[5,6]CH)(C[6]O[6]O)(H){1|Ge<4>,2|C<3>}	C[6](C[6]C[6]H)(O[6]Ge[6])(OC){1|C<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	118.9080	0.000	1	118.9080	0.000	1	118.9080	0.000	1	118.9080	0.000	1	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:2:3:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:O[6]-2:C-3:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]H)(C[6]O[6]C)(H)	C[6](C[6]C[5,6]H)(O[6]C[6])(COO)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]H)(C[6]O[6]C)(H){1|H<1>,1|O<1>,1|O<2>,2|C<4>}	C[6](C[6]C[5,6]H)(O[6]C[6])(COO){1|C<3>,1|H<1>,3|C<4>}	H(C[6]C[5,6]C[6])	118.9750	0.078	2	118.9750	0.006	2	118.9750	0.006	2	118.5237	1.195	40	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:2:3:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:O[6]-2:C-3:	C[6]-3:	C[6](C[6,6]C[6,6a]C[6,6]H)(C[6]O[6]C)(H)	C[6](C[6]C[6,6]H)(O[6]C[6])(COO)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]C[6,6]H)(C[6]O[6]C)(H){1|H<1>,2|C<3>,2|C<4>}	C[6](C[6]C[6,6]H)(O[6]C[6])(COO){1|C<3>,1|C<4>,1|N<3>,2|H<1>}	H(C[6]C[6,6]C[6])	118.8820	0.000	1	118.8820	0.000	1	118.8820	0.000	1	118.5237	1.195	40	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:2:3:	3:	C[6]-4:C[6]-3:H-1:	C[5a]-3:O[6]-2:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]C[6a]H)(C[6]C[5a]O[6])(H)	C[6](C[5a]C[5a]S[5a])(O[6]C[6,6a])(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C[6a]H)(C[6]C[5a]O[6])(H){1|S<2>,5|C<3>}	C[6](C[5a]C[5a]S[5a])(O[6]C[6,6a])(C[6]C[6]H){2|H<1>,5|C<3>}	H(C[6]C[6]2)	117.8970	0.000	1	117.8970	0.000	1	117.8970	0.000	1	118.5237	1.195	40	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:2:3:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:O[6]-2:C-3:	C[6]-3:	C[6](C[6]C[6,6]C[3]H)(C[6]O[6]C)(H)	C[6](C[6]C[6]H)(O[6]C[6])(COO)	H(C[6]C[6]2)	C[6](C[6]C[6,6]C[3]H)(C[6]O[6]C)(H){1|C<3>,1|H<1>,4|C<4>}	C[6](C[6]C[6]H)(O[6]C[6])(COO){1|O<2>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.1795	0.442	2	118.1795	0.195	2	118.9647	0.419	25	118.5237	1.195	40	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:2:3:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:O[6]-2:C-3:	C[6]-3:	C[6](C[6]C[6,6]C[6a]H)(C[6]O[6]C)(H)	C[6](C[6]C[6]H)(O[6]C[6])(COO)	H(C[6]C[6]2)	C[6](C[6]C[6,6]C[6a]H)(C[6]O[6]C)(H){1|C<4>,4|C<3>}	C[6](C[6]C[6]H)(O[6]C[6])(COO){1|C<3>,1|C<4>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	119.3820	0.000	1	119.3820	0.000	1	118.9647	0.419	25	118.5237	1.195	40	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:2:3:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:O[6]-2:C-3:	C[6]-3:	C[6](C[6]C[6]2H)(C[6]O[6]C)(H)	C[6](C[6]C[6]H)(O[6]C[6])(CHO)	H(C[6]C[6]2)	C[6](C[6]C[6]2H)(C[6]O[6]C)(H){1|O<2>,2|C<4>,3|H<1>}	C[6](C[6]C[6]H)(O[6]C[6])(CHO){1|O<2>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.6120	0.000	1	119.6120	0.000	1	118.9647	0.419	25	118.5237	1.195	40	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:2:3:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:O[6]-2:C-3:	C[6]-3:	C[6](C[6]C[6]CH)(C[6]O[6]C)(H)	C[6](C[6]C[6]H)(O[6]C[6])(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]CH)(C[6]O[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(O[6]C[6])(COO){1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.7770	0.000	1	119.7770	0.000	1	118.9647	0.419	25	118.5237	1.195	40	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:2:3:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:O[6]-2:C-3:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]O[6]C)(H)	C[6](C[6]C[6]H)(O[6]C[6])(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]O[6]C)(H){1|C<4>,1|H<1>,1|N<4>}	C[6](C[6]C[6]H)(O[6]C[6])(CCH){1|C<4>,1|O<2>,3|H<1>}	H(C[6]C[6]2)	118.6732	0.792	4	118.6732	0.627	4	118.9647	0.419	25	118.5237	1.195	40	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:2:3:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:O[6]-2:C-3:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]O[6]C)(H)	C[6](C[6]C[6]H)(O[6]C[6])(CCO)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]O[6]C)(H){1|C<4>,2|H<1>}	C[6](C[6]C[6]H)(O[6]C[6])(CCO){1|C<4>,4|H<1>}	H(C[6]C[6]2)	118.9790	0.000	1	118.9790	0.000	1	118.9647	0.419	25	118.5237	1.195	40	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:2:3:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:O[6]-2:C-3:	C[6]-3:	C[6](C[6]C[6a]C[6]H)(C[6]O[6]C)(H)	C[6](C[6]C[6]H)(O[6]C[6])(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]H)(C[6]O[6]C)(H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]C[6]H)(O[6]C[6])(CNO){1|H<1>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	118.6710	0.000	1	118.6710	0.000	1	118.9647	0.419	25	118.5237	1.195	40	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:2:3:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:O[6]-2:C-3:	C[6]-3:	C[6](C[6]C[6a]C[6]H)(C[6]O[6]C)(H)	C[6](C[6]C[6]H)(O[6]C[6])(COO)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]H)(C[6]O[6]C)(H){1|C<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)(O[6]C[6])(COO){1|C<3>,1|C<4>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	119.0300	0.000	1	119.0661	0.409	13	118.9647	0.419	25	118.5237	1.195	40	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:2:3:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:O[6]-2:C-3:	C[6]-3:	C[6](C[6]C[6a]C[6]H)(C[6]O[6]C)(H)	C[6](C[6]C[6]H)(O[6]C[6])(COO)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]H)(C[6]O[6]C)(H){1|C<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)(O[6]C[6])(COO){1|C<4>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	118.0030	0.000	1	119.0661	0.409	13	118.9647	0.419	25	118.5237	1.195	40	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:2:3:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:O[6]-2:C-3:	C[6]-3:	C[6](C[6]C[6a]C[6]H)(C[6]O[6]C)(H)	C[6](C[6]C[6]H)(O[6]C[6])(COO)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]H)(C[6]O[6]C)(H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]C[6]H)(O[6]C[6])(COO){1|C<4>,1|H<1>,1|O<2>,2|C<3>}	H(C[6]C[6]2)	118.6210	0.000	1	119.0661	0.409	13	118.9647	0.419	25	118.5237	1.195	40	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:2:3:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:O[6]-2:C-3:	C[6]-3:	C[6](C[6]C[6a]C[6]H)(C[6]O[6]C)(H)	C[6](C[6]C[6]H)(O[6]C[6])(COO)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]H)(C[6]O[6]C)(H){1|C<4>,3|C<3>}	C[6](C[6]C[6]H)(O[6]C[6])(COO){1|O<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	118.2860	0.000	1	119.0661	0.409	13	118.9647	0.419	25	118.5237	1.195	40	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:2:3:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:O[6]-2:C-3:	C[6]-3:	C[6](C[6]C[6a]C[6]H)(C[6]O[6]C)(H)	C[6](C[6]C[6]H)(O[6]C[6])(COO)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]H)(C[6]O[6]C)(H){1|C<4>,4|C<3>}	C[6](C[6]C[6]H)(O[6]C[6])(COO){1|C<3>,1|C<4>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	119.5740	0.530	2	119.0661	0.409	13	118.9647	0.419	25	118.5237	1.195	40	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:2:3:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:O[6]-2:C-3:	C[6]-3:	C[6](C[6]C[6a]C[6]H)(C[6]O[6]C)(H)	C[6](C[6]C[6]H)(O[6]C[6])(COO)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]H)(C[6]O[6]C)(H){1|H<1>,2|C<3>,2|C<4>}	C[6](C[6]C[6]H)(O[6]C[6])(COO){1|C<3>,1|C<4>,1|O<2>,2|H<1>}	H(C[6]C[6]2)	118.4420	0.000	1	119.0661	0.409	13	118.9647	0.419	25	118.5237	1.195	40	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:2:3:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:O[6]-2:C-3:	C[6]-3:	C[6](C[6]C[6a]C[6]H)(C[6]O[6]C)(H)	C[6](C[6]C[6]H)(O[6]C[6])(COO)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]H)(C[6]O[6]C)(H){1|H<1>,4|C<3>}	C[6](C[6]C[6]H)(O[6]C[6])(COO){1|C<3>,1|C<4>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	119.4573	0.418	3	119.0661	0.409	13	118.9647	0.419	25	118.5237	1.195	40	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:2:3:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:O[6]-2:C-3:	C[6]-3:	C[6](C[6]C[6a]C[6]H)(C[6]O[6]C)(H)	C[6](C[6]C[6]H)(O[6]C[6])(COO)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]H)(C[6]O[6]C)(H){2|C<4>,3|C<3>}	C[6](C[6]C[6]H)(O[6]C[6])(COO){1|C<3>,1|C<4>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	119.2980	0.000	1	119.0661	0.409	13	118.9647	0.419	25	118.5237	1.195	40	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:2:3:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:O[6]-2:C-3:	C[6]-3:	C[6](C[6]C[6a]C[6]H)(C[6]O[6]C)(H)	C[6](C[6]C[6]H)(O[6]C[6])(COO)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]H)(C[6]O[6]C)(H){2|H<1>,3|C<3>}	C[6](C[6]C[6]H)(O[6]C[6])(COO){1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.9540	0.000	1	119.0661	0.409	13	118.9647	0.419	25	118.5237	1.195	40	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:2:3:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:O[6]-2:C-3:	C[6]-3:	C[6](C[6]C[6a]C[6]H)(C[6]O[6]C)(H)	C[6](C[6]C[6]H)(O[6]C[6])(COO)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]H)(C[6]O[6]C)(H){4|C<3>}	C[6](C[6]C[6]H)(O[6]C[6])(COO){1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	118.7050	0.000	1	119.0661	0.409	13	118.9647	0.419	25	118.5237	1.195	40	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:2:3:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:O[6]-2:C-3:	C[6]-3:	C[6](C[6]C[6a]C[6]H)(C[6]O[6]C)(H)	C[6](C[6]C[6]H)(O[6]C[6])(COS)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]H)(C[6]O[6]C)(H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]C[6]H)(O[6]C[6])(COS){1|C<4>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	118.7850	0.000	1	118.7850	0.000	1	118.9647	0.419	25	118.5237	1.195	40	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:2:3:	3:	C[6]-4:C[6]-3:H-1:	C[6a]-3:N[6]-2:C[6]-3:	C[6]-3:	C[6](C[6]C[5,6]C[6a]H)(C[6]C[6a]N[6])(H)	C[6](C[6a]C[6a]2)(N[6]C[5,6])(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C[6a]H)(C[6]C[6a]N[6])(H){1|N<2>,6|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[5,6])(C[6]C[6]H){1|C<4>,1|O<2>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	121.0890	0.000	1	121.0890	0.000	1	121.0890	0.000	1	118.5237	1.195	40	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:2:3:	3:	C[6]-4:C[6]-3:H-1:	C[6a]-3:O[6]-2:C[6]-3:	C[6]-3:	C[6](C[6]C[5a,6]CH)(C[6]C[6a]O[6])(H)	C[6](C[6a]C[6a]2)(O[6]C[5a,6])(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]CH)(C[6]C[6a]O[6])(H){4|C<3>}	C[6](C[6a]C[6a]2)(O[6]C[5a,6])(C[6]C[6]H){1|C<4>,1|N<3>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	115.5160	0.000	1	115.5160	0.000	1	117.1012	0.437	10	118.5237	1.195	40	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:2:3:	3:	C[6]-4:C[6]-3:H-1:	C[6a]-3:O[6]-2:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]CH)(C[6]C[6a]O[6])(H)	C[6](C[6a]C[6a]2)(O[6]C[6,6a])(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]CH)(C[6]C[6a]O[6])(H){4|C<3>}	C[6](C[6a]C[6a]2)(O[6]C[6,6a])(C[6]C[6]H){3|H<1>,5|C<3>}	H(C[6]C[6]2)	117.4560	0.000	1	117.4560	0.000	1	117.1012	0.437	10	118.5237	1.195	40	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:2:3:	3:	C[6]-4:C[6]-3:H-1:	C[6a]-3:O[6]-2:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]C[6a]C)(C[6]C[6a]O[6])(H)	C[6](C[6a]C[6a]2)(O[6]C[6,6a])(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C[6a]C)(C[6]C[6a]O[6])(H){6|C<3>}	C[6](C[6a]C[6a]2)(O[6]C[6,6a])(C[6]C[6]H){1|C<4>,1|H<1>,1|O<2>,5|C<3>}	H(C[6]C[6]2)	116.9150	0.000	1	116.9023	0.004	3	117.1012	0.437	10	118.5237	1.195	40	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:2:3:	3:	C[6]-4:C[6]-3:H-1:	C[6a]-3:O[6]-2:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]C[6a]C)(C[6]C[6a]O[6])(H)	C[6](C[6a]C[6a]2)(O[6]C[6,6a])(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C[6a]C)(C[6]C[6a]O[6])(H){6|C<3>}	C[6](C[6a]C[6a]2)(O[6]C[6,6a])(C[6]C[6]H){1|C<4>,2|H<1>,5|C<3>}	H(C[6]C[6]2)	116.8960	0.091	2	116.9023	0.004	3	117.1012	0.437	10	118.5237	1.195	40	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:2:3:	3:	C[6]-4:C[6]-3:H-1:	C[6a]-3:O[6]-2:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]C[6a]H)(C[6]C[6a]O[6])(H)	C[6](C[6a]C[6a]2)(O[6]C[6,6a])(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C[6a]H)(C[6]C[6a]O[6])(H){6|C<3>}	C[6](C[6a]C[6a]2)(O[6]C[6,6a])(C[6]C[6]H){1|N<2>,3|H<1>,4|C<3>}	H(C[6]C[6]2)	117.1215	0.037	2	117.4666	0.125	5	117.1012	0.437	10	118.5237	1.195	40	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:2:3:	3:	C[6]-4:C[6]-3:H-1:	C[6a]-3:O[6]-2:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]C[6a]H)(C[6]C[6a]O[6])(H)	C[6](C[6a]C[6a]2)(O[6]C[6,6a])(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C[6a]H)(C[6]C[6a]O[6])(H){6|C<3>}	C[6](C[6a]C[6a]2)(O[6]C[6,6a])(C[6]C[6]H){3|H<1>,5|C<3>}	H(C[6]C[6]2)	117.6967	0.225	3	117.4666	0.125	5	117.1012	0.437	10	118.5237	1.195	40	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:2:4:	3:	C[3,6]-4:C[6]-3:H-1:	C[6]-3:O[6]-2:C-4:	C[6]-3:	C[6](C[3,6]C[3,6]C[6a]C[3])(C[6]O[6]C)(H)	C[6](C[6]C[3,6]H)(O[6]C[6])(CCCH)	H(C[6]C[3,6]C[6])	C[6](C[3,6]C[3,6]C[6a]C[3])(C[6]O[6]C)(H){1|C<4>,2|H<1>,3|C<3>}	C[6](C[6]C[3,6]H)(O[6]C[6])(CCCH){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[3,6]C[6])	118.8900	0.000	1	118.8900	0.000	1	118.8900	0.000	1	118.8350	2.013	23	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:2:4:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:O[6]-2:C-4:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]H)(C[6]O[6]C)(H)	C[6](C[6]C[5,6]H)(O[6]C[6])(CH3)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]H)(C[6]O[6]C)(H){1|C<3>,2|C<4>,3|H<1>}	C[6](C[6]C[5,6]H)(O[6]C[6])(CH3){1|H<1>,1|O<1>,2|C<4>}	H(C[6]C[5,6]C[6])	118.3590	0.156	2	118.3590	0.024	2	118.4753	0.053	3	118.8350	2.013	23	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:2:4:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:O[6]-2:C-4:	C[6]-3:	C[6](C[5,6]C[5,6a]C[5,6]H)(C[6]O[6]C)(H)	C[6](C[6]C[5,6]H)(O[6]C[6])(CH3)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6a]C[5,6]H)(C[6]O[6]C)(H){1|C<4>,1|H<1>,3|C<3>}	C[6](C[6]C[5,6]H)(O[6]C[6])(CH3){1|C<3>,1|C<4>,1|H<1>,1|O<1>}	H(C[6]C[5,6]C[6])	118.7080	0.000	1	118.7080	0.000	1	118.4753	0.053	3	118.8350	2.013	23	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:2:4:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:O[6]-2:C-4:	C[6]-3:	C[6](C[6,6]C[6,6]2O)(C[6]O[6]C)(H)	C[6](C[6]C[6,6]H)(O[6]C[6,6])(CH3)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2O)(C[6]O[6]C)(H){1|C<3>,1|O<1>,1|O<2>,2|C<4>}	C[6](C[6]C[6,6]H)(O[6]C[6,6])(CH3){1|C<3>,1|H<1>,1|O<2>,2|C<4>}	H(C[6]C[6,6]C[6])	118.7820	0.000	1	118.7820	0.000	1	118.7820	0.000	1	118.8350	2.013	23	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:2:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:O[6]-2:C-4:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]O[6]C)(H)	C[6](C[6]C[6]H)(O[6]C[6])(CCCH)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]O[6]C)(H){1|C<3>,1|C<4>}	C[6](C[6]C[6]H)(O[6]C[6])(CCCH){1|C<3>,1|N<3>,3|H<1>}	H(C[6]C[6]2)	118.2920	0.000	1	118.2920	0.000	1	119.3361	1.397	15	118.8350	2.013	23	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:2:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:O[6]-2:C-4:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]O[6]C)(H)	C[6](C[6]C[6]H)(O[6]C[6])(CC[5]CH)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]O[6]C)(H){1|H<1>,2|C<4>}	C[6](C[6]C[6]H)(O[6]C[6])(CC[5]CH){1|C<4>,4|H<1>}	H(C[6]C[6]2)	119.0920	0.000	1	119.0920	0.000	1	119.3361	1.397	15	118.8350	2.013	23	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:2:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:O[6]-2:C-4:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]O[6]C)(H)	C[6](C[6]C[6]H)(O[6]C[6])(CF3)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]O[6]C)(H){1|C<4>,2|H<1>}	C[6](C[6]C[6]H)(O[6]C[6])(CF3){2|C<4>,3|H<1>}	H(C[6]C[6]2)	118.8050	0.000	1	118.8050	0.000	1	119.3361	1.397	15	118.8350	2.013	23	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:2:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:O[6]-2:C-4:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]O[6]C)(H)	C[6](C[6]C[6]H)(O[6]C[6])(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]O[6]C)(H){1|C<3>,2|C<4>}	C[6](C[6]C[6]H)(O[6]C[6])(CH3){1|C<4>,1|O<1>,2|H<1>}	H(C[6]C[6]2)	118.8460	0.000	1	118.7870	0.007	2	119.3361	1.397	15	118.8350	2.013	23	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:2:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:O[6]-2:C-4:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]O[6]C)(H)	C[6](C[6]C[6]H)(O[6]C[6])(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]O[6]C)(H){1|H<1>,2|C<4>}	C[6](C[6]C[6]H)(O[6]C[6])(CH3){1|C<3>,1|C<4>,1|O<2>,2|H<1>}	H(C[6]C[6]2)	118.7280	0.000	1	118.7870	0.007	2	119.3361	1.397	15	118.8350	2.013	23	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:2:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:O[6]-2:C-4:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]O[6]C)(H)	C[6](C[6]C[6]H)(O[6]Ge[6])(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]O[6]C)(H){1|Ge<4>,1|P<2>}	C[6](C[6]C[6]H)(O[6]Ge[6])(CH3){1|C<4>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	116.2700	0.000	1	116.2700	0.000	1	119.3361	1.397	15	118.8350	2.013	23	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:2:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:O[6]-2:C-4:	C[6]-3:	C[6](C[6]C[6a]C[6]H)(C[6]O[6]C)(H)	C[6](C[6]C[6]H)(O[6]C[6])(CF3)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]H)(C[6]O[6]C)(H){1|C<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)(O[6]C[6])(CF3){1|C<3>,1|C<4>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	119.6570	0.000	1	120.0010	0.516	9	119.3361	1.397	15	118.8350	2.013	23	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:2:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:O[6]-2:C-4:	C[6]-3:	C[6](C[6]C[6a]C[6]H)(C[6]O[6]C)(H)	C[6](C[6]C[6]H)(O[6]C[6])(CF3)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]H)(C[6]O[6]C)(H){1|C<4>,1|S<2>,3|C<3>}	C[6](C[6]C[6]H)(O[6]C[6])(CF3){1|C<3>,1|C<4>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	119.7995	0.023	2	120.0010	0.516	9	119.3361	1.397	15	118.8350	2.013	23	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:2:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:O[6]-2:C-4:	C[6]-3:	C[6](C[6]C[6a]C[6]H)(C[6]O[6]C)(H)	C[6](C[6]C[6]H)(O[6]C[6])(CF3)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]H)(C[6]O[6]C)(H){1|H<1>,4|C<3>}	C[6](C[6]C[6]H)(O[6]C[6])(CF3){1|C<3>,1|C<4>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	120.1255	0.876	6	120.0010	0.516	9	119.3361	1.397	15	118.8350	2.013	23	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:2:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:O[6]-2:P-4:	C[6]-3:	C[6](C[6]C[6a]C[6]H)(C[6]O[6]P)(H)	C[6](C[6]C[6]H)(O[6]C[6])(PO3)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]H)(C[6]O[6]P)(H){1|C<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)(O[6]C[6])(PO3){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.7660	0.000	1	118.7660	0.000	1	118.7660	0.000	1	118.8350	2.013	23	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:2:4:	3:	S[6]-4:C[6]-3:H-1:	C[6]-3:S[6]-2:Si-4:	C[6]-3:	C[6](S[6]C[6]OO)(C[6]S[6]Si)(H)	C[6](C[6]S[6]H)(S[6]C[6])(SiC3)	H(C[6]C[6]S[6])	C[6](S[6]C[6]OO)(C[6]S[6]Si)(H){1|C<3>,1|H<1>}	C[6](C[6]S[6]H)(S[6]C[6])(SiC3){1|C<3>,1|H<1>,2|O<1>}	H(C[6]C[6]S[6])	115.6500	0.406	2	115.6500	0.165	2	115.6500	0.165	2	118.8350	2.013	23	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	B[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](B[6]C[6]PtP)(C[6]C[6]H)(H)	C[6](C[6]B[6]H)(C[6]C[6]H)(H)	H(C[6]B[6]C[6])	C[6](B[6]C[6]PtP)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]B[6]H)(C[6]C[6]H)(H){1|Pt<6>,1|C<3>,1|H<1>,1|P<4>}	H(C[6]B[6]C[6])	120.2890	0.000	1	120.3850	0.038	4	120.3850	0.038	4	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	B[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](B[6]C[6]PtP)(C[6]C[6]H)(H)	C[6](C[6]B[6]H)(C[6]C[6]H)(H)	H(C[6]B[6]C[6])	C[6](B[6]C[6]PtP)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]B[6]H)(C[6]C[6]H)(H){1|Pt<6>,1|C<4>,1|H<1>,1|P<4>}	H(C[6]B[6]C[6])	120.4170	0.224	3	120.3850	0.038	4	120.3850	0.038	4	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[3,5,6,6]-4:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[3,5,6,6]C[3,5,6,6]C[3,6,6]C[5,6])(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,6]C[5])(C[6]C[3,5,6,6]H)(H)	H(C[6]C[3,5,6,6]C[6])	C[6](C[3,5,6,6]C[3,5,6,6]C[3,6,6]C[5,6])(C[6]C[5,6]H)(H){1|C<2>,2|C<3>,2|H<1>,3|C<4>}	C[6](C[5,6]C[5,6]C[5])(C[6]C[3,5,6,6]H)(H){1|O<2>,2|H<1>,4|C<4>}	H(C[6]C[3,5,6,6]C[6])	122.9685	0.630	2	122.9685	0.397	2	122.9685	0.397	2	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[3,5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[3,5,6]C[3,5,6]C[3]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[3,5,6]H)(C[6]C[6]H)(H)	H(C[6]C[3,5,6]C[6])	C[6](C[3,5,6]C[3,5,6]C[3]C[5])(C[6]C[6]H)(H){1|F<1>,2|C<3>,2|C<4>,3|H<1>}	C[6](C[6]C[3,5,6]H)(C[6]C[6]H)(H){1|H<1>,3|C<4>}	H(C[6]C[3,5,6]C[6])	119.3260	0.127	2	119.3260	0.016	2	119.3260	0.016	2	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[3,6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[3,6,6]C[3,6,6]C[6,6]C[3])(C[6]C[6]H)(H)	C[6](C[6]C[3,6,6]H)(C[6]C[6]O)(H)	H(C[6]C[3,6,6]C[6])	C[6](C[3,6,6]C[3,6,6]C[6,6]C[3])(C[6]C[6]H)(H){1|O<1>,3|H<1>,4|C<4>}	C[6](C[6]C[3,6,6]H)(C[6]C[6]O)(H){1|H<1>,4|C<4>}	H(C[6]C[3,6,6]C[6])	118.7330	0.000	1	118.7330	0.000	1	119.2345	5.366	4	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[3,6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[3,6,6]C[3,6]2C[6])(C[6]C[6]H)(H)	C[6](C[6]C[3,6,6]H)(C[6]C[6]O)(H)	H(C[6]C[3,6,6]C[6])	C[6](C[3,6,6]C[3,6]2C[6])(C[6]C[6]H)(H){1|C<3>,1|O<1>,3|C<4>,3|H<1>}	C[6](C[6]C[3,6,6]H)(C[6]C[6]O)(H){2|H<1>,3|C<4>}	H(C[6]C[3,6,6]C[6])	117.7925	0.474	2	117.7925	0.225	2	119.2345	5.366	4	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[3,6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[3,6,6]C[6,6]N[3,6]C[3])(C[6]C[6]H)(H)	C[6](C[6]C[3,6,6]H)(C[6]C[6]C)(H)	H(C[6]C[3,6,6]C[6])	C[6](C[3,6,6]C[6,6]N[3,6]C[3])(C[6]C[6]H)(H){1|Si<4>,1|C<3>,2|H<1>,3|C<4>}	C[6](C[6]C[3,6,6]H)(C[6]C[6]C)(H){1|H<1>,1|N<3>,2|C<4>}	H(C[6]C[3,6,6]C[6])	122.6200	0.000	1	122.6200	0.000	1	119.2345	5.366	4	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[3,6]-4:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[3,6]C[3]2O[6])(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[3,6]H)(H)	H(C[6]C[3,6]C[6])	C[6](C[3,6]C[3]2O[6])(C[6]C[6,6]H)(H){3|C<3>,3|H<1>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[3,6]H)(H){1|O<1>,1|O<2>,4|C<4>}	H(C[6]C[3,6]C[6])	120.0820	0.000	1	120.0820	0.000	1	120.0820	0.000	1	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[3,6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[3,6]C[3,6]C[3]H)(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[3,6]H)(H)	H(C[6]C[3,6]C[6])	C[6](C[3,6]C[3,6]C[3]H)(C[6]C[6,6a]H)(H){1|C<4>,1|H<1>,3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[3,6]H)(H){2|C<3>,2|C<4>,2|H<1>}	H(C[6]C[3,6]C[6])	121.6790	0.000	1	120.4433	0.787	4	120.1523	0.680	6	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[3,6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[3,6]C[3,6]C[3]H)(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[3,6]H)(H)	H(C[6]C[3,6]C[6])	C[6](C[3,6]C[3,6]C[3]H)(C[6]C[6,6a]H)(H){2|H<1>,3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[3,6]H)(H){1|F<1>,1|H<1>,2|C<3>,2|C<4>}	H(C[6]C[3,6]C[6])	120.0860	0.553	2	120.4433	0.787	4	120.1523	0.680	6	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[3,6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[3,6]C[3,6]C[3]H)(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[3,6]H)(H)	H(C[6]C[3,6]C[6])	C[6](C[3,6]C[3,6]C[3]H)(C[6]C[6,6a]H)(H){2|H<1>,3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[3,6]H)(H){1|H<1>,1|O<2>,2|C<3>,2|C<4>}	H(C[6]C[3,6]C[6])	119.9220	0.000	1	120.4433	0.787	4	120.1523	0.680	6	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[3,6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[3,6]C[3,6]C[3]N)(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]N[6a])(C[6]C[3,6]H)(H)	H(C[6]C[3,6]C[6])	C[6](C[3,6]C[3,6]C[3]N)(C[6]C[6,6a]H)(H){1|N<2>,2|C<3>,2|H<1>}	C[6](C[6,6a]C[6,6a]N[6a])(C[6]C[3,6]H)(H){1|N<3>,2|C<3>,2|C<4>}	H(C[6]C[3,6]C[6])	119.5705	0.151	2	119.5705	0.023	2	120.1523	0.680	6	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[3,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[3,6]C[3,6,6]C[3,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[3,6]H)(C[6]C[6]O)(H)	H(C[6]C[3,6]C[6])	C[6](C[3,6]C[3,6,6]C[3,6]H)(C[6]C[6]H)(H){1|O<1>,4|C<4>}	C[6](C[6]C[3,6]H)(C[6]C[6]O)(H){2|C<4>,3|H<1>}	H(C[6]C[3,6]C[6])	118.6740	0.000	1	118.6740	0.000	1	118.7627	0.285	11	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[3,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[3,6]C[3,6]C[3]H)(C[6]C[6]H)(H)	C[6](C[6]C[3,6]H)(C[6]C[6]H)(H)	H(C[6]C[3,6]C[6])	C[6](C[3,6]C[3,6]C[3]H)(C[6]C[6]H)(H){1|C<2>,2|C<3>,2|H<1>}	C[6](C[6]C[3,6]H)(C[6]C[6]H)(H){2|C<4>,2|H<1>}	H(C[6]C[3,6]C[6])	118.9950	0.000	1	119.2493	0.031	4	118.7627	0.285	11	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[3,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[3,6]C[3,6]C[3]H)(C[6]C[6]H)(H)	C[6](C[6]C[3,6]H)(C[6]C[6]H)(H)	H(C[6]C[3,6]C[6])	C[6](C[3,6]C[3,6]C[3]H)(C[6]C[6]H)(H){1|C<3>,1|P<4>,3|H<1>}	C[6](C[6]C[3,6]H)(C[6]C[6]H)(H){2|C<4>,2|H<1>}	H(C[6]C[3,6]C[6])	119.3320	0.081	2	119.2493	0.031	4	118.7627	0.285	11	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[3,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[3,6]C[3,6]C[3]H)(C[6]C[6]H)(H)	C[6](C[6]C[3,6]H)(C[6]C[6]H)(H)	H(C[6]C[3,6]C[6])	C[6](C[3,6]C[3,6]C[3]H)(C[6]C[6]H)(H){2|C<3>,3|H<1>}	C[6](C[6]C[3,6]H)(C[6]C[6]H)(H){1|H<1>,3|C<4>}	H(C[6]C[3,6]C[6])	119.3380	0.000	1	119.2493	0.031	4	118.7627	0.285	11	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[3,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[3,6]C[3]C[6]O[3])(C[6]C[6]H)(H)	C[6](C[6]C[3,6]H)(C[6]C[6]O)(H)	H(C[6]C[3,6]C[6])	C[6](C[3,6]C[3]C[6]O[3])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>,2|C<4>}	C[6](C[6]C[3,6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[3,6]C[6])	118.8740	0.000	1	118.8740	0.000	1	118.7627	0.285	11	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[3,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[3,6]C[5,6,6]C[3]O[3])(C[6]C[6]H)(H)	C[6](C[6]C[5,6,6]O)(C[6]C[3,6]H)(H)	H(C[6]C[3,6]C[6])	C[6](C[3,6]C[5,6,6]C[3]O[3])(C[6]C[6]H)(H){1|O<1>,2|C<4>,3|H<1>}	C[6](C[6]C[5,6,6]O)(C[6]C[3,6]H)(H){1|H<1>,1|O<2>,3|C<4>}	H(C[6]C[3,6]C[6])	118.0610	0.000	1	118.0610	0.000	1	118.7627	0.285	11	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[3,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[3,6]C[6,6a]C[3]2)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]O)(C[6]C[3,6]H)(H)	H(C[6]C[3,6]C[6])	C[6](C[3,6]C[6,6a]C[3]2)(C[6]C[6]H)(H){1|O<1>,2|H<1>,4|C<3>}	C[6](C[6]C[6,6a]O)(C[6]C[3,6]H)(H){2|C<3>,2|C<4>}	H(C[6]C[3,6]C[6])	118.0645	0.152	2	118.0645	0.023	2	118.7627	0.285	11	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[3,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[3,6]Nb[3,4]C[3]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[3,6]H)(C[6]C[6]H)(H)	H(C[6]C[3,6]C[6])	C[6](C[3,6]Nb[3,4]C[3]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<2>,2|N<3>,4|H<1>}	C[6](C[6]C[3,6]H)(C[6]C[6]H)(H){1|Nb<6>,1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[3,6]C[6])	118.8275	0.541	2	118.8275	0.293	2	118.7627	0.285	11	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[3,6]-4:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[3,6]C[3,6]C[3]C)(C[6]N[6]H)(H)	C[6](C[6]C[3,6]H)(N[6]C[6]S)(H)	H(C[6]C[3,6]C[6])	C[6](C[3,6]C[3,6]C[3]C)(C[6]N[6]H)(H){1|S<4>,2|C<4>,2|H<1>}	C[6](C[6]C[3,6]H)(N[6]C[6]S)(H){2|H<1>,3|C<4>}	H(C[6]C[3,6]C[6])	120.6905	3.350	2	120.6905	11.220	2	119.4324	4.141	5	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[3,6]-4:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[3,6]C[3,6]C[3]H)(C[6]N[6]H)(H)	C[6](C[6]C[3,6]H)(N[6]C[6]S)(H)	H(C[6]C[3,6]C[6])	C[6](C[3,6]C[3,6]C[3]H)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|S<4>,2|H<1>}	C[6](C[6]C[3,6]H)(N[6]C[6]S)(H){2|C<4>,3|H<1>}	H(C[6]C[3,6]C[6])	118.6975	0.066	2	118.6975	0.004	2	119.4324	4.141	5	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[3,6]-4:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[3,6]C[3,6]C[6a]C[3])(C[6]N[6]H)(H)	C[6](C[6]C[3,6]H)(N[6]C[6]S)(H)	H(C[6]C[3,6]C[6])	C[6](C[3,6]C[3,6]C[6a]C[3])(C[6]N[6]H)(H){1|C<4>,1|S<4>,2|C<3>,3|H<1>}	C[6](C[6]C[3,6]H)(N[6]C[6]S)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[3,6]C[6])	118.3860	0.000	1	118.3860	0.000	1	119.4324	4.141	5	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[3x6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[3x6]C[3x6]O[6]2)(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[3x6]H)(H)	H(C[6]C[3x6]C[6])	C[6](C[3x6]C[3x6]O[6]2)(C[6]C[6,6a]H)(H){1|C<4>,1|O<2>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[3x6]H)(H){1|C<4>,1|H<1>,2|C<3>,2|O<2>}	H(C[6]C[3x6]C[6])	119.5980	0.000	1	119.5980	0.000	1	119.5980	0.000	1	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[3x6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[3x6]C[4x6]O[6]2)(C[6]C[6]Cl)(H)	C[6](C[6]C[3x6]H)(C[6]C[3x6]O)(Cl)	H(C[6]C[3x6]C[6])	C[6](C[3x6]C[4x6]O[6]2)(C[6]C[6]Cl)(H){1|Cl<1>,1|O<1>,4|C<4>}	C[6](C[6]C[3x6]H)(C[6]C[3x6]O)(Cl){1|H<1>,2|C<4>,2|O<2>}	H(C[6]C[3x6]C[6])	120.0320	0.000	1	120.0320	0.000	1	120.0320	0.000	1	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[3x6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[3x6]C[3x6]2H)(C[6]C[6]H)(H)	C[6](C[6]C[3x6]H)(C[6]C[6]O)(H)	H(C[6]C[3x6]C[6])	C[6](C[3x6]C[3x6]2H)(C[6]C[6]H)(H){1|O<1>,2|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[3x6]H)(C[6]C[6]O)(H){1|F<1>,1|H<1>,3|C<4>}	H(C[6]C[3x6]C[6])	117.9890	0.000	1	117.6860	0.184	2	118.2647	0.544	9	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[3x6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[3x6]C[3x6]2H)(C[6]C[6]H)(H)	C[6](C[6]C[3x6]H)(C[6]C[6]O)(H)	H(C[6]C[3x6]C[6])	C[6](C[3x6]C[3x6]2H)(C[6]C[6]H)(H){1|O<1>,2|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[3x6]H)(C[6]C[6]O)(H){1|H<1>,1|O<2>,3|C<4>}	H(C[6]C[3x6]C[6])	117.3830	0.000	1	117.6860	0.184	2	118.2647	0.544	9	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[3x6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[3x6]C[3x6]C[6,6]O)(C[6]C[6]H)(H)	C[6](C[6]C[3x6]H)(C[6]C[6]O)(H)	H(C[6]C[3x6]C[6])	C[6](C[3x6]C[3x6]C[6,6]O)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>,2|C<4>,2|O<2>}	C[6](C[6]C[3x6]H)(C[6]C[6]O)(H){1|O<2>,2|C<4>,2|H<1>}	H(C[6]C[3x6]C[6])	118.7375	0.267	2	118.7375	0.071	2	118.2647	0.544	9	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[3x6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[3x6]C[3x6]C[6]O[6])(C[6]C[6]H)(H)	C[6](C[6]C[3x6]H)(C[6]C[6,6]O)(H)	H(C[6]C[3x6]C[6])	C[6](C[3x6]C[3x6]C[6]O[6])(C[6]C[6]H)(H){1|H<1>,1|O<1>,1|O<2>,5|C<4>}	C[6](C[6]C[3x6]H)(C[6]C[6,6]O)(H){1|H<1>,1|O<2>,3|C<4>}	H(C[6]C[3x6]C[6])	118.4970	0.000	1	118.4970	0.000	1	118.2647	0.544	9	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[3x6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[3x6]C[5,3x6]Ge[3x6]H)(C[6]C[6]H)(H)	C[6](C[6]C[3x6]H)(C[6]C[5,6]C)(H)	H(C[6]C[3x6]C[6])	C[6](C[3x6]C[5,3x6]Ge[3x6]H)(C[6]C[6]H)(H){1|Ge<4>,2|C<4>,4|C<3>}	C[6](C[6]C[3x6]H)(C[6]C[5,6]C)(H){1|Ge<4>,1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[3x6]C[6])	117.8610	0.000	1	117.8610	0.000	1	118.2647	0.544	9	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[3x6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[3x6]C[6,6,6a]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[3x6]H)(C[6]C[6]O)(H)	H(C[6]C[3x6]C[6])	C[6](C[3x6]C[6,6,6a]C[6,6]C[6])(C[6]C[6]H)(H){1|O<1>,2|C<3>,3|C<4>,3|H<1>}	C[6](C[6]C[3x6]H)(C[6]C[6]O)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[3x6]C[6])	119.7070	0.000	1	118.8455	1.484	2	118.2647	0.544	9	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[3x6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[3x6]C[6,6,6a]C[6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[3x6]H)(C[6]C[6]O)(H)	H(C[6]C[3x6]C[6])	C[6](C[3x6]C[6,6,6a]C[6,6]C[6])(C[6]C[6]H)(H){1|O<1>,2|C<4>,3|C<3>,3|H<1>}	C[6](C[6]C[3x6]H)(C[6]C[6]O)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[3x6]C[6])	117.9840	0.000	1	118.8455	1.484	2	118.2647	0.544	9	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[3x6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[3x6]C[6,6a]C[6,6]N[6,6])(C[6]C[6]H)(H)	C[6](C[6]C[3x6]H)(C[6]C[6]O)(H)	H(C[6]C[3x6]C[6])	C[6](C[3x6]C[6,6a]C[6,6]N[6,6])(C[6]C[6]H)(H){1|H<1>,1|O<1>,1|O<2>,2|C<4>,3|C<3>}	C[6](C[6]C[3x6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|N<3>,2|H<1>}	H(C[6]C[3x6]C[6])	117.4860	0.000	1	117.4860	0.000	1	118.2647	0.544	9	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[4,4,3x6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[4,4,3x6]C[4,4,3x6]C[3x4,6]2)(C[6]C[6]H)(H)	C[6](C[6]C[3,4,4,6]C)(C[6]C[4,4,3x6]H)(H)	H(C[6]C[4,4,3x6]C[6])	C[6](C[4,4,3x6]C[4,4,3x6]C[3x4,6]2)(C[6]C[6]H)(H){1|H<1>,1|H<2>,2|C<4>,3|C<3>}	C[6](C[6]C[3,4,4,6]C)(C[6]C[4,4,3x6]H)(H){1|C<3>,2|C<4>,2|H<3>}	H(C[6]C[4,4,3x6]C[6])	122.7410	0.000	1	122.7410	0.000	1	122.7410	0.000	1	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[4,4,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[4,4,6]C[3x4,6]C[3x4]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[4,4,6]H)(C[6]C[6]H)(H)	H(C[6]C[4,4,6]C[6])	C[6](C[4,4,6]C[3x4,6]C[3x4]C[6])(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|C<4>,2|H<1>,2|H<2>}	C[6](C[6]C[4,4,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[4,4,6]C[6])	119.5170	0.936	2	119.5170	0.876	2	119.5170	0.876	2	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[4,5,6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[4,5,6,6]C[4,5,6,6]2C[5,6])(C[6]C[6]H)(H)	C[6](C[6]C[4,5,6,6]H)(C[6]C[6]H)(H)	H(C[6]C[4,5,6,6]C[6])	C[6](C[4,5,6,6]C[4,5,6,6]2C[5,6])(C[6]C[6]H)(H){1|C<3>,1|O<1>,1|O<2>,2|H<1>,3|C<4>}	C[6](C[6]C[4,5,6,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[4,5,6,6]C[6])	119.5270	0.000	1	119.5270	0.000	1	120.2103	1.434	3	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[4,5,6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[4,5,6,6]C[4,5,6,6]2O[5,6])(C[6]C[6]H)(H)	C[6](C[6]C[4,5,6,6]H)(C[6]C[6]H)(H)	H(C[6]C[4,5,6,6]C[6])	C[6](C[4,5,6,6]C[4,5,6,6]2O[5,6])(C[6]C[6]H)(H){2|C<3>,2|H<1>,3|C<4>}	C[6](C[6]C[4,5,6,6]H)(C[6]C[6]H)(H){1|H<1>,1|O<2>,2|C<4>}	H(C[6]C[4,5,6,6]C[6])	119.5110	0.000	1	119.5110	0.000	1	120.2103	1.434	3	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[4,5,6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[4,5,6,6]C[5,5,6,6]C[4,5,6]C[4,6a])(C[6]C[6]H)(H)	C[6](C[6]C[4,5,6,6]H)(C[6]C[6]H)(H)	H(C[6]C[4,5,6,6]C[6])	C[6](C[4,5,6,6]C[5,5,6,6]C[4,5,6]C[4,6a])(C[6]C[6]H)(H){1|C<4>,1|O<2>,2|H<1>,4|C<3>}	C[6](C[6]C[4,5,6,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[4,5,6,6]C[6])	121.5930	0.000	1	121.5930	0.000	1	120.2103	1.434	3	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[4,5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[4,5,6]C[4,5,6]C[4]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[4,5,6]H)(C[6]C[6]H)(H)	H(C[6]C[4,5,6]C[6])	C[6](C[4,5,6]C[4,5,6]C[4]C[5])(C[6]C[6]H)(H){1|C<2>,2|C<3>,2|C<4>,3|H<1>}	C[6](C[6]C[4,5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[4,5,6]C[6])	119.6467	1.083	4	119.6467	1.173	4	119.6467	1.173	4	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[4,6]-4:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[4,6]C[4,5]C[4,6]H)(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,6]C[5])(C[6]C[4,6]H)(H)	H(C[6]C[4,6]C[6])	C[6](C[4,6]C[4,5]C[4,6]H)(C[6]C[5,6]H)(H){1|H<1>,1|O<2>,2|C<3>,2|C<4>}	C[6](C[5,6]C[5,6]C[5])(C[6]C[4,6]H)(H){1|H<1>,1|O<1>,4|C<4>}	H(C[6]C[4,6]C[6])	118.1910	0.000	1	118.1910	0.000	1	118.1910	0.000	1	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[4,6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[4,6]C[4,6,6]C[4]H)(C[6]C[6,6a]Br)(H)	C[6](C[6,6a]C[6,6,6a]C[6a])(C[6]C[4,6]H)(Br)	H(C[6]C[4,6]C[6])	C[6](C[4,6]C[4,6,6]C[4]H)(C[6]C[6,6a]Br)(H){1|H<1>,4|C<3>}	C[6](C[6,6a]C[6,6,6a]C[6a])(C[6]C[4,6]H)(Br){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[4,6]C[6])	118.7390	0.000	1	118.7390	0.000	1	118.7390	0.000	1	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[4,6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[4,6]C[4,5,6]C[4]C)(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[4,6]H)(H)	H(C[6]C[4,6]C[6])	C[6](C[4,6]C[4,5,6]C[4]C)(C[6]C[6,6a]H)(H){1|C<4>,1|O<2>,2|C<3>,2|H<1>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[4,6]H)(H){1|H<1>,2|C<4>,3|C<3>}	H(C[6]C[4,6]C[6])	118.1840	0.000	1	118.1840	0.000	1	118.7992	1.283	5	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[4,6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[4,6]C[4,6,6]C[4]H)(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6,6a]C[6a])(C[6]C[4,6]H)(H)	H(C[6]C[4,6]C[6])	C[6](C[4,6]C[4,6,6]C[4]H)(C[6]C[6,6a]H)(H){1|C<4>,4|C<3>}	C[6](C[6,6a]C[6,6,6a]C[6a])(C[6]C[4,6]H)(H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[4,6]C[6])	118.1740	0.000	1	118.1760	0.000	2	118.7992	1.283	5	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[4,6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[4,6]C[4,6,6]C[4]H)(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6,6a]C[6a])(C[6]C[4,6]H)(H)	H(C[6]C[4,6]C[6])	C[6](C[4,6]C[4,6,6]C[4]H)(C[6]C[6,6a]H)(H){1|H<1>,4|C<3>}	C[6](C[6,6a]C[6,6,6a]C[6a])(C[6]C[4,6]H)(H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[4,6]C[6])	118.1780	0.000	1	118.1760	0.000	2	118.7992	1.283	5	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[4,6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[4,6]C[4,6]C[4]O)(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[4,6]H)(H)	H(C[6]C[4,6]C[6])	C[6](C[4,6]C[4,6]C[4]O)(C[6]C[6,6a]H)(H){1|C<4>,1|H<1>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[4,6]H)(H){1|H<1>,1|O<2>,2|C<3>,2|C<4>}	H(C[6]C[4,6]C[6])	118.6710	0.000	1	118.6710	0.000	1	118.7992	1.283	5	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[4,6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[4,6]C[4,6]Si[4]H)(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[4,6]H)(H)	H(C[6]C[4,6]C[6])	C[6](C[4,6]C[4,6]Si[4]H)(C[6]C[6,6a]H)(H){1|Br<1>,1|Si<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[4,6]H)(H){1|Si<4>,1|C<4>,2|C<3>,2|H<1>}	H(C[6]C[4,6]C[6])	120.7890	0.000	1	120.7890	0.000	1	118.7992	1.283	5	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[4,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[4,6]C[3,4]C[6]O[4])(C[6]C[6]Cl)(H)	C[6](C[6]C[4,6]H)(C[6]C[6]O)(Cl)	H(C[6]C[4,6]C[6])	C[6](C[4,6]C[3,4]C[6]O[4])(C[6]C[6]Cl)(H){1|C<3>,1|H<1>,1|O<1>,3|C<4>}	C[6](C[6]C[4,6]H)(C[6]C[6]O)(Cl){1|Cl<1>,1|C<3>,1|C<4>,1|O<2>}	H(C[6]C[4,6]C[6])	119.0980	0.011	2	119.0980	0.000	2	119.0980	0.000	2	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[4,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[4,6]C[4,6]2C)(C[6]C[6]H)(H)	C[6](C[6]C[4,6]H)(C[6]N[6]O)(H)	H(C[6]C[4,6]C[6])	C[6](C[4,6]C[4,6]2C)(C[6]C[6]H)(H){1|C<4>,1|O<1>,2|H<1>,2|N<3>}	C[6](C[6]C[4,6]H)(C[6]N[6]O)(H){1|H<1>,3|C<4>}	H(C[6]C[4,6]C[6])	118.5450	0.000	1	118.5450	0.000	1	119.2603	0.873	9	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[4,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[4,6]C[4,6]2Cl)(C[6]C[6]H)(H)	C[6](C[6]C[4,6]H)(C[6]N[6]O)(H)	H(C[6]C[4,6]C[6])	C[6](C[4,6]C[4,6]2Cl)(C[6]C[6]H)(H){1|C<4>,1|O<1>,2|H<1>,2|N<3>}	C[6](C[6]C[4,6]H)(C[6]N[6]O)(H){1|Cl<1>,1|H<1>,2|C<4>}	H(C[6]C[4,6]C[6])	119.8625	0.313	2	119.8625	0.098	2	119.2603	0.873	9	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[4,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[4,6]C[4,6]C[4]H)(C[6]C[6]H)(H)	C[6](C[6]C[4,6]H)(C[6]N[6]O)(H)	H(C[6]C[4,6]C[6])	C[6](C[4,6]C[4,6]C[4]H)(C[6]C[6]H)(H){1|C<4>,1|N<3>,1|O<1>,1|S<4>,2|H<1>}	C[6](C[6]C[4,6]H)(C[6]N[6]O)(H){1|H<1>,3|C<4>}	H(C[6]C[4,6]C[6])	118.9940	0.000	1	118.9940	0.000	1	119.2603	0.873	9	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[4,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[4,6]C[4]C[6]N[4])(C[6]C[6]H)(H)	C[6](C[6]C[4,6]H)(C[6]C[6]O)(H)	H(C[6]C[4,6]C[6])	C[6](C[4,6]C[4]C[6]N[4])(C[6]C[6]H)(H){1|C<4>,1|O<1>,2|H<1>,3|C<3>}	C[6](C[6]C[4,6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[4,6]C[6])	118.2785	0.206	2	118.2785	0.042	2	119.2603	0.873	9	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[4,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[4,6]C[5,6,6]C[4]O[4])(C[6]C[6]H)(H)	C[6](C[6]C[5,6,6]O)(C[6]C[4,6]H)(H)	H(C[6]C[4,6]C[6])	C[6](C[4,6]C[5,6,6]C[4]O[4])(C[6]C[6]H)(H){1|O<1>,3|C<4>,3|H<1>}	C[6](C[6]C[5,6,6]O)(C[6]C[4,6]H)(H){1|H<1>,1|O<2>,3|C<4>}	H(C[6]C[4,6]C[6])	118.5300	0.000	1	118.5300	0.000	1	119.2603	0.873	9	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[4,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[4,6]C[5x3,4,5x5,20x6]C[4]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[4,6]H)(C[6]C[6]H)(H)	H(C[6]C[4,6]C[6])	C[6](C[4,6]C[5x3,4,5x5,20x6]C[4]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<5>,1|C<6>,4|B<6>,4|H<1>}	C[6](C[6]C[4,6]H)(C[6]C[6]H)(H){1|C<6>,1|H<1>,2|C<4>}	H(C[6]C[4,6]C[6])	120.6030	0.000	1	120.4960	0.023	2	119.2603	0.873	9	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[4,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[4,6]C[5x3,4,5x5,20x6]C[4]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[4,6]H)(C[6]C[6]H)(H)	H(C[6]C[4,6]C[6])	C[6](C[4,6]C[5x3,4,5x5,20x6]C[4]C[6])(C[6]C[6]H)(H){1|C<3>,2|C<6>,4|B<6>,4|H<1>}	C[6](C[6]C[4,6]H)(C[6]C[6]H)(H){1|C<6>,1|H<1>,2|C<4>}	H(C[6]C[4,6]C[6])	120.3890	0.000	1	120.4960	0.023	2	119.2603	0.873	9	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[4,6]-4:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[4,6]C[4,5,6]C[4]H)(C[6]N[6]H)(H)	C[6](C[6]C[4,6]H)(N[6]C[6]C)(H)	H(C[6]C[4,6]C[6])	C[6](C[4,6]C[4,5,6]C[4]H)(C[6]N[6]H)(H){1|C<2>,1|C<3>,4|C<4>}	C[6](C[6]C[4,6]H)(N[6]C[6]C)(H){1|H<1>,1|O<1>,2|C<4>}	H(C[6]C[4,6]C[6])	119.4440	0.000	1	119.4440	0.000	1	118.5157	0.652	3	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[4,6]-4:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[4,6]C[4]2C[6])(C[6]N[6]H)(H)	C[6](C[6]C[4,6]H)(N[6]C[6]S)(H)	H(C[6]C[4,6]C[6])	C[6](C[4,6]C[4]2C[6])(C[6]N[6]H)(H){1|N<3>,1|O<1>,1|S<4>,2|C<3>,2|H<1>}	C[6](C[6]C[4,6]H)(N[6]C[6]S)(H){1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[4,6]C[6])	118.0515	0.107	2	118.0515	0.011	2	118.5157	0.652	3	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[4x6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[4x6]C[5,3x6]C[6,6]2)(C[6]C[6]H)(H)	C[6](C[6]C[4x6]H)(C[6]C[5,6]C)(H)	H(C[6]C[4x6]C[6])	C[6](C[4x6]C[5,3x6]C[6,6]2)(C[6]C[6]H)(H){1|H<1>,1|O<1>,2|C<3>,2|O<2>,3|C<4>}	C[6](C[6]C[4x6]H)(C[6]C[5,6]C)(H){2|C<3>,2|C<4>}	H(C[6]C[4x6]C[6])	120.0560	0.000	1	119.9080	0.022	3	119.9080	0.022	3	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[4x6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[4x6]C[5,3x6]C[6,6]2)(C[6]C[6]H)(H)	C[6](C[6]C[4x6]H)(C[6]C[5,6]C)(H)	H(C[6]C[4x6]C[6])	C[6](C[4x6]C[5,3x6]C[6,6]2)(C[6]C[6]H)(H){1|O<1>,1|O<2>,2|C<3>,2|H<1>,3|C<4>}	C[6](C[6]C[4x6]H)(C[6]C[5,6]C)(H){2|C<3>,2|C<4>}	H(C[6]C[4x6]C[6])	119.8340	0.105	2	119.9080	0.022	3	119.9080	0.022	3	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[4x6]-4:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[4x6]C[4,4x6]C[5x6]H)(C[6]N[6]H)(H)	C[6](N[6]C[4,6,6]C)(C[6]C[4x6]H)(H)	H(C[6]C[4x6]C[6])	C[6](C[4x6]C[4,4x6]C[5x6]H)(C[6]N[6]H)(H){2|N<3>,5|C<4>}	C[6](N[6]C[4,6,6]C)(C[6]C[4x6]H)(H){2|H<1>,3|C<4>}	H(C[6]C[4x6]C[6])	119.7380	0.000	1	119.7380	0.000	1	119.7380	0.000	1	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,3x6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,3x6]C[3x6]C[5,6]2)(C[6]C[6]H)(H)	C[6](C[6]C[5,3x6]H)(C[6]C[6]O)(H)	H(C[6]C[5,3x6]C[6])	C[6](C[5,3x6]C[3x6]C[5,6]2)(C[6]C[6]H)(H){1|O<1>,4|C<4>,5|H<1>}	C[6](C[6]C[5,3x6]H)(C[6]C[6]O)(H){2|H<1>,3|C<4>}	H(C[6]C[5,3x6]C[6])	118.0980	0.000	1	117.7730	0.211	2	118.4643	0.367	6	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,3x6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,3x6]C[3x6]C[5,6]2)(C[6]C[6]H)(H)	C[6](C[6]C[5,3x6]H)(C[6]C[6]O)(H)	H(C[6]C[5,3x6]C[6])	C[6](C[5,3x6]C[3x6]C[5,6]2)(C[6]C[6]H)(H){1|O<1>,4|C<4>,5|H<1>}	C[6](C[6]C[5,3x6]H)(C[6]C[6]O)(H){5|C<4>}	H(C[6]C[5,3x6]C[6])	117.4480	0.000	1	117.7730	0.211	2	118.4643	0.367	6	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,3x6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,3x6]C[5,3x6]C[5,6]N[5,6])(C[6]C[6]H)(H)	C[6](C[6]C[5,3x6]H)(C[6]C[5,6]O)(H)	H(C[6]C[5,3x6]C[6])	C[6](C[5,3x6]C[5,3x6]C[5,6]N[5,6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>,1|O<2>,5|C<4>}	C[6](C[6]C[5,3x6]H)(C[6]C[5,6]O)(H){1|H<1>,1|N<3>,3|C<4>}	H(C[6]C[5,3x6]C[6])	119.1500	0.000	1	119.1500	0.000	1	118.4643	0.367	6	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,3x6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,3x6]C[6,6,6a]P[5,6,6]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]C[5,3x6]H)(C[6]C[6]H)(H)	H(C[6]C[5,3x6]C[6])	C[6](C[5,3x6]C[6,6,6a]P[5,6,6]C[5,6])(C[6]C[6]H)(H){1|Au<2>,1|Si<4>,2|H<1>,2|P<3>,3|C<3>}	C[6](C[6]C[5,3x6]H)(C[6]C[6]H)(H){1|Si<4>,1|C<3>,1|C<4>,1|P<4>}	H(C[6]C[5,3x6]C[6])	118.5520	0.000	1	118.6967	0.017	3	118.4643	0.367	6	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,3x6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,3x6]C[6,6,6a]P[5,6,6]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]C[5,3x6]H)(C[6]C[6]H)(H)	H(C[6]C[5,3x6]C[6])	C[6](C[5,3x6]C[6,6,6a]P[5,6,6]C[5,6])(C[6]C[6]H)(H){1|Cu<3>,1|Si<4>,2|H<1>,2|P<3>,3|C<3>}	C[6](C[6]C[5,3x6]H)(C[6]C[6]H)(H){1|Si<4>,1|C<3>,1|C<4>,1|P<4>}	H(C[6]C[5,3x6]C[6])	118.8100	0.000	1	118.6967	0.017	3	118.4643	0.367	6	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,3x6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,3x6]C[6,6,6a]P[5,6,6]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]C[5,3x6]H)(C[6]C[6]H)(H)	H(C[6]C[5,3x6]C[6])	C[6](C[5,3x6]C[6,6,6a]P[5,6,6]C[5,6])(C[6]C[6]H)(H){1|Si<4>,2|H<1>,2|P<3>,3|C<3>}	C[6](C[6]C[5,3x6]H)(C[6]C[6]H)(H){1|Si<4>,1|C<3>,1|C<4>,1|P<3>}	H(C[6]C[5,3x6]C[6])	118.7280	0.000	1	118.6967	0.017	3	118.4643	0.367	6	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,5,6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,5,6,6]C[4,5,6,6]C[5,6,6a]O[5,5])(C[6]C[6]H)(H)	C[6](C[6]C[5,5,6,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,5,6,6]C[6])	C[6](C[5,5,6,6]C[4,5,6,6]C[5,6,6a]O[5,5])(C[6]C[6]H)(H){1|H<1>,2|C<4>,4|C<3>}	C[6](C[6]C[5,5,6,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[5,5,6,6]C[6])	122.2160	0.000	1	122.2160	0.000	1	121.9575	0.134	2	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,5,6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,5,6,6]C[5,6,6a]C[5,6,6]C[5,5])(C[6]C[6]H)(H)	C[6](C[6]C[5,5,6,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,5,6,6]C[6])	C[6](C[5,5,6,6]C[5,6,6a]C[5,6,6]C[5,5])(C[6]C[6]H)(H){1|C<4>,3|H<1>,4|C<3>}	C[6](C[6]C[5,5,6,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[5,5,6,6]C[6])	121.6990	0.000	1	121.6990	0.000	1	121.9575	0.134	2	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,5,6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,5,6]C[5,5,6]C[5,5]N[5])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,5,6]H)(H)	H(C[6]C[5,5,6]C[6])	C[6](C[5,5,6]C[5,5,6]C[5,5]N[5])(C[6]C[6,6a]H)(H){1|N<3>,3|C<3>,5|C<4>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,5,6]H)(H){1|H<1>,1|N<3>,2|C<3>,2|C<4>}	H(C[6]C[5,5,6]C[6])	118.4980	0.000	1	118.4980	0.000	1	118.4980	0.000	1	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,5,6]C[3x5,6]2C[6])(C[6]C[6]H)(H)	C[6](C[6]C[5,5,6]H)(C[6]C[6]O)(H)	H(C[6]C[5,5,6]C[6])	C[6](C[5,5,6]C[3x5,6]2C[6])(C[6]C[6]H)(H){1|Cl<1>,1|H<1>,1|O<1>,2|C<3>,4|C<4>}	C[6](C[6]C[5,5,6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[5,5,6]C[6])	117.9910	0.098	2	117.9910	0.010	2	118.4296	0.601	9	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,5,6]C[5,5]C[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,5,6]H)(C[6]C[6]O)(H)	H(C[6]C[5,5,6]C[6])	C[6](C[5,5,6]C[5,5]C[5,6]C[5])(C[6]C[6]H)(H){1|O<1>,1|O<2>,2|C<3>,2|C<4>,3|H<1>}	C[6](C[6]C[5,5,6]H)(C[6]C[6]O)(H){1|Cl<1>,1|C<3>,2|C<4>}	H(C[6]C[5,5,6]C[6])	119.6410	0.000	1	119.6410	0.000	1	118.4296	0.601	9	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,5,6]C[5,6]N[5,5]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,5,6]H)(C[6]C[6]O)(H)	H(C[6]C[5,5,6]C[6])	C[6](C[5,5,6]C[5,6]N[5,5]C[5])(C[6]C[6]H)(H){1|B<4>,1|H<1>,1|N<3>,1|O<2>,1|S<1>,1|S<2>,2|C<3>}	C[6](C[6]C[5,5,6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[5,5,6]C[6])	119.3190	0.037	2	118.3738	0.586	6	118.4296	0.601	9	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,5,6]C[5,6]N[5,5]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,5,6]H)(C[6]C[6]O)(H)	H(C[6]C[5,5,6]C[6])	C[6](C[5,5,6]C[5,6]N[5,5]C[5])(C[6]C[6]H)(H){1|C<3>,1|O<1>,2|H<1>,5|C<4>}	C[6](C[6]C[5,5,6]H)(C[6]C[6]O)(H){1|N<3>,2|C<4>,2|H<1>}	H(C[6]C[5,5,6]C[6])	117.6890	0.000	1	118.3738	0.586	6	118.4296	0.601	9	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,5,6]C[5,6]N[5,5]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,5,6]H)(C[6]C[6]O)(H)	H(C[6]C[5,5,6]C[6])	C[6](C[5,5,6]C[5,6]N[5,5]C[5])(C[6]C[6]H)(H){1|H<1>,1|O<1>,1|S<4>,2|C<3>,3|C<4>}	C[6](C[6]C[5,5,6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|N<3>,2|H<1>}	H(C[6]C[5,5,6]C[6])	117.7420	0.000	1	118.3738	0.586	6	118.4296	0.601	9	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,5,6]C[5,6]N[5,5]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,5,6]H)(C[6]C[6]O)(H)	H(C[6]C[5,5,6]C[6])	C[6](C[5,5,6]C[5,6]N[5,5]C[5])(C[6]C[6]H)(H){1|H<1>,1|O<1>,2|C<4>,4|C<3>}	C[6](C[6]C[5,5,6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|N<3>,2|H<1>}	H(C[6]C[5,5,6]C[6])	118.0870	0.330	2	118.3738	0.586	6	118.4296	0.601	9	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6,6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6,6]C[6,6,6a]C[5,6a]C[5,6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a,6a]C[6a])(C[6]C[5,6,6]H)(H)	H(C[6]C[5,6,6]C[6])	C[6](C[5,6,6]C[6,6,6a]C[5,6a]C[5,6])(C[6]C[6,6a]H)(H){1|C<4>,2|H<1>,5|C<3>}	C[6](C[6,6a]C[6,6a,6a]C[6a])(C[6]C[5,6,6]H)(H){1|C<4>,1|H<1>,4|C<3>}	H(C[6]C[5,6,6]C[6])	119.1900	0.000	1	119.1900	0.000	1	119.1900	0.000	1	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6,6]C[3,5,6]C[5,6,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6,6]H)(C[6]C[6]O)(H)	H(C[6]C[5,6,6]C[6])	C[6](C[5,6,6]C[3,5,6]C[5,6,6]C[6])(C[6]C[6]H)(H){1|H<1>,1|O<1>,3|C<3>,4|C<4>}	C[6](C[6]C[5,6,6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[5,6,6]C[6])	117.7435	0.425	2	117.7435	0.181	2	118.4451	0.797	14	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6,6]C[5,5,6,6]C[5,6,6]Br)(C[6]C[6]H)(H)	C[6](C[6]C[5,6,6]H)(C[6]C[5,6,6]O)(H)	H(C[6]C[5,6,6]C[6])	C[6](C[5,6,6]C[5,5,6,6]C[5,6,6]Br)(C[6]C[6]H)(H){1|O<1>,2|C<4>,2|H<1>,2|O<2>}	C[6](C[6]C[5,6,6]H)(C[6]C[5,6,6]O)(H){1|Br<1>,1|H<1>,3|C<4>}	H(C[6]C[5,6,6]C[6])	118.9290	0.000	1	118.9290	0.000	1	118.4451	0.797	14	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6,6]C[5,5,6,6]C[5,6,6]C)(C[6]C[6]H)(H)	C[6](C[6]C[5,6,6]H)(C[6]C[6]O)(H)	H(C[6]C[5,6,6]C[6])	C[6](C[5,6,6]C[5,5,6,6]C[5,6,6]C)(C[6]C[6]H)(H){1|C<3>,1|O<1>,1|O<2>,3|C<4>}	C[6](C[6]C[5,6,6]H)(C[6]C[6]O)(H){2|Cl<1>,1|C<3>,2|C<4>}	H(C[6]C[5,6,6]C[6])	117.0040	0.000	1	117.0040	0.000	1	118.4451	0.797	14	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6,6]C[5,6,6]C[5]O[6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6,6]H)(C[6]C[6]O)(H)	H(C[6]C[5,6,6]C[6])	C[6](C[5,6,6]C[5,6,6]C[5]O[6])(C[6]C[6]H)(H){1|N<3>,1|O<1>,2|H<1>,4|C<4>}	C[6](C[6]C[5,6,6]H)(C[6]C[6]O)(H){1|O<2>,2|C<4>,2|H<1>}	H(C[6]C[5,6,6]C[6])	118.0060	0.000	1	118.0060	0.000	1	118.4451	0.797	14	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6,6]C[5,6,6]C[6]O[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6,6]C[6])	C[6](C[5,6,6]C[5,6,6]C[6]O[5])(C[6]C[6]H)(H){1|O<2>,2|H<1>,4|C<3>}	C[6](C[6]C[5,6,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[5,6,6]C[6])	118.9455	0.223	2	118.9455	0.050	2	118.4451	0.797	14	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6,6]C[5,6]2C[6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6,6]H)(C[6]C[6]O)(H)	H(C[6]C[5,6,6]C[6])	C[6](C[5,6,6]C[5,6]2C[6])(C[6]C[6]H)(H){1|C<3>,1|O<1>,3|H<1>,4|C<4>}	C[6](C[6]C[5,6,6]H)(C[6]C[6]O)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[5,6,6]C[6])	117.9690	0.000	1	117.9690	0.000	1	118.4451	0.797	14	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6,6]C[6,6]N[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6,6]C[6])	C[6](C[5,6,6]C[6,6]N[5,6]C[5])(C[6]C[6]H)(H){1|C<4>,1|O<2>,2|H<1>,4|C<3>}	C[6](C[6]C[5,6,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[5,6,6]C[6])	119.6980	0.000	1	119.6980	0.000	1	118.4451	0.797	14	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6,6]C[6,6]N[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6,6]H)(C[6]C[6]O)(H)	H(C[6]C[5,6,6]C[6])	C[6](C[5,6,6]C[6,6]N[5,6]C[5])(C[6]C[6]H)(H){1|C<4>,1|O<1>,5|C<3>}	C[6](C[6]C[5,6,6]H)(C[6]C[6]O)(H){1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[5,6,6]C[6])	119.0180	0.000	1	118.5105	0.515	2	118.4451	0.797	14	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6,6]C[6,6]N[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6,6]H)(C[6]C[6]O)(H)	H(C[6]C[5,6,6]C[6])	C[6](C[5,6,6]C[6,6]N[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|O<1>,3|C<3>,3|C<4>}	C[6](C[6]C[5,6,6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|N<3>,2|H<1>}	H(C[6]C[5,6,6]C[6])	118.0030	0.000	1	118.5105	0.515	2	118.4451	0.797	14	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6,6]C[6,6a]C[5,6]2)(C[6]C[6]H)(H)	C[6](C[6]C[5,6,6]H)(C[6]C[6]O)(H)	H(C[6]C[5,6,6]C[6])	C[6](C[5,6,6]C[6,6a]C[5,6]2)(C[6]C[6]H)(H){1|C<4>,1|O<1>,2|H<1>,2|N<3>,3|C<3>}	C[6](C[6]C[5,6,6]H)(C[6]C[6]O)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[5,6,6]C[6])	117.2740	0.000	1	117.2740	0.000	1	118.4451	0.797	14	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6,6]C[6,6a]C[5,6]N[5,6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6,6]H)(C[6]C[6]O)(H)	H(C[6]C[5,6,6]C[6])	C[6](C[5,6,6]C[6,6a]C[5,6]N[5,6])(C[6]C[6]H)(H){1|O<1>,3|C<3>,3|C<4>}	C[6](C[6]C[5,6,6]H)(C[6]C[6]O)(H){1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[5,6,6]C[6])	119.0710	0.000	1	119.0710	0.000	1	118.4451	0.797	14	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6,6]N[5,6,6]C[5,6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6,6]H)(C[6]C[6]C)(H)	H(C[6]C[5,6,6]C[6])	C[6](C[5,6,6]N[5,6,6]C[5,6]N[6])(C[6]C[6]H)(H){2|C<4>,2|H<1>,4|C<3>}	C[6](C[6]C[5,6,6]H)(C[6]C[6]C)(H){1|C<4>,1|H<1>,2|N<3>}	H(C[6]C[5,6,6]C[6])	119.8810	0.000	1	119.8810	0.000	1	118.4451	0.797	14	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6,6]-4:C[6]-3:H-1:	N[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6,6]C[5,6,6]N[5,5,6]H)(C[6]N[5a,6]H)(H)	C[6](N[5a,6]N[5a,6]C[5a])(C[6]C[5,6,6]H)(H)	H(C[6]C[5,6,6]C[6])	C[6](C[5,6,6]C[5,6,6]N[5,5,6]H)(C[6]N[5a,6]H)(H){1|C<3>,1|H<1>,1|N<3>,1|S<4>,2|C<4>}	C[6](N[5a,6]N[5a,6]C[5a])(C[6]C[5,6,6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|O<1>,2|N<3>}	H(C[6]C[5,6,6]C[6])	118.2175	0.214	2	118.2175	0.046	2	118.2175	0.046	2	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6,6]C[5]Hf)(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,6,6]C[5])(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6,6]C[5]Hf)(C[6]C[5,6]H)(H){1|C<3>,1|H<1>,3|C<4>}	C[6](C[5,6]C[5,6,6]C[5])(C[6]C[5,6]H)(H){1|Hf<12>,2|C<3>,2|C<4>,2|H<1>}	H(C[6]C[5,6]C[6])	120.1630	0.000	1	120.1630	0.000	1	120.1968	0.330	5	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Fe)(C[6]C[5,6]H)(H)	C[6](C[5,6]N[5,6]N[5])(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Fe)(C[6]C[5,6]H)(H){1|H<1>,1|N<2>,1|N<3>,2|C<4>}	C[6](C[5,6]N[5,6]N[5])(C[6]C[5,6]H)(H){1|Fe<10>,4|C<4>}	H(C[6]C[5,6]C[6])	120.4707	0.486	3	120.4707	0.236	3	120.1968	0.330	5	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]N[5,6]H)(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,5,6]C[5])(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]N[5,6]H)(C[6]C[5,6]H)(H){1|C<3>,2|H<1>,3|C<4>}	C[6](C[5,6]C[5,5,6]C[5])(C[6]C[5,6]H)(H){1|C<3>,1|N<3>,1|O<2>,2|C<4>,2|H<1>}	H(C[6]C[5,6]C[6])	119.4090	0.000	1	119.4090	0.000	1	120.1968	0.330	5	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6a]N[5,5a]C[6])(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6]N[6])(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6a]N[5,5a]C[6])(C[6]C[6,6]H)(H){1|H<1>,1|N<2>,5|C<3>}	C[6](C[6,6]C[6,6]N[6])(C[6]C[5,6]H)(H){1|N<3>,1|O<2>,3|C<3>}	H(C[6]C[5,6]C[6])	118.4670	0.000	1	118.3520	0.026	2	117.7462	1.151	5	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6a]N[5,5a]C[6])(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6]N[6])(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6a]N[5,5a]C[6])(C[6]C[6,6]H)(H){1|H<1>,1|N<2>,5|C<3>}	C[6](C[6,6]C[6,6]N[6])(C[6]C[5,6]H)(H){1|N<3>,1|S<2>,3|C<3>}	H(C[6]C[5,6]C[6])	118.2370	0.000	1	118.3520	0.026	2	117.7462	1.151	5	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5]N[5]O[6])(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6]N[6])(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5]N[5]O[6])(C[6]C[6,6]H)(H){1|N<3>,3|C<3>,3|C<4>}	C[6](C[6,6]C[6,6]N[6])(C[6]C[5,6]H)(H){1|N<3>,1|O<2>,2|C<3>,2|C<4>}	H(C[6]C[5,6]C[6])	117.3423	1.295	3	117.3423	1.677	3	117.7462	1.151	5	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[5,6]C[5]C[6]O[5])(C[6]C[6,6a]Br)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(Br)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5]C[6]O[5])(C[6]C[6,6a]Br)(H){1|C<4>,1|O<1>,2|H<1>,3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(Br){1|C<4>,1|H<1>,1|O<2>,3|C<3>}	H(C[6]C[5,6]C[6])	119.6290	0.000	1	119.6290	0.000	1	119.6290	0.000	1	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,5,6]C[5,6]H)(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,5,6]C[5,6]H)(C[6]C[6,6a]H)(H){1|O<2>,2|C<3>,2|C<4>,2|H<1>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H){2|C<3>,2|C<4>,2|H<1>}	H(C[6]C[5,6]C[6])	118.9440	0.000	1	118.9440	0.000	1	119.2872	2.209	76	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,5,6]C[5]C)(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[5,6,6a]C[6a])(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,5,6]C[5]C)(C[6]C[6,6a]H)(H){3|C<3>,4|C<4>}	C[6](C[6,6a]C[5,6,6a]C[6a])(C[6]C[5,6]H)(H){1|H<1>,2|C<3>,3|C<4>}	H(C[6]C[5,6]C[6])	116.3240	0.492	2	116.3240	0.242	2	119.2872	2.209	76	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,5]N[5,6]H)(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,5]N[5,6]H)(C[6]C[6,6a]H)(H){1|C<4>,1|H<1>,1|N<3>,3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[5,6]C[6])	119.2300	0.000	1	119.0567	0.069	4	119.2872	2.209	76	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,5]N[5,6]H)(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,5]N[5,6]H)(C[6]C[6,6a]H)(H){2|C<4>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[5,6]C[6])	118.9990	0.289	3	119.0567	0.069	4	119.2872	2.209	76	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Co)(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Co)(C[6]C[6,6a]H)(H){1|H<1>,2|C<3>,2|C<4>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H){1|Co<10>,1|H<1>,2|C<3>,2|C<4>}	H(C[6]C[5,6]C[6])	120.3925	0.315	2	120.3925	0.099	2	119.2872	2.209	76	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Fe)(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Fe)(C[6]C[6,6a]H)(H){1|H<1>,2|C<3>,2|C<4>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H){1|Fe<10>,1|H<1>,2|C<3>,2|C<4>}	H(C[6]C[5,6]C[6])	120.1838	0.432	4	120.1838	0.187	4	119.2872	2.209	76	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6,6a]H)(H){1|C<4>,1|H<1>,1|O<2>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H){2|C<3>,2|C<4>,2|H<1>}	H(C[6]C[5,6]C[6])	122.4850	0.000	1	118.9775	3.670	6	119.2872	2.209	76	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6,6a]H)(H){1|C<4>,1|O<2>,2|H<1>,3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H){1|C<2>,1|H<1>,2|C<3>,2|C<4>}	H(C[6]C[5,6]C[6])	117.4080	0.031	2	118.9775	3.670	6	119.2872	2.209	76	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6,6a]H)(H){1|H<1>,1|O<2>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H){1|H<1>,2|C<4>,3|C<3>}	H(C[6]C[5,6]C[6])	118.0140	0.000	1	118.9775	3.670	6	119.2872	2.209	76	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6,6a]H)(H){1|N<3>,3|C<3>,3|H<1>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H){2|C<3>,2|C<4>,2|H<1>}	H(C[6]C[5,6]C[6])	119.3580	0.000	1	118.9775	3.670	6	119.2872	2.209	76	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6,6a]H)(H){2|Cl<1>,1|N<3>,1|S<2>,3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H){2|C<3>,2|C<4>,2|H<1>}	H(C[6]C[5,6]C[6])	119.1920	0.000	1	118.9775	3.670	6	119.2872	2.209	76	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6,6a]H)(H){1|Si<5>,2|C<3>,2|C<4>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H){1|Zr<13>,1|H<1>,2|C<3>,2|C<4>}	H(C[6]C[5,6]C[6])	120.4940	0.000	1	120.2717	0.072	3	119.2872	2.209	76	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6,6a]H)(H){1|Si<5>,2|C<3>,2|C<4>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H){1|Zr<15>,1|H<1>,2|C<3>,2|C<4>}	H(C[6]C[5,6]C[6])	120.1605	0.264	2	120.2717	0.072	3	119.2872	2.209	76	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]N[5]H)(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]N[5]H)(C[6]C[6,6a]H)(H){1|O<2>,2|H<1>,3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[5,6]C[6])	122.3595	0.152	2	122.3595	0.023	2	119.2872	2.209	76	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6a]2O[6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6a]2O[6])(C[6]C[6,6a]H)(H){6|C<3>}	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[5,6]H)(H){1|O<2>,5|C<3>}	H(C[6]C[5,6]C[6])	121.4910	0.000	1	121.4910	0.000	1	119.2872	2.209	76	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6a]2O[6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6a]2O[6])(C[6]C[6,6a]H)(H){6|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H){1|H<1>,1|O<2>,4|C<3>}	H(C[6]C[5,6]C[6])	122.0830	0.000	1	122.0830	0.000	1	119.2872	2.209	76	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6a]C[5,6]C)(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6a]C[5,6]C)(C[6]C[6,6a]H)(H){1|C<4>,1|N<3>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H){1|H<1>,2|C<4>,3|C<3>}	H(C[6]C[5,6]C[6])	118.0920	0.000	1	118.0920	0.000	1	119.2872	2.209	76	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6a]C[5,6]C[6a])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6a]C[5,6]C[6a])(C[6]C[6,6a]H)(H){1|N<2>,6|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H){1|H<1>,5|C<3>}	H(C[6]C[5,6]C[6])	120.2190	0.000	1	120.2190	0.000	1	119.2872	2.209	76	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6a]C[5,6]H)(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6a]C[5,6]H)(C[6]C[6,6a]H)(H){1|H<1>,1|N<3>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[5,6]C[6])	118.7790	0.000	1	118.7375	0.003	2	119.2872	2.209	76	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6a]C[5,6]H)(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6a]C[5,6]H)(C[6]C[6,6a]H)(H){1|H<1>,1|O<2>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[5,6]C[6])	118.6960	0.000	1	118.7375	0.003	2	119.2872	2.209	76	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6a]N[5,6]H)(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6a]N[5,6]H)(C[6]C[6,6a]H)(H){1|N<3>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[5,6]C[6])	119.1820	0.000	1	119.1820	0.000	1	119.2872	2.209	76	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6a]O[5]O[6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6a]O[5]O[6])(C[6]C[6,6a]H)(H){1|C<4>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H){1|H<1>,2|O<2>,3|C<3>}	H(C[6]C[5,6]C[6])	119.2727	0.293	3	119.2727	0.086	3	119.2872	2.209	76	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5]2C[6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5]2C[6])(C[6]C[6,6a]H)(H){1|H<1>,1|O<1>,6|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H){1|C<4>,1|H<1>,4|C<3>}	H(C[6]C[5,6]C[6])	118.4315	0.076	2	118.4315	0.006	2	119.2872	2.209	76	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5]N[5]O[6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]2)(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5]N[5]O[6])(C[6]C[6,6a]H)(H){3|C<4>,4|C<3>}	C[6](C[6,6a]C[6,6a]2)(C[6]C[5,6]H)(H){1|C<4>,1|N<3>,1|O<2>,3|C<3>}	H(C[6]C[5,6]C[6])	118.4580	0.000	1	118.4580	0.000	1	119.2872	2.209	76	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5]N[5]O[6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5]N[5]O[6])(C[6]C[6,6a]H)(H){2|C<3>,5|C<4>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H){1|C<4>,1|H<1>,1|N<3>,1|O<2>,2|C<3>}	H(C[6]C[5,6]C[6])	118.4985	0.200	2	118.8707	1.915	32	119.2872	2.209	76	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5]N[5]O[6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5]N[5]O[6])(C[6]C[6,6a]H)(H){2|C<4>,5|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H){1|C<4>,1|H<1>,1|N<3>,1|O<2>,2|C<3>}	H(C[6]C[5,6]C[6])	121.5140	1.430	2	118.8707	1.915	32	119.2872	2.209	76	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5]N[5]O[6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5]N[5]O[6])(C[6]C[6,6a]H)(H){3|C<4>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H){1|C<4>,1|H<1>,1|N<3>,1|O<2>,2|C<3>}	H(C[6]C[5,6]C[6])	118.7084	1.252	28	118.8707	1.915	32	119.2872	2.209	76	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5]N[5]O[6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5]N[5]O[6])(C[6]C[6,6a]H)(H){3|C<4>,4|C<3>}	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[5,6]H)(H){1|C<4>,1|N<3>,1|O<2>,3|C<3>}	H(C[6]C[5,6]C[6])	120.3535	0.237	2	120.3535	0.056	2	119.2872	2.209	76	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6,6]C[5,5]H)(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6,6a]C[6a])(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6,6]C[5,5]H)(C[6]C[6,6a]H)(H){1|H<1>,2|C<4>,3|C<3>}	C[6](C[6,6a]C[6,6,6a]C[6a])(C[6]C[5,6]H)(H){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[5,6]C[6])	118.9820	0.000	1	118.9820	0.000	1	119.2872	2.209	76	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]C[5]H)(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]C[5]H)(C[6]C[6,6a]H)(H){1|C<4>,1|H<1>,1|N<3>,3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[5,6]C[6])	119.5913	0.288	3	120.4650	3.108	4	119.2872	2.209	76	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]C[5]H)(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]C[5]H)(C[6]C[6,6a]H)(H){2|C<4>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(H){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[5,6]C[6])	123.0860	0.000	1	120.4650	3.108	4	119.2872	2.209	76	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[5,6]C[3,5,6]O[5]C)(C[6]C[6]Br)(H)	C[6](C[6]C[3,6]O)(C[6]C[5,6]H)(Br)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[3,5,6]O[5]C)(C[6]C[6]Br)(H){1|C<3>,1|H<1>,1|O<1>,2|C<4>}	C[6](C[6]C[3,6]O)(C[6]C[5,6]H)(Br){1|H<1>,1|O<2>,3|C<4>}	H(C[6]C[5,6]C[6])	120.1250	0.000	1	120.1250	0.000	1	120.2426	0.844	8	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Pd)(C[6]C[6]Br)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]C)(Br)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Pd)(C[6]C[6]Br)(H){2|C<3>,3|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]C)(Br){1|Pd<7>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	121.2435	0.012	2	121.2435	0.000	2	120.2426	0.844	8	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[5,6]C[5]C[6]O[5])(C[6]C[6]Br)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(Br)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5]C[6]O[5])(C[6]C[6]Br)(H){1|N<2>,2|C<3>,2|O<2>,3|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]O)(Br){1|Br<1>,1|O<2>,2|C<4>}	H(C[6]C[5,6]C[6])	120.5027	0.122	3	119.8658	0.795	5	120.2426	0.844	8	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[5,6]C[5]C[6]O[5])(C[6]C[6]Br)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(Br)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5]C[6]O[5])(C[6]C[6]Br)(H){1|O<1>,3|C<3>,3|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]O)(Br){1|Br<1>,1|C<3>,1|C<4>,1|O<2>}	H(C[6]C[5,6]C[6])	118.9105	0.329	2	119.8658	0.795	5	120.2426	0.844	8	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[3,5,6]C[6a]N[5])(C[6]C[6]H)(H)	C[6](C[6]C[3,6]O)(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[3,5,6]C[6a]N[5])(C[6]C[6]H)(H){1|H<1>,1|O<1>,1|S<4>,2|C<3>,3|C<4>}	C[6](C[6]C[3,6]O)(C[6]C[5,6]H)(H){1|C<3>,1|H<1>,1|N<3>,2|C<4>}	H(C[6]C[5,6]C[6])	117.6630	0.000	1	117.6630	0.000	1	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,5,6,6]N[5]C)(C[6]C[6]H)(H)	C[6](C[6]C[5,6,6]O)(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,5,6,6]N[5]C)(C[6]C[6]H)(H){1|H<1>,1|O<1>,1|S<4>,3|C<4>}	C[6](C[6]C[5,6,6]O)(C[6]C[5,6]H)(H){1|H<1>,1|N<3>,3|C<4>}	H(C[6]C[5,6]C[6])	118.1080	0.000	1	118.1080	0.000	1	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,5,6]C[5]N)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[5,6]O)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,5,6]C[5]N)(C[6]C[6]H)(H){1|C<3>,1|O<1>,2|C<4>,3|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[5,6]O)(H){1|H<1>,1|N<3>,1|O<2>,2|C<4>}	H(C[6]C[5,6]C[6])	117.7730	0.000	1	117.7730	0.000	1	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,5,6]C[5]O)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]C)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,5,6]C[5]O)(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<4>,3|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]C)(H){1|H<1>,1|O<2>,2|C<4>}	H(C[6]C[5,6]C[6])	119.3260	0.000	1	119.3260	0.000	1	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,5,6]N[5]C)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[5,6]O)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,5,6]N[5]C)(C[6]C[6]H)(H){1|H<1>,1|O<1>,1|S<4>,3|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[5,6]O)(H){1|H<1>,1|N<3>,3|C<4>}	H(C[6]C[5,6]C[6])	117.0690	0.000	1	117.0690	0.000	1	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,5,6]O[5]C)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[5,6]O)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,5,6]O[5]C)(C[6]C[6]H)(H){1|H<1>,1|O<1>,3|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[5,6]O)(H){1|H<1>,1|O<2>,3|C<4>}	H(C[6]C[5,6]C[6])	117.3840	0.000	1	117.3840	0.000	1	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,5]C[5,6]C)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[5,6]O)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,5]C[5,6]C)(C[6]C[6]H)(H){1|C<3>,1|O<1>,2|H<1>,3|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[5,6]O)(H){5|C<4>}	H(C[6]C[5,6]C[6])	118.3420	0.129	2	118.3420	0.017	2	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,5]C[5,6]Li)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,5]C[5,6]Li)(C[6]C[6]H)(H){1|Li<7>,1|C<3>,1|C<5>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Li<7>,1|C<4>,1|C<5>,1|H<1>}	H(C[6]C[5,6]C[6])	119.4810	0.000	1	119.4810	0.000	1	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,5]N[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]C)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,5]N[5,6]H)(C[6]C[6]H)(H){1|C<2>,2|C<4>,3|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]C)(H){1|C<4>,1|N<3>,2|H<1>}	H(C[6]C[5,6]C[6])	118.9830	0.000	1	118.9830	0.000	1	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,5a]C[6]N[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,5a]C[6]N[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>,1|O<2>,3|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[5,6]C[6])	118.4535	0.049	2	118.4535	0.002	2	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6,6]C[5,6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6,6]C[5,6]Ru)(C[6]C[6]H)(H){1|C<3>,1|H<1>,3|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ru<10>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.6310	0.216	2	120.6310	0.047	2	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6,6]C[5]C)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6,6]O)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6,6]C[5]C)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<1>,1|O<2>,3|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6,6]O)(H){5|C<4>}	H(C[6]C[5,6]C[6])	120.1740	0.017	2	120.1740	0.000	2	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6,6]C[5]Ca)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6,6]C[5]Ca)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6,6]H)(H){1|Ca<12>,1|C<3>,2|C<4>}	H(C[6]C[5,6]C[6])	120.4558	0.495	4	120.4558	0.245	4	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6,6]C[5]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6,6]C[5]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>,1|O<2>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6,6]H)(H){1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	119.6490	0.000	1	119.6490	0.000	1	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6,6]C[5]O)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6,6]C[5]O)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>,1|O<2>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6,6]H)(H){1|C<3>,1|O<2>,2|C<4>}	H(C[6]C[5,6]C[6])	119.7060	0.000	1	119.7060	0.000	1	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6,6]N[5]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6,6]N[5]H)(C[6]C[6]H)(H){1|S<4>,2|H<1>,3|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6,6]H)(H){1|H<1>,1|N<3>,2|C<4>}	H(C[6]C[5,6]C[6])	118.9360	0.000	1	118.9360	0.000	1	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6,6]O[5]C)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6,6]O)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6,6]O[5]C)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|N<3>,1|O<1>}	C[6](C[6]C[5,6]H)(C[6]C[6,6]O)(H){1|C<3>,2|C<4>,2|O<2>}	H(C[6]C[5,6]C[6])	117.7830	0.000	1	117.9845	0.081	2	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6,6]O[5]C)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6,6]O)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6,6]O[5]C)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<2>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6,6]O)(H){1|C<3>,1|O<2>,2|C<4>}	H(C[6]C[5,6]C[6])	118.1860	0.000	1	117.9845	0.081	2	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6,6]O[5]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6,6]O[5]H)(C[6]C[6]H)(H){1|N<2>,2|C<3>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6,6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[5,6]C[6])	124.1280	0.000	1	124.1280	0.000	1	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6,6]O[5]O)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6,6]O)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6,6]O[5]O)(C[6]C[6]H)(H){1|H<1>,1|O<1>,3|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6,6]O)(H){1|C<3>,2|C<4>,2|O<2>}	H(C[6]C[5,6]C[6])	116.7880	0.000	1	116.7880	0.000	1	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6,6]Si[5]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6,6]C)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6,6]Si[5]H)(C[6]C[6]H)(H){1|Si<4>,1|C<3>,1|O<2>,4|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6,6]C)(H){1|Si<4>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[5,6]C[6])	119.9490	0.000	1	119.9490	0.000	1	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]2Fe)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]2Fe)(C[6]C[6]H)(H){1|C<3>,1|H<1>,3|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Fe<10>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	122.3400	0.000	1	121.5225	1.337	2	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]2Fe)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]2Fe)(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Fe<10>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.7050	0.000	1	121.5225	1.337	2	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]2Hf)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]2Hf)(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Hf<12>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.6372	0.084	6	120.4338	0.167	10	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]2Hf)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]2Hf)(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Hf<13>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.1287	0.532	4	120.4338	0.167	10	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]2Mn)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]2Mn)(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Mn<8>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	121.1623	1.776	4	121.1623	3.153	4	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]2Nd)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]2Nd)(C[6]C[6]H)(H){1|C<3>,1|H<1>,3|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Nd<19>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.1100	0.000	1	120.0825	0.002	2	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]2Nd)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]2Nd)(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Nd<19>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.0550	0.000	1	120.0825	0.002	2	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]2Ru)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]2Ru)(C[6]C[6]H)(H){1|C<3>,1|C<5>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ru<7>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.7200	0.072	2	120.7200	0.005	6	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]2Ru)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]2Ru)(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ru<11>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.7200	0.081	4	120.7200	0.005	6	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]2Zr)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]C)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]2Zr)(C[6]C[6]H)(H){2|C<3>,3|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]C)(H){1|Zr<13>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.5459	0.220	12	120.5459	0.049	12	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]2Zr)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]2Zr)(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Zr<12>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.5958	0.168	5	120.5673	0.038	12	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]2Zr)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]2Zr)(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Zr<13>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.5469	0.224	7	120.5673	0.038	12	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]B[5]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]B[5]Ru)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|N<3>,1|N<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ru<9>,1|B<4>,1|C<4>,1|H<1>}	H(C[6]C[5,6]C[6])	119.3950	0.047	2	119.3950	0.002	2	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]C)(C[6]C[6]H)(H)	C[6](C[6]C[3x6]C[6])(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]C)(C[6]C[6]H)(H){1|C<3>,2|H<1>,4|C<4>}	C[6](C[6]C[3x6]C[6])(C[6]C[5,6]H)(H){1|H<1>,6|C<4>}	H(C[6]C[5,6]C[6])	118.5840	0.000	1	118.5840	0.000	1	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]C)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<2>,1|O<2>,3|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){4|C<4>}	H(C[6]C[5,6]C[6])	118.8620	0.000	1	118.8620	0.000	1	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]C)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]C)(C[6]C[6]H)(H){1|O<1>,1|O<2>,2|C<4>,3|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,3|C<4>}	H(C[6]C[5,6]C[6])	119.5160	0.000	1	119.5160	0.000	1	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]C)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]O[6]O)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]C)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<1>,1|O<2>,3|H<1>}	C[6](C[6]C[5,6]H)(C[6]O[6]O)(H){3|C<4>}	H(C[6]C[5,6]C[6])	121.2400	0.000	1	119.6730	2.008	3	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]C)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]O[6]O)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]C)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<1>,2|H<1>,2|O<2>}	C[6](C[6]C[5,6]H)(C[6]O[6]O)(H){1|C<3>,2|C<4>}	H(C[6]C[5,6]C[6])	118.8895	0.576	2	119.6730	2.008	3	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]C[6])(C[6]C[6]H)(H){1|N<3>,1|O<1>,3|H<1>,4|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	118.1262	0.203	4	118.1262	0.041	4	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Co)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Co)(C[6]C[6]H)(H){1|C<3>,1|H<1>,3|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Co<10>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.3104	0.165	7	120.6386	0.118	43	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Co)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Co)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Co<10>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.8130	0.288	3	120.6386	0.118	43	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Co)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Co)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Co<11>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.9314	0.116	20	120.6386	0.118	43	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Co)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Co)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Co<9>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.5858	0.054	4	120.6386	0.118	43	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Co)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Co)(C[6]C[6]H)(H){1|Si<4>,1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Co<10>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.2867	0.051	4	120.6386	0.118	43	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Co)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Co)(C[6]C[6]H)(H){1|Si<4>,1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Co<11>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.0305	0.043	2	120.6386	0.118	43	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Co)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Co)(C[6]C[6]H)(H){1|Si<4>,1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Co<9>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.2233	0.104	3	120.6386	0.118	43	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Cr)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Cr)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|P<3>,1|P<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Cr<8>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.0530	0.000	1	120.3498	0.066	28	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Cr)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Cr)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|P<3>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Cr<8>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.0510	0.000	1	120.3498	0.066	28	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Cr)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Cr)(C[6]C[6]H)(H){1|C<3>,1|H<1>,3|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Cr<10>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.3532	0.302	13	120.3498	0.066	28	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Cr)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Cr)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Cr<10>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.2952	0.130	9	120.3498	0.066	28	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Cr)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Cr)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Cr<9>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.7220	0.089	2	120.3498	0.066	28	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Cr)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Cr)(C[6]C[6]H)(H){1|Si<5>,1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Cr<9>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.4990	0.079	2	120.3498	0.066	28	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Eu)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Eu)(C[6]C[6]H)(H){1|C<3>,1|H<1>,3|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Eu<12>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.0300	0.596	4	120.0136	0.139	11	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Eu)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Eu)(C[6]C[6]H)(H){1|C<3>,1|H<1>,3|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Eu<13>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.0075	0.057	2	120.0136	0.139	11	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Eu)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Eu)(C[6]C[6]H)(H){1|Si<4>,1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Eu<12>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.0188	0.325	4	120.0136	0.139	11	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Eu)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Eu)(C[6]C[6]H)(H){1|Si<5>,1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Eu<13>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	119.9400	0.000	1	120.0136	0.139	11	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Fe)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Fe)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Fe<8>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.3700	0.000	1	120.5984	0.843	46	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Fe)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Fe)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<3>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Fe<10>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.1290	0.000	1	120.5984	0.843	46	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Fe)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Fe)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<4>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Fe<10>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.1715	0.223	2	120.5984	0.843	46	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Fe)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Fe)(C[6]C[6]H)(H){1|C<3>,1|H<1>,3|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Fe<10>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.6439	1.369	19	120.5984	0.843	46	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Fe)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Fe)(C[6]C[6]H)(H){1|C<3>,1|H<1>,3|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Fe<8>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.4710	0.167	2	120.5984	0.843	46	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Fe)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Fe)(C[6]C[6]H)(H){1|C<3>,1|H<1>,3|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Fe<9>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.1040	0.025	2	120.5984	0.843	46	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Fe)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Fe)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Fe<10>,1|Br<1>,2|C<4>}	H(C[6]C[5,6]C[6])	119.9130	0.000	1	120.5984	0.843	46	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Fe)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Fe)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Fe<10>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.4660	0.230	3	120.5984	0.843	46	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Fe)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Fe)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Fe<11>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	121.0075	0.076	2	120.5984	0.843	46	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Fe)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Fe)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Fe<8>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.7806	0.374	12	120.5984	0.843	46	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Fe)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Fe)(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Fe<8>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.6050	0.000	1	120.5984	0.843	46	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Gd)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Gd)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Gd<16>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.3123	0.110	4	120.3123	0.012	4	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]C)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,2|C<3>,2|N<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]C)(H){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[5,6]C[6])	119.5200	0.000	1	119.5200	0.000	1	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,2|C<3>,2|N<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[5,6]C[6])	121.4160	0.000	1	121.4173	0.692	3	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H){1|C<4>,1|N<3>,2|C<3>,3|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){2|C<4>,3|H<1>}	H(C[6]C[5,6]C[6])	120.5860	0.000	1	121.4173	0.692	3	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H){1|N<3>,1|P<4>,2|C<3>,3|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){2|C<4>,2|H<1>}	H(C[6]C[5,6]C[6])	122.2500	0.000	1	121.4173	0.692	3	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Hf)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]C)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Hf)(C[6]C[6]H)(H){1|C<3>,1|C<5>,3|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]C)(H){1|Hf<13>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.4914	0.189	10	120.4914	0.036	10	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Hf)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Hf)(C[6]C[6]H)(H){1|C<3>,1|C<5>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Hf<13>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	119.7175	0.124	2	120.5268	0.217	22	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Hf)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Hf)(C[6]C[6]H)(H){1|C<3>,1|H<1>,3|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Hf<12>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.5418	0.127	6	120.5268	0.217	22	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Hf)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Hf)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Hf<12>,1|Br<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.0590	0.085	2	120.5268	0.217	22	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Hf)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Hf)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Hf<12>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.8023	0.234	3	120.5268	0.217	22	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Hf)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Hf)(C[6]C[6]H)(H){1|Si<4>,1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Hf<11>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.4694	0.212	7	120.5268	0.217	22	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Hf)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Hf)(C[6]C[6]H)(H){1|Si<5>,1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Hf<13>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	121.5460	0.064	2	120.5268	0.217	22	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Ho)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Ho)(C[6]C[6]H)(H){1|C<3>,1|H<1>,3|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ho<14>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.1180	0.000	1	120.3055	0.070	2	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Ho)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Ho)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ho<14>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.4930	0.000	1	120.3055	0.070	2	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Ir)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Ir)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ir<9>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.7858	0.080	4	120.7858	0.006	4	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Li)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Li)(C[6]C[6]H)(H){1|C<3>,1|H<1>,3|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Li<7>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.0150	0.000	1	120.0566	0.052	5	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Li)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Li)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Li<7>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.0920	0.000	1	120.0566	0.052	5	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Li)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Li)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Li<8>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.2055	0.272	2	120.0566	0.052	5	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Li)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Li)(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|C<5>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Li<7>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	119.7650	0.000	1	120.0566	0.052	5	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Lu)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Lu)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Lu<16>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	123.1600	0.000	1	123.1150	0.004	2	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Lu)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Lu)(C[6]C[6]H)(H){1|Si<5>,1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Lu<16>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	123.0700	0.000	1	123.1150	0.004	2	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Mn)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Mn)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<4>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Mn<8>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.5620	0.000	2	120.7334	3.886	33	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Mn)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Mn)(C[6]C[6]H)(H){1|C<3>,1|H<1>,3|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Mn<10>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.3001	0.262	12	120.7334	3.886	33	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Mn)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Mn)(C[6]C[6]H)(H){1|C<3>,1|H<1>,3|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Mn<8>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	123.8560	0.000	1	120.7334	3.886	33	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Mn)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Mn)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Mn<10>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.4785	0.094	2	120.7334	3.886	33	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Mn)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Mn)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Mn<8>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	121.4047	3.632	9	120.7334	3.886	33	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Mn)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Mn)(C[6]C[6]H)(H){1|Si<4>,1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Mn<10>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.2889	0.254	7	120.7334	3.886	33	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Mo)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Mo)(C[6]C[6]H)(H){1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Mo<9>,1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[5,6]C[6])	121.9580	0.000	1	121.1595	0.679	57	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Mo)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Mo)(C[6]C[6]H)(H){1|C<3>,1|H<1>,3|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Mo<10>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.4050	0.139	2	121.1595	0.679	57	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Mo)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Mo)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Mo<10>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	121.1925	1.111	13	121.1595	0.679	57	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Mo)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Mo)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Mo<11>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	123.3350	0.000	1	121.1595	0.679	57	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Mo)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Mo)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Mo<12>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	121.2222	0.593	25	121.1595	0.679	57	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Mo)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Mo)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Mo<8>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.4180	0.006	2	121.1595	0.679	57	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Mo)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Mo)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Mo<9>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	121.4232	1.020	4	121.1595	0.679	57	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Mo)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Mo)(C[6]C[6]H)(H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Mo<9>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	122.0780	0.000	1	121.1595	0.679	57	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Mo)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Mo)(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Mo<10>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.8423	0.261	3	121.1595	0.679	57	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Mo)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Mo)(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Mo<12>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.4712	0.373	4	121.1595	0.679	57	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Mo)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Mo)(C[6]C[6]H)(H){1|Mo<9>,1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Mo<11>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.9100	0.000	1	121.1595	0.679	57	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Nd)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Nd)(C[6]C[6]H)(H){1|C<3>,1|C<5>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Nd<19>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	119.9690	0.000	1	119.9690	0.000	1	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Ni)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Ni)(C[6]C[6]H)(H){1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ni<7>,1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[5,6]C[6])	121.0680	0.000	1	120.8814	0.091	25	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Ni)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Ni)(C[6]C[6]H)(H){1|C<3>,1|H<1>,3|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ni<7>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.9414	0.391	5	120.8814	0.091	25	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Ni)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Ni)(C[6]C[6]H)(H){1|C<3>,1|H<1>,3|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ni<8>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.9260	0.198	2	120.8814	0.091	25	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Ni)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Ni)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ni<7>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.8307	0.330	14	120.8814	0.091	25	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Ni)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Ni)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ni<8>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.9830	0.047	2	120.8814	0.091	25	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Ni)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Ni)(C[6]C[6]H)(H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ni<7>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.8110	0.000	1	120.8814	0.091	25	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]O)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]O)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<1>,1|O<2>,3|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|O<2>,2|C<4>,2|H<1>}	H(C[6]C[5,6]C[6])	118.1090	0.000	1	117.8315	0.050	4	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]O)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]O)(C[6]C[6]H)(H){1|C<4>,1|O<1>,2|C<3>,3|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|O<2>,2|C<4>,2|H<1>}	H(C[6]C[5,6]C[6])	117.6030	0.000	1	117.8315	0.050	4	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]O)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]O)(C[6]C[6]H)(H){1|N<3>,1|O<1>,2|C<4>,3|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|O<2>,2|C<4>,2|H<1>}	H(C[6]C[5,6]C[6])	117.8070	0.137	2	117.8315	0.050	4	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]O[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[5,6]O)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]O[5])(C[6]C[6]H)(H){1|H<1>,1|O<1>,2|C<4>,3|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[5,6]O)(H){1|C<3>,1|H<1>,1|O<2>,2|C<4>}	H(C[6]C[5,6]C[6])	118.1590	0.000	1	118.1590	0.000	1	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Os)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Os)(C[6]C[6]H)(H){1|C<3>,1|H<1>,3|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Os<8>,1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[5,6]C[6])	120.7560	0.000	1	120.7560	0.000	1	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Pd)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Pd)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Pd<7>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.7117	0.320	8	120.7117	0.102	8	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Re)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Re)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Re<8>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.7289	0.417	9	120.7545	0.144	11	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Re)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Re)(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Re<8>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.8700	0.124	2	120.7545	0.144	11	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Rh)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Rh)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Rh<10>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.7200	0.000	1	120.7894	0.138	40	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Rh)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Rh)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Rh<10>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	121.0960	0.338	2	120.7894	0.138	40	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Rh)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Rh)(C[6]C[6]H)(H){1|C<3>,1|H<1>,3|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Rh<10>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.3200	0.000	1	120.7894	0.138	40	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Rh)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Rh)(C[6]C[6]H)(H){1|C<3>,1|H<1>,3|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Rh<7>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.3240	0.255	2	120.7894	0.138	40	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Rh)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Rh)(C[6]C[6]H)(H){1|C<3>,1|H<1>,3|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Rh<8>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	121.0145	0.268	2	120.7894	0.138	40	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Rh)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Rh)(C[6]C[6]H)(H){1|C<3>,1|H<1>,3|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Rh<9>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.5860	0.000	1	120.7894	0.138	40	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Rh)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Rh)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Rh<10>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	121.5820	0.240	2	120.7894	0.138	40	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Rh)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Rh)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Rh<7>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.5492	0.253	12	120.7894	0.138	40	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Rh)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Rh)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Rh<8>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.9580	0.097	6	120.7894	0.138	40	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Rh)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Rh)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Rh<9>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.4827	0.129	3	120.7894	0.138	40	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Rh)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Rh)(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Rh<10>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.6870	0.144	2	120.7894	0.138	40	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Rh)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Rh)(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Rh<8>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	121.1258	0.197	6	120.7894	0.138	40	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]C)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]H)(H){1|C<3>,1|C<5>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]C)(H){1|Ru<7>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.3020	0.000	1	120.3020	0.000	1	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|N<4>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ru<9>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.5665	0.062	2	120.6725	0.308	115	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]H)(H){1|C<2>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ru<8>,2|C<4>}	H(C[6]C[5,6]C[6])	120.8650	0.000	1	120.6725	0.308	115	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|C<5>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ru<7>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.7727	1.038	12	120.6725	0.308	115	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ru<11>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.7650	0.147	8	120.6725	0.308	115	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<3>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ru<10>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.3580	0.000	1	120.6725	0.308	115	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<4>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ru<10>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.4170	0.120	2	120.6725	0.308	115	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<5>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ru<11>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.2855	0.595	2	120.6725	0.308	115	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ru<10>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.5120	0.138	5	120.6725	0.308	115	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ru<7>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.5717	0.293	9	120.6725	0.308	115	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ru<8>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.6606	0.348	47	120.6725	0.308	115	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ru<9>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	121.5357	1.357	3	120.6725	0.308	115	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]H)(H){1|C<4>,1|C<5>,1|H<1>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ru<7>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.6621	0.829	14	120.6725	0.308	115	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|P<5>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ru<11>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.7190	0.000	1	120.6725	0.308	115	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ru<7>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.6328	0.298	5	120.6725	0.308	115	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ru<8>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.5570	0.314	2	120.6725	0.308	115	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ru<9>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.5600	0.000	1	120.6725	0.308	115	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]H)(H){1|N<2>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Ru<10>,2|C<4>}	H(C[6]C[5,6]C[6])	121.0198	0.202	4	120.8346	0.110	8	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]H)(H){1|N<3>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|Ru<10>,1|Pt<4>,2|C<4>}	H(C[6]C[5,6]C[6])	120.6495	0.355	4	120.8346	0.110	8	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6a]N[6])(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>,2|C<4>}	C[6](C[6]C[6a]N[6])(C[6]C[5,6]H)(H){1|Ru<10>,2|C<3>,2|C<4>}	H(C[6]C[5,6]C[6])	121.1182	0.260	6	120.8256	0.210	14	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6a]N[6])(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>,2|C<4>}	C[6](C[6]C[6a]N[6])(C[6]C[5,6]H)(H){1|Ru<10>,1|Co<4>,2|C<3>,2|C<4>}	H(C[6]C[5,6]C[6])	120.3665	0.552	4	120.8256	0.210	14	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6a]N[6])(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>,2|C<4>}	C[6](C[6]C[6a]N[6])(C[6]C[5,6]H)(H){1|Ru<10>,1|Cu<2>,2|C<3>,2|C<4>}	H(C[6]C[5,6]C[6])	120.7490	0.129	2	120.8256	0.210	14	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6a]N[6])(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>,2|C<4>}	C[6](C[6]C[6a]N[6])(C[6]C[5,6]H)(H){1|Ru<10>,1|Fe<4>,2|C<3>,2|C<4>}	H(C[6]C[5,6]C[6])	120.9425	0.257	2	120.8256	0.210	14	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Sc)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Sc)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Sc<13>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.8055	0.059	2	120.5803	0.034	6	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Sc)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Sc)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Sc<15>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.4677	0.069	4	120.5803	0.034	6	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Sm)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Sm)(C[6]C[6]H)(H){1|C<3>,1|H<1>,3|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Sm<14>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.0560	0.000	1	120.6554	0.438	10	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Sm)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Sm)(C[6]C[6]H)(H){1|C<3>,1|H<1>,3|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Sm<16>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	121.0975	0.794	4	120.6554	0.438	10	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Sm)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Sm)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Sm<14>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.1530	0.000	1	120.6554	0.438	10	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Sm)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Sm)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Sm<16>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.4887	0.427	4	120.6554	0.438	10	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Ti)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Ti)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ti<9>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.7150	0.000	1	120.6824	0.244	37	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Ti)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Ti)(C[6]C[6]H)(H){1|C<3>,1|H<1>,3|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ti<11>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	121.0560	0.000	2	120.6824	0.244	37	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Ti)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Ti)(C[6]C[6]H)(H){1|C<3>,1|H<1>,3|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ti<12>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.4927	0.321	6	120.6824	0.244	37	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Ti)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Ti)(C[6]C[6]H)(H){1|C<3>,1|H<1>,3|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ti<9>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.4265	1.119	2	120.6824	0.244	37	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Ti)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Ti)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ti<11>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	121.2990	0.000	2	120.6824	0.244	37	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Ti)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Ti)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ti<12>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.5095	0.217	8	120.6824	0.244	37	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Ti)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Ti)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ti<13>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.4870	0.112	4	120.6824	0.244	37	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Ti)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Ti)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ti<8>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.8884	0.282	5	120.6824	0.244	37	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Ti)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Ti)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ti<9>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	121.7020	0.960	2	120.6824	0.244	37	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Ti)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Ti)(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ti<11>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.4700	0.570	4	120.6824	0.244	37	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Ti)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Ti)(C[6]C[6]H)(H){1|Si<5>,1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ti<9>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.2650	0.000	1	120.6824	0.244	37	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Y)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Y)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<3>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Y<12>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.1295	0.441	2	120.7652	3.073	6	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Y)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Y)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Y<12>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	119.2355	0.292	2	120.7652	3.073	6	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Y)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Y)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Y<16>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	123.2640	0.000	1	120.7652	3.073	6	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Y)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Y)(C[6]C[6]H)(H){1|Si<5>,1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Y<16>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	122.5970	0.000	1	120.7652	3.073	6	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Yb)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Yb)(C[6]C[6]H)(H){1|B<3>,1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Yb<12>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.5925	0.239	4	120.4685	0.882	12	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Yb)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Yb)(C[6]C[6]H)(H){1|C<3>,1|H<1>,3|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Yb<12>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	119.4010	1.457	2	120.4685	0.882	12	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Yb)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Yb)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Yb<12>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.7417	0.961	6	120.4685	0.882	12	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]C)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(H){1|C<3>,1|C<5>,3|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]C)(H){1|Zr<13>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.3875	0.185	11	120.3580	0.034	13	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]C)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(H){1|Si<5>,1|C<3>,3|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]C)(H){1|Zr<13>,1|N<3>,2|C<4>}	H(C[6]C[5,6]C[6])	120.1955	0.039	2	120.3580	0.034	13	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(H){1|C<3>,1|C<5>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Zr<13>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.2380	0.151	8	120.7132	0.749	164	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(H){1|C<3>,1|H<1>,3|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Zr<10>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.2980	0.000	1	120.7132	0.749	164	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(H){1|C<3>,1|H<1>,3|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Zr<12>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.5218	0.791	21	120.7132	0.749	164	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(H){1|C<3>,1|H<1>,3|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Zr<13>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.7969	0.790	8	120.7132	0.749	164	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(H){1|C<3>,1|H<1>,3|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Zr<14>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.0120	0.797	4	120.7132	0.749	164	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(H){1|C<3>,1|H<1>,3|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Zr<15>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	123.0225	1.265	4	120.7132	0.749	164	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Zr<10>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.5115	0.248	2	120.7132	0.749	164	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Zr<12>,1|C<3>,2|C<4>}	H(C[6]C[5,6]C[6])	121.1280	0.000	1	120.7132	0.749	164	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Zr<12>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.5933	0.532	44	120.7132	0.749	164	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Zr<13>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.6912	0.299	24	120.7132	0.749	164	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Zr<14>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.5536	0.498	8	120.7132	0.749	164	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Zr<9>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.7530	0.282	7	120.7132	0.749	164	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Zr<12>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.5570	0.221	2	120.7132	0.749	164	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Zr<13>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	121.0097	0.357	4	120.7132	0.749	164	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(H){1|Si<4>,1|C<2>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Zr<13>,2|C<4>}	H(C[6]C[5,6]C[6])	121.7490	0.000	1	120.7132	0.749	164	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(H){1|Si<4>,1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Zr<12>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	121.3991	1.879	12	120.7132	0.749	164	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(H){1|Si<4>,1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Zr<13>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	121.6845	2.033	2	120.7132	0.749	164	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(H){1|Si<5>,1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Zr<13>,1|C<3>,2|C<4>}	H(C[6]C[5,6]C[6])	120.5435	0.175	2	120.7132	0.749	164	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(H){1|Si<5>,1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Zr<13>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.4532	0.161	5	120.7132	0.749	164	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(H){1|Si<5>,1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Zr<13>,1|N<3>,2|C<4>}	H(C[6]C[5,6]C[6])	120.1525	0.019	2	120.7132	0.749	164	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]H)(H){1|Si<5>,1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Zr<14>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.0160	0.066	2	120.7132	0.749	164	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[6,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]C[6])(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[6,6]C[5])(C[6]C[6]H)(H){1|C<2>,1|C<4>,1|N<3>,1|O<1>,4|C<3>}	C[6](C[6]C[6,6]C[6])(C[6]C[5,6]H)(H){1|C<4>,1|H<1>,5|C<3>}	H(C[6]C[5,6]C[6])	129.5360	0.000	1	129.5360	0.000	1	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[6]N[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[6]N[5])(C[6]C[6]H)(H){1|O<1>,1|O<2>,2|C<4>,4|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[5,6]C[6])	118.1770	0.165	2	118.1770	0.027	2	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[6a]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[6a]C[5])(C[6]C[6]H)(H){1|N<3>,1|O<1>,2|C<3>,2|C<4>,3|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[5,6]C[6])	118.6060	0.000	1	118.6060	0.000	1	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[6a]N[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[6a]N[5])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<1>,1|S<4>,4|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|N<3>,2|H<1>}	H(C[6]C[5,6]C[6])	117.5823	0.517	4	117.6190	0.207	5	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[6a]N[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[6a]N[5])(C[6]C[6]H)(H){1|H<1>,1|O<1>,1|S<4>,2|C<4>,3|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|N<3>,2|H<1>}	H(C[6]C[5,6]C[6])	117.7660	0.000	1	117.6190	0.207	5	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]N[5]C)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]N[5]C)(C[6]C[6]H)(H){1|S<4>,2|H<1>,3|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<4>}	H(C[6]C[5,6]C[6])	121.3330	0.000	1	121.3330	0.000	1	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]N[5]C)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]N[5]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>,1|S<4>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|N<3>,2|C<4>,2|H<1>}	H(C[6]C[5,6]C[6])	117.8810	0.000	1	117.6291	0.022	7	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]N[5]C)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]N[5]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<1>,1|S<4>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|N<3>,2|C<4>,2|H<1>}	H(C[6]C[5,6]C[6])	117.6550	0.000	1	117.6291	0.022	7	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]N[5]C)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]N[5]C)(C[6]C[6]H)(H){1|H<1>,1|O<1>,1|S<4>,3|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|N<3>,2|C<4>,2|H<1>}	H(C[6]C[5,6]C[6])	117.5736	0.112	5	117.6291	0.022	7	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]N[5]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]N[5]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,4|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[5,6]C[6])	119.0130	0.000	1	119.0130	0.000	1	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]N[5]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]N[5]H)(C[6]C[6]H)(H){1|C<3>,1|N<2>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]N[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[5,6]C[6])	120.0520	0.000	1	120.0520	0.000	1	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]N[5]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]N[6]S)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]N[5]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>,1|S<2>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]N[6]S)(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[5,6]C[6])	119.5620	0.034	2	119.5620	0.001	2	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]O[5]C)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]O[5]C)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<2>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[5,6]C[6])	119.0460	0.000	1	119.0460	0.000	1	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]O[5]C)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]O[5]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|Br<1>,1|H<1>,1|O<2>,2|C<4>}	H(C[6]C[5,6]C[6])	117.3065	0.415	2	117.7401	0.593	25	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]O[5]C)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]O[5]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|Cl<1>,1|H<1>,1|O<2>,2|C<4>}	H(C[6]C[5,6]C[6])	117.1858	0.217	5	117.7401	0.593	25	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]O[5]C)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]O[5]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|O<2>,2|C<4>,2|H<1>}	H(C[6]C[5,6]C[6])	117.9266	0.450	10	117.7401	0.593	25	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]O[5]C)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]O[5]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<1>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|H<1>,1|O<2>,2|C<4>}	H(C[6]C[5,6]C[6])	117.2870	0.000	1	117.7401	0.593	25	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]O[5]C)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]O[5]C)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|O<2>,2|C<4>,2|H<1>}	H(C[6]C[5,6]C[6])	118.1510	0.000	1	117.7401	0.593	25	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]O[5]C)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]O[5]C)(C[6]C[6]H)(H){1|H<1>,1|O<1>,1|O<2>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|O<2>,2|C<4>,2|H<1>}	H(C[6]C[5,6]C[6])	119.2545	2.102	2	117.7401	0.593	25	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]O[5]C)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]O[5]C)(C[6]C[6]H)(H){1|H<1>,1|O<1>,3|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|O<2>,2|C<4>,2|H<1>}	H(C[6]C[5,6]C[6])	117.4368	0.100	4	117.7401	0.593	25	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]O[5]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]O[5]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<2>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<4>,1|O<2>,2|H<1>}	H(C[6]C[5,6]C[6])	118.9750	0.000	1	118.9750	0.000	1	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]O[5]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]O[6]O)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]O[5]H)(C[6]C[6]H)(H){1|H<1>,1|O<1>,1|O<2>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]O[6]O)(H){1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[5,6]C[6])	119.7955	0.302	2	119.7955	0.091	2	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]P[5]Fe)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]P[5]Fe)(C[6]C[6]H)(H){1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Fe<10>,1|C<4>,1|H<1>,1|P<3>}	H(C[6]C[5,6]C[6])	120.1980	0.000	1	120.1980	0.000	1	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]P[5]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]P[5]H)(C[6]C[6]H)(H){1|C<4>,1|N<3>,1|O<1>,2|C<3>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<4>,1|P<4>,2|H<1>}	H(C[6]C[5,6]C[6])	121.4180	0.000	1	121.4180	0.000	1	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]P[5]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]P[5]Ru)(C[6]C[6]H)(H){1|H<1>,2|C<4>,3|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ru<11>,1|C<4>,1|H<1>,1|P<5>}	H(C[6]C[5,6]C[6])	120.5283	1.058	3	120.5283	1.120	3	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6a]2C[6,6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]C)(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6a]2C[6,6a])(C[6]C[6]H)(H){7|C<3>}	C[6](C[6]C[6,6a]C)(C[6]C[5,6]H)(H){4|C<3>}	H(C[6]C[5,6]C[6])	117.4180	0.000	1	117.4180	0.000	1	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6a]2C[6,6a])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]O)(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6a]2C[6,6a])(C[6]C[6]H)(H){1|O<1>,6|C<3>}	C[6](C[6]C[6,6a]O)(C[6]C[5,6]H)(H){4|C<3>}	H(C[6]C[5,6]C[6])	117.3550	0.000	1	117.3550	0.000	1	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6a]C[5,6]O)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6a]C[5,6]O)(C[6]C[6]H)(H){1|H<1>,1|O<1>,2|C<3>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|O<2>,2|H<1>}	H(C[6]C[5,6]C[6])	117.9800	0.000	1	117.9800	0.000	1	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6a]C[5]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6a]C[5]C[6])(C[6]C[6]H)(H){1|C<4>,3|H<1>,4|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[5,6]C[6])	123.0550	0.000	1	123.0550	0.000	1	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6a]C[5]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]N)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6a]C[5]C[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<2>,1|N<3>,1|O<1>,1|S<2>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]N)(H){1|C<4>,2|C<3>,2|H<1>}	H(C[6]C[5,6]C[6])	118.3000	0.000	1	118.3000	0.000	1	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6a]C[5]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6a]C[5]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>,4|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|H<1>,3|C<3>}	H(C[6]C[5,6]C[6])	118.3640	0.355	10	118.4075	0.114	12	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6a]C[5]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6a]C[5]C[6])(C[6]C[6]H)(H){1|H<1>,1|O<1>,5|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|H<1>,3|C<3>}	H(C[6]C[5,6]C[6])	118.6250	0.089	2	118.4075	0.114	12	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6a]C[6,6a]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]O)(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6a]C[6,6a]C[5])(C[6]C[6]H)(H){1|H<1>,1|O<1>,6|C<3>}	C[6](C[6]C[6,6a]O)(C[6]C[5,6]H)(H){1|C<4>,3|C<3>}	H(C[6]C[5,6]C[6])	118.3350	0.051	2	118.2000	0.056	3	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6a]C[6,6a]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]O)(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6a]C[6,6a]C[5])(C[6]C[6]H)(H){1|O<1>,6|C<3>}	C[6](C[6]C[6,6a]O)(C[6]C[5,6]H)(H){4|C<3>}	H(C[6]C[5,6]C[6])	117.9300	0.000	1	118.2000	0.056	3	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6a]C[6,6a]N[5])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]O)(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6a]C[6,6a]N[5])(C[6]C[6]H)(H){1|O<1>,5|C<3>}	C[6](C[6]C[6,6a]O)(C[6]C[5,6]H)(H){1|N<2>,3|C<3>}	H(C[6]C[5,6]C[6])	117.8935	0.058	4	117.8935	0.003	4	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6a]C[6]O[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6a]C[6]O[5])(C[6]C[6]H)(H){1|H<1>,1|O<1>,4|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|H<1>,1|O<2>,2|C<3>}	H(C[6]C[5,6]C[6])	118.9528	0.117	4	118.9528	0.014	4	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5]2C[6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]Cl)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5]2C[6])(C[6]C[6]H)(H){1|Cl<1>,1|C<4>,1|O<1>,4|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]Cl)(H){1|H<1>,3|C<3>}	H(C[6]C[5,6]C[6])	119.8620	0.000	1	119.8620	0.000	1	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5]2C[6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5]2C[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<1>,4|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|H<1>,3|C<3>}	H(C[6]C[5,6]C[6])	122.4180	0.000	1	119.6732	3.503	4	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5]2C[6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5]2C[6])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|O<1>,4|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<4>,3|C<3>}	H(C[6]C[5,6]C[6])	119.2990	0.000	1	119.6732	3.503	4	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5]2C[6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5]2C[6])(C[6]C[6]H)(H){1|H<1>,1|N<2>,5|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|H<1>,3|C<3>}	H(C[6]C[5,6]C[6])	118.4880	0.161	2	119.6732	3.503	4	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5]2C[6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5]2C[6])(C[6]C[6]H)(H){1|C<4>,1|O<1>,2|H<1>,3|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|H<1>,3|C<3>}	H(C[6]C[5,6]C[6])	117.8920	0.004	2	118.3117	0.929	14	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5]2C[6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5]2C[6])(C[6]C[6]H)(H){1|C<4>,1|O<1>,3|C<3>,3|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[5,6]C[6])	117.9138	0.258	6	118.3117	0.929	14	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5]2C[6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5]2C[6])(C[6]C[6]H)(H){1|N<3>,1|O<1>,1|O<2>,4|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|H<1>,3|C<3>}	H(C[6]C[5,6]C[6])	118.6560	0.000	1	118.3117	0.929	14	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5]2C[6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5]2C[6])(C[6]C[6]H)(H){1|N<3>,1|O<1>,3|C<3>,3|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[5,6]C[6])	117.9925	0.063	2	118.3117	0.929	14	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5]2C[6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5]2C[6])(C[6]C[6]H)(H){1|O<1>,1|O<2>,2|C<3>,2|C<4>,3|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[5,6]C[6])	117.6080	0.000	1	118.3117	0.929	14	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5]2C[6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5]2C[6])(C[6]C[6]H)(H){1|O<1>,3|H<1>,4|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[5,6]C[6])	120.4240	0.834	2	118.3117	0.929	14	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5]C[6]N[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5]C[6]N[5])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<1>,4|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[5,6]C[6])	119.4740	0.120	2	119.4137	0.066	10	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5]C[6]N[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5]C[6]N[5])(C[6]C[6]H)(H){1|C<4>,1|O<1>,2|H<1>,3|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[5,6]C[6])	119.6037	0.241	3	119.4137	0.066	10	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5]C[6]N[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5]C[6]N[5])(C[6]C[6]H)(H){1|C<4>,1|O<2>,2|H<1>,4|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[5,6]C[6])	119.4690	0.000	1	119.4137	0.066	10	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5]C[6]N[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5]C[6]N[5])(C[6]C[6]H)(H){1|H<1>,1|O<1>,2|C<4>,3|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[5,6]C[6])	119.2272	0.263	4	119.4137	0.066	10	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5]C[6]N[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5]C[6]N[5])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<1>,4|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[5,6]C[6])	118.4181	0.225	10	118.4984	0.061	22	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5]C[6]N[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5]C[6]N[5])(C[6]C[6]H)(H){1|C<4>,1|N<3>,2|C<3>,2|O<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|H<1>,1|N<2>,2|C<3>}	H(C[6]C[5,6]C[6])	118.7320	0.000	1	118.4984	0.061	22	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5]C[6]N[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5]C[6]N[5])(C[6]C[6]H)(H){1|C<4>,2|C<3>,2|O<1>,3|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[5,6]C[6])	118.4185	0.110	2	118.4984	0.061	22	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5]C[6]N[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5]C[6]N[5])(C[6]C[6]H)(H){1|Cl<1>,1|C<4>,1|O<1>,4|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[5,6]C[6])	118.3050	0.000	1	118.4984	0.061	22	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5]C[6]N[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5]C[6]N[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>,2|O<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|H<1>,1|N<2>,2|C<3>}	H(C[6]C[5,6]C[6])	118.5325	0.303	2	118.4984	0.061	22	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5]C[6]N[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5]C[6]N[5])(C[6]C[6]H)(H){1|H<1>,1|O<1>,4|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|H<1>,1|N<2>,2|C<3>}	H(C[6]C[5,6]C[6])	118.6225	0.144	2	118.4984	0.061	22	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5]C[6]N[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5]C[6]N[5])(C[6]C[6]H)(H){1|O<1>,2|C<4>,2|H<1>,3|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[5,6]C[6])	118.6497	0.367	4	118.4984	0.061	22	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5]C[6]O[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]C)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5]C[6]O[5])(C[6]C[6]H)(H){1|H<1>,1|O<2>,2|C<3>,4|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]C)(H){1|O<2>,3|C<4>}	H(C[6]C[5,6]C[6])	120.1890	0.000	1	120.1890	0.000	1	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5]C[6]O[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5]C[6]O[5])(C[6]C[6]H)(H){1|C<3>,1|O<1>,2|C<4>,3|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[5,6]C[6])	118.2215	0.222	4	118.7609	0.811	17	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5]C[6]O[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5]C[6]O[5])(C[6]C[6]H)(H){1|C<3>,1|O<1>,2|H<1>,3|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[5,6]C[6])	120.9665	0.156	2	118.7609	0.811	17	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5]C[6]O[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5]C[6]O[5])(C[6]C[6]H)(H){1|C<3>,1|O<1>,3|C<4>,3|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|O<2>,2|C<4>,2|H<1>}	H(C[6]C[5,6]C[6])	118.0460	0.000	1	118.7609	0.811	17	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5]C[6]O[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5]C[6]O[5])(C[6]C[6]H)(H){1|H<1>,1|O<1>,2|C<4>,3|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[5,6]C[6])	118.9675	0.692	2	118.7609	0.811	17	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5]C[6]O[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5]C[6]O[5])(C[6]C[6]H)(H){1|H<1>,1|O<1>,4|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|H<1>,1|O<2>,2|C<3>}	H(C[6]C[5,6]C[6])	118.5710	0.113	6	118.7609	0.811	17	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5]C[6]O[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5]C[6]O[5])(C[6]C[6]H)(H){1|O<1>,3|C<3>,3|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[5,6]C[6])	118.3545	0.470	2	118.7609	0.811	17	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5]O[5]O[6])(C[6]C[6]H)(H)	C[6](C[6]C[4,6]N)(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5]O[5]O[6])(C[6]C[6]H)(H){1|N<2>,2|H<1>,3|C<4>}	C[6](C[6]C[4,6]N)(C[6]C[5,6]H)(H){2|O<2>,3|C<4>}	H(C[6]C[5,6]C[6])	118.7160	0.242	2	118.7160	0.058	2	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[6,6]O[5]2)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6,6]O)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[6,6]O[5]2)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>,3|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6,6]O)(H){1|C<3>,2|C<4>,2|O<2>}	H(C[6]C[5,6]C[6])	118.1187	0.152	3	118.1187	0.023	3	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[6,6a]C[5]N[5])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]O)(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[6,6a]C[5]N[5])(C[6]C[6]H)(H){1|N<3>,1|O<1>,2|C<4>,4|C<3>}	C[6](C[6]C[6,6a]O)(C[6]C[5,6]H)(H){1|C<4>,1|N<3>,2|C<3>}	H(C[6]C[5,6]C[6])	117.9030	0.263	2	117.9030	0.069	2	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[6]N[5]2)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[6]N[5]2)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<1>,3|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[5,6]C[6])	118.7640	0.055	5	118.7640	0.003	5	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[6]N[5]O[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[6]N[5]O[5])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>,1|S<4>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[5,6]C[6])	118.4885	0.036	2	118.5480	0.007	4	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[6]N[5]O[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[6]N[5]O[5])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<1>,3|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[5,6]C[6])	118.6075	0.067	2	118.5480	0.007	4	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]C[5]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]C[5]C[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<1>,4|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]O)(H){1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[5,6]C[6])	118.6363	0.089	4	118.6363	0.008	4	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]C[6a]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]C[6a]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<2>,1|O<1>,4|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[5,6]C[6])	120.1140	0.000	1	120.1140	0.000	1	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]O[5,6]C[5]C)(C[6]C[6]H)(H)	C[6](C[6]C[5,5,6]O)(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]O[5,6]C[5]C)(C[6]C[6]H)(H){1|O<1>,2|C<4>,2|H<1>}	C[6](C[6]C[5,5,6]O)(C[6]C[5,6]H)(H){1|O<2>,4|C<4>}	H(C[6]C[5,6]C[6])	119.7640	0.000	1	119.7640	0.000	1	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]O[5,6]C[5]C)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[5,6]O)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]O[5,6]C[5]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[5,6]O)(H){1|C<2>,1|N<3>,1|O<2>,2|C<4>}	H(C[6]C[5,6]C[6])	120.4550	0.006	2	119.8837	0.979	3	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]O[5,6]C[5]C)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[5,6]O)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]O[5,6]C[5]C)(C[6]C[6]H)(H){1|C<4>,1|O<1>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[5,6]O)(H){1|C<4>,1|H<1>,1|O<2>,2|C<3>}	H(C[6]C[5,6]C[6])	118.7410	0.000	1	119.8837	0.979	3	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]O[5,6]C[5]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,5,6]O)(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]O[5,6]C[5]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<1>,2|H<1>}	C[6](C[6]C[5,5,6]O)(C[6]C[5,6]H)(H){1|C<3>,1|H<1>,1|O<2>,2|C<4>}	H(C[6]C[5,6]C[6])	120.1880	0.000	1	120.0840	0.022	2	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]O[5,6]C[5]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,5,6]O)(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]O[5,6]C[5]H)(C[6]C[6]H)(H){1|O<1>,2|C<4>,2|H<1>}	C[6](C[6]C[5,5,6]O)(C[6]C[5,6]H)(H){1|H<1>,1|O<2>,3|C<4>}	H(C[6]C[5,6]C[6])	119.9800	0.000	1	120.0840	0.022	2	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]O[5,6]C[5]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6,6]O)(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]O[5,6]C[5]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>,2|C<4>}	C[6](C[6]C[5,6,6]O)(C[6]C[5,6]H)(H){1|C<3>,1|H<1>,1|O<2>,2|C<4>}	H(C[6]C[5,6]C[6])	120.2390	0.000	1	120.2390	0.000	1	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]Si[5,5]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]Si[5,5]C[5,6]H)(C[6]C[6]H)(H){1|H<1>,1|O<2>,2|C<3>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Si<4>,1|C<3>,2|H<1>}	H(C[6]C[5,6]C[6])	119.7370	0.000	1	119.7370	0.000	1	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]Si[5,6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]Si[5,6]C[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>,3|N<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Si<4>,1|C<3>,2|H<1>}	H(C[6]C[5,6]C[6])	121.5560	0.000	1	121.5560	0.000	1	120.2615	1.519	1018	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]O)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(O)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]O)(H){1|H<1>,1|O<2>,2|C<3>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(O){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[5,6]C[6])	123.1080	0.000	1	123.1080	0.000	1	123.1080	0.000	1	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6a]C[5]C[6])(C[6]N[6]H)(H)	C[6](C[6]C[5,6]H)(N[6]C[6]S)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6a]C[5]C[6])(C[6]N[6]H)(H){1|H<1>,1|N<3>,1|O<1>,1|S<4>,3|C<3>}	C[6](C[6]C[5,6]H)(N[6]C[6]S)(H){1|H<1>,3|C<3>}	H(C[6]C[5,6]C[6])	117.8585	0.070	2	117.8585	0.005	2	117.8585	0.005	2	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]N[5,6]H)(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,6,6]C[5])(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]N[5,6]H)(C[6]C[5,6]H)(H){1|C<3>,2|H<1>,3|C<4>}	C[6](C[5,6]C[5,6,6]C[5])(C[6]C[6,6]H)(H){1|C<3>,1|N<3>,1|O<2>,2|C<4>,2|H<1>}	H(C[6]C[6,6]C[6])	118.5640	0.000	1	118.5640	0.000	1	118.5640	0.000	1	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6,6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6,6]C[5,6]C[6,6]H)(C[6]C[6,6]Br)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]H)(Br)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6]C[6,6]H)(C[6]C[6,6]Br)(H){1|C<3>,2|H<1>,4|C<4>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]H)(Br){1|C<3>,2|H<1>,4|C<4>}	H(C[6]C[6,6]C[6])	118.3090	0.000	1	118.3090	0.000	1	118.3090	0.000	1	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6,6]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6,6]C[5,6]C[6,6]H)(C[6]C[6,6]Cl)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]H)(Cl)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6]C[6,6]H)(C[6]C[6,6]Cl)(H){1|C<3>,2|H<1>,4|C<4>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]H)(Cl){1|C<3>,2|H<1>,4|C<4>}	H(C[6]C[6,6]C[6])	118.7910	0.000	1	118.7910	0.000	1	118.7910	0.000	1	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[5,6]C[6,6]H)(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6]C[6,6]H)(C[6]C[6,6]H)(H){1|C<3>,1|H<1>,1|O<2>,4|C<4>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]H)(H){1|C<3>,2|H<1>,4|C<4>}	H(C[6]C[6,6]C[6])	118.3030	0.000	1	118.6135	0.095	12	119.3409	2.543	20	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[5,6]C[6,6]H)(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6]C[6,6]H)(C[6]C[6,6]H)(H){1|C<3>,2|H<1>,4|C<4>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]H)(H){1|C<3>,2|H<1>,4|C<4>}	H(C[6]C[6,6]C[6])	118.5296	0.339	5	118.6135	0.095	12	119.3409	2.543	20	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[5,6]C[6,6]H)(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6]C[6,6]H)(C[6]C[6,6]H)(H){1|C<3>,2|H<1>,4|C<4>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]H)(H){1|C<3>,3|C<4>,3|H<1>}	H(C[6]C[6,6]C[6])	118.6223	0.205	4	118.6135	0.095	12	119.3409	2.543	20	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[5,6]C[6,6]H)(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6]C[6,6]H)(C[6]C[6,6]H)(H){1|C<3>,2|H<1>,4|C<4>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]H)(H){2|C<3>,2|H<1>,3|C<4>}	H(C[6]C[6,6]C[6])	118.7480	0.000	1	118.6135	0.095	12	119.3409	2.543	20	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[5,6]C[6,6]H)(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6]C[6,6]H)(C[6]C[6,6]H)(H){1|Cl<1>,1|H<1>,2|C<3>,3|C<4>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]H)(H){2|C<3>,2|H<1>,3|C<4>}	H(C[6]C[6,6]C[6])	119.1740	0.000	1	118.6135	0.095	12	119.3409	2.543	20	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]2H)(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6]2)(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2H)(C[6]C[6,6]H)(H){1|C<3>,6|C<4>}	C[6](C[6,6]C[6,6]2)(C[6]C[6,6]H)(H){1|H<1>,6|C<4>}	H(C[6]C[6,6]C[6])	118.3045	0.247	2	118.3045	0.061	2	119.3409	2.543	20	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]Cr)(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6]O[6])(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]Cr)(C[6]C[6,6]H)(H){1|C<3>,1|H<1>,1|O<2>,2|C<4>}	C[6](C[6,6]C[6,6]O[6])(C[6]C[6,6]H)(H){1|Cr<9>,1|C<3>,3|C<4>}	H(C[6]C[6,6]C[6])	122.7083	1.252	3	122.7083	1.568	3	119.3409	2.543	20	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6,6]H)(H)	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6,6]H)(H){2|C<3>,2|H<1>,3|C<4>}	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6,6]H)(H){2|H<1>,5|C<4>}	H(C[6]C[6,6]C[6])	119.0750	0.000	1	119.0750	0.000	1	119.3409	2.543	20	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6,6]H)(H){2|C<3>,5|C<4>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6,6]H)(H){1|H<1>,1|O<1>,2|C<3>,2|C<4>}	H(C[6]C[6,6]C[6])	120.5370	0.000	1	120.5370	0.000	1	119.3409	2.543	20	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]O[6]O)(C[6]C[6,6]H)(H)	C[6](C[6,6]C[3x6]C[6])(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]O[6]O)(C[6]C[6,6]H)(H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6,6]C[3x6]C[6])(C[6]C[6,6]H)(H){1|C<3>,1|H<1>,1|N<3>,2|C<4>,2|O<2>}	H(C[6]C[6,6]C[6])	119.1110	0.000	1	119.1110	0.000	1	119.3409	2.543	20	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6,6]C[6]2O[6])(C[6]C[6,6a]Br)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(Br)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6]2O[6])(C[6]C[6,6a]Br)(H){1|C<4>,1|O<1>,2|H<1>,3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(Br){1|C<4>,1|H<1>,1|O<2>,3|C<3>}	H(C[6]C[6,6]C[6])	119.5940	0.000	1	119.5940	0.000	1	119.5940	0.000	1	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[3x6]C[6]Ru)(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6,6a]C[6a])(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[3x6]C[6]Ru)(C[6]C[6,6a]H)(H){1|H<1>,2|C<3>,2|C<4>}	C[6](C[6,6a]C[6,6,6a]C[6a])(C[6]C[6,6]H)(H){1|Ru<11>,1|H<1>,2|C<3>,2|C<4>}	H(C[6]C[6,6]C[6])	119.4120	0.137	2	119.4120	0.019	2	119.5157	1.306	40	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[5,6,6]C[6,6a]H)(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6,6]C[6,6a]H)(C[6]C[6,6a]H)(H){1|N<3>,5|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6,6]C[6])	119.0450	0.590	3	119.0450	0.348	3	119.5157	1.306	40	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[5,6,6]C[6]Ru)(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[5,6,6a]C[6a])(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6,6]C[6]Ru)(C[6]C[6,6a]H)(H){1|H<1>,2|C<3>,2|C<4>}	C[6](C[6,6a]C[5,6,6a]C[6a])(C[6]C[6,6]H)(H){1|Ru<12>,1|H<1>,2|C<3>,2|C<4>}	H(C[6]C[6,6]C[6])	119.9185	0.250	4	119.9185	0.062	4	119.5157	1.306	40	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[5,6]C[6,6]H)(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6]C[6,6]H)(C[6]C[6,6a]H)(H){1|H<1>,1|O<2>,2|C<3>,3|C<4>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H){2|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6,6]C[6])	118.9680	0.000	1	118.9680	0.000	1	119.5157	1.306	40	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6,6a]C[6,6]C)(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a,6a]C[6a])(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6,6a]C[6,6]C)(C[6]C[6,6a]H)(H){1|C<4>,5|C<3>}	C[6](C[6,6a]C[6,6a,6a]C[6a])(C[6]C[6,6]H)(H){1|H<1>,2|C<4>,3|C<3>}	H(C[6]C[6,6]C[6])	118.4460	0.300	2	118.4460	0.090	2	119.5157	1.306	40	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]Cr)(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]Cr)(C[6]C[6,6a]H)(H){1|H<1>,2|C<3>,2|C<4>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H){1|Cr<9>,1|O<2>,2|C<3>,2|C<4>}	H(C[6]C[6,6]C[6])	119.4893	0.250	3	119.5063	0.026	6	119.5157	1.306	40	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]Cr)(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]Cr)(C[6]C[6,6a]H)(H){1|O<2>,2|C<3>,2|C<4>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H){1|Cr<9>,1|H<1>,2|C<3>,2|C<4>}	H(C[6]C[6,6]C[6])	119.5233	0.047	3	119.5063	0.026	6	119.5157	1.306	40	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6,6a]H)(H){2|C<3>,2|H<1>,3|C<4>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H){2|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6,6]C[6])	119.8020	0.000	1	120.0205	0.095	2	119.5157	1.306	40	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6,6a]H)(H){2|C<3>,5|C<4>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H){2|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6,6]C[6])	120.2390	0.000	1	120.0205	0.095	2	119.5157	1.306	40	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]N[6a])(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6,6a]H)(H){1|B<3>,1|H<1>,1|N<2>,3|C<3>}	C[6](C[6,6a]C[6,6a]N[6a])(C[6]C[6,6]H)(H){1|C<4>,1|H<1>,3|C<3>}	H(C[6]C[6,6]C[6])	119.4370	0.000	1	119.4370	0.000	1	119.5157	1.306	40	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]Rh)(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]Rh)(C[6]C[6,6a]H)(H){1|H<1>,2|C<3>,2|C<4>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H){1|Rh<10>,1|H<1>,2|C<3>,2|C<4>}	H(C[6]C[6,6]C[6])	119.7720	0.000	1	119.7720	0.000	1	119.5157	1.306	40	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]Ru)(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]Ru)(C[6]C[6,6a]H)(H){1|H<1>,2|C<3>,2|C<4>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H){1|Ru<10>,1|H<1>,2|C<3>,2|C<4>}	H(C[6]C[6,6]C[6])	117.4370	0.000	1	117.4370	0.000	1	119.5157	1.306	40	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6a]C[6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6a]C[6])(C[6]C[6,6a]H)(H){1|H<1>,1|O<2>,6|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H){1|C<4>,1|H<1>,4|C<3>}	H(C[6]C[6,6]C[6])	118.5015	0.032	2	118.5015	0.001	2	119.5157	1.306	40	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6a]2O[6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]2O[6])(C[6]C[6,6a]H)(H){6|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H){1|H<1>,1|O<2>,4|C<3>}	H(C[6]C[6,6]C[6])	119.3250	0.000	1	119.3250	0.000	1	119.5157	1.306	40	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6a]2O[6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]2O[6])(C[6]C[6,6a]H)(H){6|C<3>}	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6,6]H)(H){1|O<2>,5|C<3>}	H(C[6]C[6,6]C[6])	119.6835	0.105	2	119.6835	0.011	2	119.5157	1.306	40	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6a]C[6,6]H)(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]C[6,6]H)(C[6]C[6,6a]H)(H){1|H<1>,1|N<3>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6,6]C[6])	118.8370	0.000	1	118.8370	0.000	1	119.5157	1.306	40	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6]2O[6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6]2O[6])(C[6]C[6,6a]H)(H){1|C<4>,3|C<3>,4|H<1>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H){1|H<1>,1|O<2>,2|C<3>,2|C<4>}	H(C[6]C[6,6]C[6])	119.8080	0.000	1	119.8080	0.000	1	119.5157	1.306	40	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6]N[6]2)(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6]N[6]2)(C[6]C[6,6a]H)(H){1|N<2>,2|H<1>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H){1|H<1>,2|N<3>,3|C<3>}	H(C[6]C[6,6]C[6])	118.8320	0.000	1	118.6080	0.100	2	119.5157	1.306	40	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6]N[6]2)(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6]N[6]2)(C[6]C[6,6a]H)(H){1|O<1>,2|H<1>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H){1|H<1>,2|N<3>,3|C<3>}	H(C[6]C[6,6]C[6])	118.3840	0.000	1	118.6080	0.100	2	119.5157	1.306	40	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6]O[6]2)(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6]O[6]2)(C[6]C[6,6a]H)(H){1|C<4>,2|H<1>,3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H){1|C<4>,1|H<1>,2|C<3>,2|O<2>}	H(C[6]C[6,6]C[6])	119.1890	0.000	1	121.4330	10.071	2	119.5157	1.306	40	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6]O[6]2)(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6]O[6]2)(C[6]C[6,6a]H)(H){1|H<1>,2|C<4>,3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H){1|C<4>,1|H<1>,2|C<3>,2|O<2>}	H(C[6]C[6,6]C[6])	123.6770	0.000	1	121.4330	10.071	2	119.5157	1.306	40	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]N[6,6]C[6]H)(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6]H)(C[6]C[6,6a]H)(H){1|N<3>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6,6]C[6])	119.5340	0.436	3	119.5340	0.190	3	119.5157	1.306	40	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]N[6,6]O[6]H)(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]O[6]H)(C[6]C[6,6a]H)(H){1|C<4>,3|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(H){1|N<3>,1|O<2>,2|C<3>,2|H<1>}	H(C[6]C[6,6]C[6])	120.7960	2.618	3	120.7960	6.855	3	119.5157	1.306	40	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:B[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]Cr)(C[6]B[6]H)(H)	C[6](C[6]C[6,6]H)(B[6]N[6]C)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]Cr)(C[6]B[6]H)(H){1|H<1>,1|N<3>,3|C<4>}	C[6](C[6]C[6,6]H)(B[6]N[6]C)(H){1|Cr<9>,1|H<1>,2|C<4>}	H(C[6]C[6,6]C[6])	119.2030	0.375	2	119.2030	0.140	2	119.2030	0.140	2	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6,6]C[6,6]2C)(C[6]C[6]Br)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(Br)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2C)(C[6]C[6]Br)(H){1|Cl<1>,1|C<3>,1|O<1>,3|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]O)(Br){1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6,6]C[6])	118.4265	0.192	2	118.4265	0.037	2	118.4310	0.013	4	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6,6]C[6,6]2H)(C[6]C[6]Br)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(Br)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2H)(C[6]C[6]Br)(H){1|O<1>,2|H<1>,4|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]O)(Br){2|C<4>,3|H<1>}	H(C[6]C[6,6]C[6])	118.4355	0.049	2	118.4355	0.002	2	118.4310	0.013	4	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[3,6,6]C[6,6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[3,6,6]C[6,6]C)(C[6]C[6]H)(H){1|C<3>,1|O<1>,1|O<2>,3|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6,6]C[6])	117.9200	0.314	2	117.9200	0.099	2	118.7329	1.258	261	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[4,6,6]N[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[4,6]O)(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[4,6,6]N[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>,1|S<4>,2|C<4>}	C[6](C[6]C[4,6]O)(C[6]C[6,6]H)(H){1|H<1>,1|N<3>,3|C<4>}	H(C[6]C[6,6]C[6])	117.7910	0.000	1	117.7910	0.000	1	118.7329	1.258	261	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[5,6,6]C[6,6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6,6]C[6,6]C)(C[6]C[6]H)(H){1|H<1>,1|O<1>,1|O<2>,4|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){5|C<4>}	H(C[6]C[6,6]C[6])	117.7280	0.096	2	117.7280	0.009	2	118.7329	1.258	261	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[5,6,6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6,6]C[6]C)(C[6]C[6]H)(H){1|C<4>,2|C<3>,4|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6,6]H)(H){4|C<4>}	H(C[6]C[6,6]C[6])	120.4740	0.000	1	120.4740	0.000	1	118.7329	1.258	261	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[5,6,6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6,6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6,6]H)(H){1|Ru<11>,1|C<3>,2|C<4>}	H(C[6]C[6,6]C[6])	120.0550	0.000	1	120.0550	0.000	1	118.7329	1.258	261	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[5,6,6]O[6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6,6]O[6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<4>,1|O<2>,2|H<1>}	H(C[6]C[6,6]C[6])	119.9510	0.000	1	119.9510	0.000	1	118.7329	1.258	261	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[5,6,6]O[6]O)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]O)(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6,6]O[6]O)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>,2|C<4>}	C[6](C[6]C[5,6]O)(C[6]C[6,6]H)(H){1|C<3>,2|C<4>,2|O<2>}	H(C[6]C[6,6]C[6])	118.0350	0.000	1	118.0350	0.000	1	118.7329	1.258	261	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[5,6]C[5x6]H)(C[6]C[6]H)(H)	C[6](C[6]C[3x6]H)(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6]C[5x6]H)(C[6]C[6]H)(H){2|C<4>,2|H<1>,3|C<3>}	C[6](C[6]C[3x6]H)(C[6]C[6,6]H)(H){1|Si<4>,1|H<1>,2|C<4>}	H(C[6]C[6,6]C[6])	119.4090	0.000	1	119.4090	0.000	1	118.7329	1.258	261	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[5,6]C[6,6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6]C[6,6]C)(C[6]C[6]H)(H){1|O<1>,2|H<1>,4|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){5|C<4>}	H(C[6]C[6,6]C[6])	117.5830	0.272	3	117.5830	0.074	3	118.7329	1.258	261	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[5,6]C[6,6]O)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6,6]O)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6]C[6,6]O)(C[6]C[6]H)(H){1|O<1>,2|C<4>,2|H<1>,2|O<2>}	C[6](C[6]C[6,6]H)(C[6]C[6,6]O)(H){1|H<1>,1|O<2>,3|C<4>}	H(C[6]C[6,6]C[6])	118.4930	0.000	1	118.4930	0.000	1	118.7329	1.258	261	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[5,6]N[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6]N[6,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,4|C<3>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<4>,1|N<3>,2|H<1>}	H(C[6]C[6,6]C[6])	118.5430	0.000	1	118.5430	0.000	1	118.7329	1.258	261	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6,6a]O[6]O)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]O)(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6,6a]O[6]O)(C[6]C[6]H)(H){1|O<1>,3|C<3>}	C[6](C[6]C[6,6a]O)(C[6]C[6,6]H)(H){2|C<3>,2|O<2>}	H(C[6]C[6,6]C[6])	119.2825	0.211	2	119.2825	0.045	2	118.7329	1.258	261	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]2C)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]N)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2C)(C[6]C[6]H)(H){1|N<2>,2|H<1>,4|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]N)(H){2|H<1>,3|C<4>}	H(C[6]C[6,6]C[6])	118.0010	0.000	1	118.0010	0.000	1	118.7329	1.258	261	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]2C)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2C)(C[6]C[6]H)(H){1|Br<1>,1|C<3>,1|O<1>,3|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6,6]C[6])	117.5615	0.049	2	118.1129	0.498	69	118.7329	1.258	261	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]2C)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2C)(C[6]C[6]H)(H){1|C<3>,1|F<1>,1|O<1>,3|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6,6]C[6])	117.7929	0.365	8	118.1129	0.498	69	118.7329	1.258	261	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]2C)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>,3|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6,6]C[6])	117.7917	0.642	23	118.1129	0.498	69	118.7329	1.258	261	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]2C)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>,3|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|C<3>,4|C<4>}	H(C[6]C[6,6]C[6])	119.0770	0.207	3	118.1129	0.498	69	118.7329	1.258	261	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]2C)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2C)(C[6]C[6]H)(H){1|C<3>,1|O<1>,2|H<1>,3|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){5|C<4>}	H(C[6]C[6,6]C[6])	118.6933	0.510	3	118.1129	0.498	69	118.7329	1.258	261	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]2C)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2C)(C[6]C[6]H)(H){1|Cl<1>,1|C<3>,1|O<1>,3|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6,6]C[6])	117.7597	0.111	4	118.1129	0.498	69	118.7329	1.258	261	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]2C)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2C)(C[6]C[6]H)(H){1|Cl<1>,1|C<4>,1|O<1>,3|C<3>}	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6,6]C[6])	118.0100	0.000	1	118.1129	0.498	69	118.7329	1.258	261	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]2C)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2C)(C[6]C[6]H)(H){1|F<1>,1|O<1>,2|C<3>,2|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6,6]C[6])	118.0190	0.059	2	118.1129	0.498	69	118.7329	1.258	261	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]2C)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2C)(C[6]C[6]H)(H){1|H<1>,1|O<1>,2|C<3>,2|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6,6]C[6])	117.5796	0.372	5	118.1129	0.498	69	118.7329	1.258	261	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]2C)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2C)(C[6]C[6]H)(H){1|H<1>,1|O<1>,2|C<3>,2|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|C<3>,4|C<4>}	H(C[6]C[6,6]C[6])	119.2420	0.000	1	118.1129	0.498	69	118.7329	1.258	261	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]2C)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2C)(C[6]C[6]H)(H){1|O<1>,2|C<3>,2|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6,6]C[6])	117.7440	0.000	1	118.1129	0.498	69	118.7329	1.258	261	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]2C)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2C)(C[6]C[6]H)(H){1|O<1>,2|H<1>,4|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){2|H<1>,3|C<4>}	H(C[6]C[6,6]C[6])	117.8490	0.000	1	118.1129	0.498	69	118.7329	1.258	261	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]2C)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2C)(C[6]C[6]H)(H){1|O<1>,2|H<1>,4|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){5|C<4>}	H(C[6]C[6,6]C[6])	118.7988	0.572	15	118.1129	0.498	69	118.7329	1.258	261	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]2H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2H)(C[6]C[6]H)(H){1|C<3>,1|O<1>,5|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6,6]C[6])	118.0445	0.330	4	118.1068	0.078	6	118.7329	1.258	261	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]2H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2H)(C[6]C[6]H)(H){1|O<1>,2|H<1>,4|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){2|C<4>,3|H<1>}	H(C[6]C[6,6]C[6])	118.2315	0.122	2	118.1068	0.078	6	118.7329	1.258	261	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]2O)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2O)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>,3|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[6,6]C[6])	117.8890	0.000	1	117.8890	0.000	1	118.7329	1.258	261	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]2Rh)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2Rh)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Rh<9>,1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6,6]C[6])	119.6750	0.000	1	119.6750	0.000	1	118.7329	1.258	261	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]As[6]Mo)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]As[6]Mo)(C[6]C[6]H)(H){1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|As<3>,1|Mo<9>,1|C<4>,1|H<1>}	H(C[6]C[6,6]C[6])	120.1900	0.000	1	120.1900	0.000	1	118.7329	1.258	261	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(H){1|C<4>,2|C<3>,4|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<3>,3|C<4>}	H(C[6]C[6,6]C[6])	119.6210	0.000	1	119.6210	0.000	1	118.7329	1.258	261	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]N)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|N<2>,2|C<4>,2|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]N)(H){1|C<3>,3|C<4>}	H(C[6]C[6,6]C[6])	117.6753	0.441	4	117.6753	0.195	4	118.7329	1.258	261	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|O<1>,2|C<4>,2|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|C<3>,3|C<4>}	H(C[6]C[6,6]C[6])	117.8016	0.153	5	117.9452	0.219	13	118.7329	1.258	261	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|O<1>,2|C<4>,3|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|C<3>,3|C<4>}	H(C[6]C[6,6]C[6])	118.3360	0.000	1	117.9452	0.219	13	118.7329	1.258	261	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|O<1>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|C<3>,3|C<4>}	H(C[6]C[6,6]C[6])	117.9020	0.389	4	117.9452	0.219	13	118.7329	1.258	261	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(H){1|H<1>,2|O<1>,3|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|C<3>,4|C<4>}	H(C[6]C[6,6]C[6])	118.6415	0.227	2	117.9452	0.219	13	118.7329	1.258	261	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(H){1|O<1>,2|H<1>,4|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){2|O<2>,3|C<4>}	H(C[6]C[6,6]C[6])	117.0530	0.000	1	117.9452	0.219	13	118.7329	1.258	261	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]O)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(H){1|N<3>,1|O<1>,1|O<2>,2|C<4>,2|H<1>}	C[6](C[6]C[6,6]H)(C[6]N[6]O)(H){1|C<3>,1|S<4>,2|C<4>}	H(C[6]C[6,6]C[6])	123.9860	0.000	1	123.9860	0.000	1	118.7329	1.258	261	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]O[6]O)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|O<1>,1|O<2>,2|C<4>,2|H<1>}	C[6](C[6]C[6,6]H)(C[6]O[6]O)(H){3|C<4>}	H(C[6]C[6,6]C[6])	120.0650	0.143	2	120.0650	0.020	2	118.7329	1.258	261	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]Ce)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]Ce)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Ce<16>,1|H<1>,2|C<4>}	H(C[6]C[6,6]C[6])	118.9245	0.042	2	118.9245	0.002	2	118.7329	1.258	261	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]Cr)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]C)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]Cr)(C[6]C[6]H)(H){1|O<2>,2|C<3>,2|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]C)(H){1|Cr<9>,1|H<1>,2|C<4>}	H(C[6]C[6,6]C[6])	119.4310	0.033	3	119.4310	0.001	3	118.7329	1.258	261	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]Cr)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]Cr)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>,2|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Cr<9>,1|H<1>,2|C<4>}	H(C[6]C[6,6]C[6])	120.0015	0.011	2	120.0015	0.000	2	118.7329	1.258	261	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]Cr)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]N)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]Cr)(C[6]C[6]H)(H){1|C<3>,1|N<2>,1|O<2>,2|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]N)(H){1|Cr<9>,1|H<1>,2|C<4>}	H(C[6]C[6,6]C[6])	119.3680	0.000	1	119.3680	0.000	1	118.7329	1.258	261	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]Dy)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]Dy)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Dy<16>,1|H<1>,2|C<4>}	H(C[6]C[6,6]C[6])	119.0410	0.021	2	119.0410	0.000	2	118.7329	1.258	261	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]F)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]F)(C[6]C[6]H)(H){1|C<3>,1|O<1>,2|C<4>,2|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|F<1>,1|H<1>}	H(C[6]C[6,6]C[6])	117.9530	0.142	5	117.9530	0.020	5	118.7329	1.258	261	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]Fe)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]Fe)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Fe<11>,1|H<1>,2|C<4>}	H(C[6]C[6,6]C[6])	119.7140	0.089	2	119.7140	0.008	2	118.7329	1.258	261	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6,6]O)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,2|H<1>,2|O<1>}	C[6](C[6]C[6,6]H)(C[6]C[6,6]O)(H){1|C<4>,2|C<3>,2|H<1>}	H(C[6]C[6,6]C[6])	118.7250	0.079	2	120.3000	7.445	3	118.7329	1.258	261	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6,6]O)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H){1|C<4>,1|O<1>,1|O<2>,3|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6,6]O)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6,6]C[6])	123.4500	0.000	1	120.3000	7.445	3	118.7329	1.258	261	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]C)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H){1|C<3>,2|H<1>,4|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]C)(H){2|C<4>,2|H<1>}	H(C[6]C[6,6]C[6])	120.2380	0.000	1	120.2380	0.000	1	118.7329	1.258	261	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H){1|C<3>,1|O<1>,2|C<4>,3|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|H<1>,4|C<4>}	H(C[6]C[6,6]C[6])	117.9920	0.000	1	118.0092	0.055	5	118.7329	1.258	261	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H){1|C<3>,1|O<1>,2|H<1>,3|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){2|C<4>,3|H<1>}	H(C[6]C[6,6]C[6])	117.9823	0.323	3	118.0092	0.055	5	118.7329	1.258	261	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H){1|N<3>,1|O<1>,2|C<4>,3|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){2|C<4>,3|H<1>}	H(C[6]C[6,6]C[6])	118.1070	0.000	1	118.0092	0.055	5	118.7329	1.258	261	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]Mo)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]Mo)(C[6]C[6]H)(H){1|As<3>,1|C<3>,1|C<4>,2|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Mo<9>,1|H<1>,2|C<4>}	H(C[6]C[6,6]C[6])	119.7990	0.000	1	119.9110	3.307	6	118.7329	1.258	261	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]Mo)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]Mo)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|C<4>,2|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Mo<9>,1|H<1>,2|C<4>}	H(C[6]C[6,6]C[6])	120.1780	0.000	1	119.9110	3.307	6	118.7329	1.258	261	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]Mo)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]Mo)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>,2|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Mo<9>,1|H<1>,2|C<4>}	H(C[6]C[6,6]C[6])	121.0880	2.359	2	119.9110	3.307	6	118.7329	1.258	261	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]Mo)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]Mo)(C[6]C[6]H)(H){1|C<3>,1|H<1>,3|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Mo<9>,1|H<1>,2|C<4>}	H(C[6]C[6,6]C[6])	120.2330	0.000	1	119.9110	3.307	6	118.7329	1.258	261	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]Mo)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]Mo)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Mo<9>,1|H<1>,2|C<4>}	H(C[6]C[6,6]C[6])	117.0800	0.000	1	119.9110	3.307	6	118.7329	1.258	261	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]Mo)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]Mo)(C[6]C[6]H)(H){1|N<2>,2|C<4>,2|H<1>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(H){1|Mo<9>,2|C<4>}	H(C[6]C[6,6]C[6])	120.3575	0.818	2	120.3575	0.669	2	118.7329	1.258	261	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]N)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6,6]O)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]N)(C[6]C[6]H)(H){1|N<3>,1|O<1>,2|C<4>,3|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6,6]O)(H){2|N<3>,3|C<4>}	H(C[6]C[6,6]C[6])	119.8620	0.134	2	119.8620	0.018	2	118.7329	1.258	261	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]O)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]O)(C[6]C[6]H)(H){1|C<3>,1|O<1>,2|C<4>,3|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|O<2>,2|C<4>,2|H<1>}	H(C[6]C[6,6]C[6])	116.9605	0.192	2	117.4772	0.387	6	118.7329	1.258	261	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]O)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]O)(C[6]C[6]H)(H){1|C<4>,1|O<1>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[6,6]C[6])	118.4650	0.000	1	117.4772	0.387	6	118.7329	1.258	261	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]O)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]O)(C[6]C[6]H)(H){1|N<3>,1|O<1>,2|C<4>,3|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|O<2>,2|C<4>,2|H<1>}	H(C[6]C[6,6]C[6])	117.4923	0.441	3	117.4772	0.387	6	118.7329	1.258	261	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]Re)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]Re)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Re<12>,1|H<1>,2|C<4>}	H(C[6]C[6,6]C[6])	119.7523	0.379	4	119.7727	0.087	6	118.7329	1.258	261	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]Re)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]Re)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Re<9>,1|H<1>,2|C<4>}	H(C[6]C[6,6]C[6])	119.8135	0.015	2	119.7727	0.087	6	118.7329	1.258	261	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]Rh)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]Rh)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>,2|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Rh<8>,1|H<1>,2|C<4>}	H(C[6]C[6,6]C[6])	120.3350	0.199	2	120.1963	0.098	4	118.7329	1.258	261	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]Rh)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]Rh)(C[6]C[6]H)(H){1|C<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Rh<9>,1|H<1>,2|C<4>}	H(C[6]C[6,6]C[6])	120.3550	0.000	1	120.1963	0.098	4	118.7329	1.258	261	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]Rh)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]Rh)(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Rh<7>,1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6,6]C[6])	119.7600	0.000	1	120.1963	0.098	4	118.7329	1.258	261	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]Ru)(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Ru<11>,1|H<1>,2|C<4>}	H(C[6]C[6,6]C[6])	119.9190	0.008	2	119.7225	0.117	33	118.7329	1.258	261	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Ru<10>,1|H<1>,2|C<4>}	H(C[6]C[6,6]C[6])	119.8381	0.341	8	119.7225	0.117	33	118.7329	1.258	261	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Ru<11>,1|C<2>,2|C<4>}	H(C[6]C[6,6]C[6])	119.8275	0.250	2	119.7225	0.117	33	118.7329	1.258	261	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Ru<11>,1|C<3>,2|C<4>}	H(C[6]C[6,6]C[6])	119.5890	0.000	1	119.7225	0.117	33	118.7329	1.258	261	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]Ru)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Ru<11>,1|H<1>,2|C<4>}	H(C[6]C[6,6]C[6])	119.6528	0.365	20	119.7225	0.117	33	118.7329	1.258	261	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]Y)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]Y)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Y<16>,1|H<1>,2|C<4>}	H(C[6]C[6,6]C[6])	119.3135	0.144	2	119.3135	0.021	2	118.7329	1.258	261	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6a]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6a]N[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,1|O<1>,1|S<4>,3|C<3>}	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|N<3>,2|H<1>}	H(C[6]C[6,6]C[6])	118.1980	0.000	1	118.1980	0.000	1	118.7329	1.258	261	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6a]O[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6a]O[6])(C[6]C[6]H)(H){1|H<1>,1|O<1>,1|O<2>,2|C<3>,2|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|O<2>,2|H<1>}	H(C[6]C[6,6]C[6])	117.7700	0.000	1	117.7700	0.000	1	118.7329	1.258	261	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]N[6]Mo)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]N[6]Mo)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Mo<9>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6,6]C[6])	119.4882	0.431	4	119.4490	0.147	5	118.7329	1.258	261	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]N[6]Mo)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]N[6]Mo)(C[6]C[6]H)(H){1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Mo<9>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6,6]C[6])	119.2920	0.000	1	119.4490	0.147	5	118.7329	1.258	261	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]N[6]O)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]N[6]O)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<1>,1|O<2>,2|C<3>}	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|C<4>,1|N<3>,1|O<1>,2|H<1>}	H(C[6]C[6,6]C[6])	117.9460	0.000	1	117.9460	0.000	1	118.7329	1.258	261	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]N[6]Zr)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]N[6]Zr)(C[6]C[6]H)(H){1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Zr<14>,1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6,6]C[6])	120.1960	0.000	1	120.1960	0.000	1	118.7329	1.258	261	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]O[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]O[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>,2|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|H<1>,2|C<4>,2|O<2>}	H(C[6]C[6,6]C[6])	117.6920	0.065	2	117.7594	0.064	10	118.7329	1.258	261	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]O[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]O[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>,2|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|O<2>,2|C<4>,2|H<1>}	H(C[6]C[6,6]C[6])	117.7108	0.138	4	117.7594	0.064	10	118.7329	1.258	261	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]O[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]O[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>,2|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|Se<2>,1|H<1>,1|O<2>,2|C<4>}	H(C[6]C[6,6]C[6])	117.5760	0.000	1	117.7594	0.064	10	118.7329	1.258	261	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]O[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]O[6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<1>,2|O<2>}	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|O<2>,2|C<4>,2|H<1>}	H(C[6]C[6,6]C[6])	118.2980	0.000	1	117.7594	0.064	10	118.7329	1.258	261	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]O[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]O[6]C)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>,2|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|O<2>,2|C<4>,2|H<1>}	H(C[6]C[6,6]C[6])	117.7465	0.412	2	117.7594	0.064	10	118.7329	1.258	261	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]O[6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]O[6]O)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]O[6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|O<1>,1|O<2>}	C[6](C[6]C[6,6]H)(C[6]O[6]O)(H){1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[6,6]C[6])	119.9523	0.165	3	119.9523	0.027	3	118.7329	1.258	261	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6a]2N[5a,6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]O)(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]2N[5a,6])(C[6]C[6]H)(H){1|O<1>,6|C<3>}	C[6](C[6]C[6,6a]O)(C[6]C[6,6]H)(H){1|N<3>,3|C<3>}	H(C[6]C[6,6]C[6])	117.8920	0.000	1	117.8920	0.000	1	118.7329	1.258	261	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6a]C[6,6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]C[6,6]C)(C[6]C[6]H)(H){1|H<1>,1|O<1>,2|C<3>,2|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|C<3>,4|C<4>}	H(C[6]C[6,6]C[6])	118.8240	0.000	1	118.8240	0.000	1	118.7329	1.258	261	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6a]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]N[6,6]O)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]C[6,6]H)(C[6]C[6]H)(H){1|N<3>,1|O<1>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6]H)(C[6]N[6,6]O)(H){1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6,6]C[6])	120.3310	0.000	1	120.3310	0.000	1	118.7329	1.258	261	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6a]C[6,6]O)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]C[6,6]O)(C[6]C[6]H)(H){1|H<1>,1|O<1>,2|C<3>,2|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|O<2>,2|H<1>}	H(C[6]C[6,6]C[6])	117.8433	0.211	3	117.8433	0.044	3	118.7329	1.258	261	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6a]C[6]2)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]C[6]2)(C[6]C[6]H)(H){1|C<4>,1|O<1>,3|C<3>,3|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|C<4>,1|O<2>,2|C<3>}	H(C[6]C[6,6]C[6])	118.0800	0.000	1	118.0800	0.000	1	118.7329	1.258	261	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6a]C[6]N[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]C[6]N[6])(C[6]C[6]H)(H){1|H<1>,1|O<1>,4|C<3>}	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|H<1>,1|N<2>,2|C<3>}	H(C[6]C[6,6]C[6])	121.8050	0.484	2	121.8050	0.234	2	118.7329	1.258	261	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6a]C[6]P[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]C[6]P[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>,1|O<2>,4|C<3>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|H<1>,1|P<4>,2|C<3>}	H(C[6]C[6,6]C[6])	120.2350	0.000	1	120.2350	0.000	1	118.7329	1.258	261	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6a]N[5a,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]N[5a,6]C[6])(C[6]C[6]H)(H){1|H<1>,1|O<1>,5|C<3>}	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6,6]C[6])	118.4808	0.173	4	118.4808	0.030	4	118.7329	1.258	261	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6]2O[6])(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6]2O[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>,2|O<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|H<1>,1|O<2>,2|C<3>}	H(C[6]C[6,6]C[6])	118.8717	0.162	4	118.8717	0.026	4	118.7329	1.258	261	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6]3)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6]3)(C[6]C[6]H)(H){1|C<3>,1|O<1>,1|O<2>,3|C<4>,4|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){2|H<1>,3|C<4>}	H(C[6]C[6,6]C[6])	118.7490	0.689	2	118.0676	0.262	10	118.7329	1.258	261	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6]3)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6]3)(C[6]C[6]H)(H){1|C<3>,1|O<1>,2|C<4>,5|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6,6]C[6])	117.8080	0.322	2	118.0676	0.262	10	118.7329	1.258	261	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6]3)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6]3)(C[6]C[6]H)(H){1|C<3>,1|O<1>,2|H<1>,5|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6,6]C[6])	117.5420	0.049	2	118.0676	0.262	10	118.7329	1.258	261	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6]3)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6]3)(C[6]C[6]H)(H){1|C<4>,1|N<3>,1|O<1>,2|C<3>,4|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6,6]C[6])	118.1195	0.226	4	118.0676	0.262	10	118.7329	1.258	261	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6]3)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]O[6]O)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6]3)(C[6]C[6]H)(H){1|C<3>,1|O<1>,1|O<2>,2|H<1>,4|C<4>}	C[6](C[6]C[6,6]H)(C[6]O[6]O)(H){1|C<3>,2|C<4>}	H(C[6]C[6,6]C[6])	119.0700	0.947	4	119.0700	0.897	4	118.7329	1.258	261	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]N[5,6]N[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[5,6]N[6,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|S<4>,2|C<3>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){2|H<1>,2|N<3>}	H(C[6]C[6,6]C[6])	118.9800	0.000	1	119.2330	0.128	2	118.7329	1.258	261	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]N[5,6]N[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[5,6]N[6,6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){2|H<1>,2|N<3>}	H(C[6]C[6,6]C[6])	119.4860	0.000	1	119.2330	0.128	2	118.7329	1.258	261	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]N[6,6]C[6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,4|C<3>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|C<4>,1|N<3>,2|H<1>}	H(C[6]C[6,6]C[6])	118.2490	0.000	1	118.2490	0.000	1	118.7329	1.258	261	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6,6]C[6,6]2C)(C[6]C[6]O)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]C)(O)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2C)(C[6]C[6]O)(H){1|C<2>,1|C<3>,2|H<1>,3|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]C)(O){4|C<4>}	H(C[6]C[6,6]C[6])	122.7080	0.000	1	122.7080	0.000	1	122.7080	0.000	1	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6,6]H)(N[6]C[6,6]C)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]H)(C[6]N[6]H)(H){1|C<4>,1|I<1>,2|H<1>,3|C<3>}	C[6](C[6]C[6,6]H)(N[6]C[6,6]C)(H){1|O<2>,2|C<4>,2|H<1>}	H(C[6]C[6,6]C[6])	118.9080	0.000	1	118.9080	0.000	1	119.6880	1.217	2	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6a]C[6,6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6,6]H)(N[6]C[6,6]S)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]C[6,6]H)(C[6]N[6]H)(H){1|H<1>,1|S<4>,2|C<3>,2|C<4>}	C[6](C[6]C[6,6]H)(N[6]C[6,6]S)(H){1|C<4>,1|H<1>,1|O<2>,2|C<3>}	H(C[6]C[6,6]C[6])	120.4680	0.000	1	120.4680	0.000	1	119.6880	1.217	2	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	N[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[3x6]C[6]C)(C[6]N[5a,6]H)(H)	C[6](N[5a,6]C[5a,6,6]C[5a,6a])(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[3x6]C[6]C)(C[6]N[5a,6]H)(H){1|C<4>,1|N<3>,2|C<3>,3|H<1>}	C[6](N[5a,6]C[5a,6,6]C[5a,6a])(C[6]C[6,6]H)(H){3|C<3>,3|C<4>}	H(C[6]C[6,6]C[6])	118.2775	0.018	2	118.2775	0.000	2	118.2775	0.000	2	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]O[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6,6]C[6a])(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]O[6]H)(C[6]N[6]H)(H){1|H<1>,2|C<3>,2|C<4>}	C[6](N[6]C[6,6]C[6a])(C[6]C[6,6]H)(H){1|C<4>,1|O<2>,2|H<1>,3|C<3>}	H(C[6]C[6,6]C[6])	119.3790	0.000	1	119.3790	0.000	1	119.3790	0.000	1	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	B[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]B[6]H)(H)	C[6](B[6]N[6]N)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]B[6]H)(H){2|H<1>,2|N<3>}	C[6](B[6]N[6]N)(C[6]C[6]H)(H){2|C<4>,2|H<1>}	H(C[6]C[6]2)	122.8360	0.000	1	122.8360	0.000	1	122.8360	0.000	1	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]C[6a]H)(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C[6a]H)(C[6]C[5,6]H)(H){6|C<3>}	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<1>,3|C<3>}	H(C[6]C[6]2)	119.2940	0.033	3	119.2940	0.001	3	119.0933	0.676	7	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]HH)(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]HH)(C[6]C[5,6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|O<2>}	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<2>,4|H<1>}	H(C[6]C[6]2)	120.5580	0.000	1	120.5580	0.000	1	119.0933	0.676	7	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]ClH)(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]ClH)(C[6]C[5,6]H)(H){1|C<3>,1|C<4>,2|H<1>}	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|Cl<1>,1|C<3>,1|O<2>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.6280	0.256	2	118.6280	0.066	2	119.0933	0.676	7	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[5,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6]H)(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]H)(C[6]C[5,6]H)(H){1|C<4>,2|H<1>,3|C<3>}	C[6](C[5,6]C[5,6]C[5])(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<4>,3|C<3>}	H(C[6]C[6]2)	117.9570	0.000	1	117.9570	0.000	1	119.0933	0.676	7	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]C[6a]H)(C[6]C[5a,6]H)(H)	C[6](C[5a,6]N[5a,6]C[5a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C[6a]H)(C[6]C[5a,6]H)(H){1|N<3>,5|C<3>}	C[6](C[5a,6]N[5a,6]C[5a])(C[6]C[6]H)(H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.1000	0.102	2	119.1000	0.010	2	118.6362	1.198	5	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]HH)(C[6]C[5a,6]H)(H)	C[6](C[5a,6]N[5,5a,6]C[5a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]HH)(C[6]C[5a,6]H)(H){1|H<1>,1|N<3>,2|C<3>}	C[6](C[5a,6]N[5,5a,6]C[5a])(C[6]C[6]H)(H){1|B<3>,1|C<4>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	117.5740	0.000	1	117.5740	0.000	1	118.6362	1.198	5	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]C[6]H)(C[6]C[5a,6]H)(H)	C[6](C[5a,6]N[5a,6]C[5a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6]H)(C[6]C[5a,6]H)(H){1|C<4>,1|H<1>,1|N<3>,3|C<3>}	C[6](C[5a,6]N[5a,6]C[5a])(C[6]C[6]H)(H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.9710	0.000	1	119.9710	0.000	1	118.6362	1.198	5	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[5a,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]SiH)(C[6]C[5a,6]H)(H)	C[6](C[5a,6]C[5a,6,6]C[5a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]SiH)(C[6]C[5a,6]H)(H){1|C<4>,3|C<3>}	C[6](C[5a,6]C[5a,6,6]C[5a])(C[6]C[6]H)(H){1|Si<4>,1|C<3>,1|C<4>,1|O<2>,2|H<1>}	H(C[6]C[6]2)	117.4360	0.000	1	117.4360	0.000	1	118.6362	1.198	5	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]C[6]H)(C[6]C[6,6]H)(H)	C[6](C[6,6]C[5,6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C[6]H)(C[6]C[6,6]H)(H){1|Ca<12>,1|H<1>,2|C<3>,3|C<4>}	C[6](C[6,6]C[5,6,6]C[6])(C[6]C[6]H)(H){1|Ca<12>,1|C<3>,2|H<1>,3|C<4>}	H(C[6]C[6]2)	116.8050	0.105	4	116.8050	0.011	4	118.4967	5.057	10	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]HO)(C[6]C[6,6]H)(H)	C[6](C[6,6]C[5,6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]HO)(C[6]C[6,6]H)(H){1|C<3>,1|C<4>,2|O<2>}	C[6](C[6,6]C[5,6,6]C[6])(C[6]C[6]H)(H){1|O<2>,3|C<4>,3|H<1>}	H(C[6]C[6]2)	123.3910	0.000	1	123.3910	0.000	1	118.4967	5.057	10	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]MoH)(C[6]C[6,6]H)(H)	C[6](C[6,6]C[5,6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]MoH)(C[6]C[6,6]H)(H){1|C<3>,2|C<4>}	C[6](C[6,6]C[5,6,6]C[6])(C[6]C[6]H)(H){1|Mo<10>,1|C<3>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	120.8850	0.000	1	120.8850	0.000	1	118.4967	5.057	10	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]NiH)(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]NiH)(C[6]C[6,6]H)(H){1|H<1>,2|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(H){1|Ni<4>,1|C<3>,1|C<4>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.0280	0.000	1	119.0280	0.000	1	118.4967	5.057	10	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]2O[6])(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6]2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]2O[6])(C[6]C[6,6]H)(H){1|C<4>,5|C<3>}	C[6](C[6,6]C[6,6]2)(C[6]C[6]H)(H){1|Cr<9>,1|O<2>,2|C<4>,3|C<3>}	H(C[6]C[6]2)	119.1590	0.000	1	119.1590	0.000	1	118.4967	5.057	10	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]O[6]C)(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6]2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]O[6]C)(C[6]C[6,6]H)(H){1|C<4>,3|C<3>}	C[6](C[6,6]C[6,6]2)(C[6]C[6]H)(H){1|Cr<9>,1|O<2>,2|C<3>,3|C<4>}	H(C[6]C[6]2)	116.5940	0.000	1	116.5940	0.000	1	118.4967	5.057	10	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]HH)(C[6]C[6,6]H)(H)	C[6](C[6,6]C[3x6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]HH)(C[6]C[6,6]H)(H){1|C<3>,2|C<4>}	C[6](C[6,6]C[3x6]C[6])(C[6]C[6]H)(H){1|N<3>,3|C<4>,3|H<1>}	H(C[6]C[6]2)	118.6900	0.000	1	118.6900	0.000	1	118.4967	5.057	10	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6a]N[6]H)(C[6]C[6,6a]Cl)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6]H)(C[6]C[6,6a]Cl)(H){5|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(Cl){1|C<3>,1|H<1>,1|N<2>,1|O<1>,2|N<3>}	H(C[6]C[6]2)	122.3610	0.000	1	121.0980	3.190	2	121.0980	3.190	2	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6a]N[6]H)(C[6]C[6,6a]Cl)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6]H)(C[6]C[6,6a]Cl)(H){5|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(Cl){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.8350	0.000	1	121.0980	3.190	2	121.0980	3.190	2	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]MoH)(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[5,6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]MoH)(C[6]C[6,6a]H)(H){1|C<4>,2|C<3>}	C[6](C[6,6a]C[5,6,6a]C[6a])(C[6]C[6]H)(H){1|Mo<10>,1|C<4>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	118.8020	0.000	1	118.8020	0.000	1	119.2753	1.260	50	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]C[6]H)(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6]H)(C[6]C[6,6a]H)(H){1|H<1>,1|O<2>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.6130	0.000	1	119.6130	0.000	1	119.2753	1.260	50	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]C[6a]O[6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6a]O[6])(C[6]C[6,6a]H)(H){1|S<2>,5|C<3>}	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H){1|O<2>,5|C<3>}	H(C[6]C[6]2)	119.8875	0.234	2	119.8875	0.055	2	119.2753	1.260	50	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6]H)(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6]H)(C[6]C[6,6a]H)(H){1|H<1>,1|O<2>,2|C<3>,2|C<4>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	118.6940	0.000	1	119.0705	0.284	2	119.2753	1.260	50	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6]H)(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6]H)(C[6]C[6,6a]H)(H){1|O<2>,2|C<3>,3|C<4>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.4470	0.000	1	119.0705	0.284	2	119.2753	1.260	50	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]2N[6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]2N[6])(C[6]C[6,6a]H)(H){1|O<1>,6|C<3>}	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H){1|N<2>,1|N<3>,4|C<3>}	H(C[6]C[6]2)	118.2820	0.000	1	118.2820	0.000	1	119.2753	1.260	50	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]2N[6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]2N[6])(C[6]C[6,6a]H)(H){1|O<1>,6|C<3>}	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H){1|N<3>,5|C<3>}	H(C[6]C[6]2)	117.7090	0.000	1	117.7090	0.000	1	119.2753	1.260	50	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]2O[6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]2O[6])(C[6]C[6,6a]H)(H){6|C<3>}	C[6](C[6,6a]C[5a,6a]C[6,6a])(C[6]C[6]H)(H){1|O<2>,5|C<3>}	H(C[6]C[6]2)	120.8180	0.000	1	120.8180	0.000	1	119.2753	1.260	50	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]2O[6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]2O[6])(C[6]C[6,6a]H)(H){6|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|O<2>,4|C<3>}	H(C[6]C[6]2)	120.3550	0.031	2	119.8977	1.144	12	119.2753	1.260	50	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]2O[6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]2O[6])(C[6]C[6,6a]H)(H){6|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,1|O<2>,4|C<3>}	H(C[6]C[6]2)	119.8536	1.309	8	119.8977	1.144	12	119.2753	1.260	50	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]2O[6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]2O[6])(C[6]C[6,6a]H)(H){6|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|O<2>,5|C<3>}	H(C[6]C[6]2)	119.6170	0.045	2	119.8977	1.144	12	119.2753	1.260	50	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]2O[6])(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]2O[6])(C[6]C[6,6a]H)(H){6|C<3>}	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(H){1|O<2>,5|C<3>}	H(C[6]C[6]2)	119.6797	0.782	8	119.6797	0.612	8	119.2753	1.260	50	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6]H)(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]H)(C[6]C[6,6a]H)(H){1|C<4>,1|H<1>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.2345	0.482	2	119.4079	0.477	7	119.2753	1.260	50	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6]H)(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]H)(C[6]C[6,6a]H)(H){1|H<1>,1|N<3>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.3045	0.705	2	119.4079	0.477	7	119.2753	1.260	50	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6]H)(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]H)(C[6]C[6,6a]H)(H){1|H<1>,1|O<2>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	118.9275	0.213	2	119.4079	0.477	7	119.2753	1.260	50	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6]H)(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]H)(C[6]C[6,6a]H)(H){6|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	118.9220	0.000	1	119.4079	0.477	7	119.2753	1.260	50	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6]H)(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6]H)(C[6]C[6,6a]H)(H){1|S<4>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.8190	0.000	1	119.7465	0.011	2	119.2753	1.260	50	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6]H)(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6]H)(C[6]C[6,6a]H)(H){5|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.6740	0.000	1	119.7465	0.011	2	119.2753	1.260	50	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]O[6]O)(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]O[6]O)(C[6]C[6,6a]H)(H){4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|H<1>,2|O<2>,3|C<3>}	H(C[6]C[6]2)	119.5943	0.182	3	119.5943	0.033	3	119.2753	1.260	50	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]S[6]H)(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]S[6]H)(C[6]C[6,6a]H)(H){4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|N<2>,1|S<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	116.6760	0.000	1	117.4046	0.389	5	119.2753	1.260	50	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]S[6]H)(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]S[6]H)(C[6]C[6,6a]H)(H){4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|S<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	117.5867	0.545	4	117.4046	0.389	5	119.2753	1.260	50	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]CH)(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[5,6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]CH)(C[6]C[6,6a]H)(H){1|Si<4>,2|C<3>}	C[6](C[6,6a]C[5,6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	118.4600	0.000	1	118.4600	0.000	1	119.2753	1.260	50	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5a,6]HO)(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[5a,6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5a,6]HO)(C[6]C[6,6a]H)(H){3|C<3>}	C[6](C[6,6a]C[5a,6,6a]C[6a])(C[6]C[6]H)(H){1|N<3>,1|O<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	116.4990	0.000	1	116.4990	0.000	1	119.2753	1.260	50	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5a]C[6]H)(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5a]C[6]H)(C[6]C[6,6a]H)(H){1|H<1>,1|O<2>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.5600	0.000	1	119.5600	0.000	1	119.2753	1.260	50	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]CH)(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6,6a]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]CH)(C[6]C[6,6a]H)(H){1|C<4>,2|C<3>}	C[6](C[6,6a]C[6,6,6a]C[6a])(C[6]C[6]H)(H){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	118.7420	0.000	1	118.7420	0.000	1	119.2753	1.260	50	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6a]O[6]H)(C[6]C[6,6a]O)(H)	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6a]O[6]H)(C[6]C[6,6a]O)(H){4|C<3>}	C[6](C[6,6a]C[6a,6a]C[6,6a])(C[6]C[6]H)(O){1|H<1>,1|O<2>,4|C<3>}	H(C[6]C[6]2)	124.3190	0.000	1	124.3190	0.000	1	124.3190	0.000	1	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:F-1:	C[6]-3:	C[6](C[6]C[6]Ni2)(C[6]C[6]F)(H)	C[6](C[6]C[6]F)(C[6]C[6]H)(F)	H(C[6]C[6]2)	C[6](C[6]C[6]Ni2)(C[6]C[6]F)(H){1|C<3>,1|F<1>}	C[6](C[6]C[6]F)(C[6]C[6]H)(F){2|Ni<4>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	121.8025	0.013	2	121.8025	0.000	2	121.8025	0.000	2	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]B[6]PtH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]B[6]PtH)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<4>}	C[6](C[6]C[6]H)2(H){1|Pt<6>,1|B<4>,2|H<1>}	H(C[6]C[6]2)	118.7290	0.091	2	118.7290	0.008	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[3,5,6,6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[3,5,6,6]O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[3,5,6,6]HH)(C[6]C[6]H)(H){1|O<1>,3|C<4>}	C[6](C[6]C[3,5,6,6]O)(C[6]C[6]H)(H){2|H<1>,3|C<4>}	H(C[6]C[6]2)	117.4670	0.000	1	117.4670	0.000	1	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[3,6,6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[3,6,6]HH)(C[6]C[6]H)(H){1|O<1>,1|O<2>,2|C<4>}	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H){2|H<1>,3|C<4>}	H(C[6]C[6]2)	118.3685	2.978	2	118.3685	8.866	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[3,6,6]HO)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[3,6,6]HO)(C[6]C[6]H)(H){1|O<1>,1|O<2>,2|C<4>}	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H){1|H<1>,1|O<2>,3|C<4>}	H(C[6]C[6]2)	119.8060	0.000	1	119.8060	0.000	1	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[3x3,4,3x5,14x6]C[4,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[3x3,4,3x5,14x6]C[4,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|C<6>,1|H<1>,4|B<6>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|C<5>,2|H<1>}	H(C[6]C[6]2)	119.2780	0.000	1	119.2780	0.000	1	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[4,6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[4,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[4,6]HH)(C[6]C[6]H)(H){1|C<4>,1|H<1>,2|C<3>}	C[6](C[6]C[4,6]H)(C[6]C[6]H)(H){2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.7270	0.000	1	118.7270	0.000	1	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[4]C[6]Ni)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[4]C[6]Ni)(C[6]C[6]H)(H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Ni<5>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.5805	0.036	2	119.5805	0.001	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[4x6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[3x6]O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[4x6]HH)(C[6]C[6]H)(H){1|C<4>,1|O<2>,2|C<3>}	C[6](C[6]C[3x6]O)(C[6]C[6]H)(H){2|C<4>,3|H<1>}	H(C[6]C[6]2)	117.5420	0.000	1	117.5420	0.000	1	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,5,6]CH)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,5,6]CH)(C[6]C[6]H)(H){1|O<1>,3|C<4>}	C[6](C[6]C[5,6]O)(C[6]C[6]H)(H){1|H<1>,4|C<4>}	H(C[6]C[6]2)	117.8070	0.030	2	117.8070	0.001	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]AlH)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]AlH)(C[6]C[6]H)(H){1|C<3>,1|N<3>,2|C<4>}	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H){1|Al<5>,1|C<3>,1|C<5>,1|H<1>}	H(C[6]C[6]2)	118.3360	0.000	1	118.3360	0.000	1	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]CC)(C[6]C[6]H)(H)	C[6](C[6]C[5,5,6]O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]CC)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<1>,1|O<2>}	C[6](C[6]C[5,5,6]O)(C[6]C[6]H)(H){5|C<4>}	H(C[6]C[6]2)	116.8000	0.000	1	116.8000	0.000	1	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]CC)(C[6]C[6]H)(H)	C[6](C[6]C[5,6,6]O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]CC)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<1>,1|O<2>}	C[6](C[6]C[5,6,6]O)(C[6]C[6]H)(H){5|C<4>}	H(C[6]C[6]2)	117.0710	0.000	1	117.0710	0.000	1	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]CH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]CH)(C[6]C[6]H)(H){1|C<3>,1|O<1>,2|C<4>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|O<2>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	117.8460	0.000	1	117.8460	0.000	1	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]C[6a])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H){1|O<2>,2|C<3>}	C[6](C[6]C[5,6]C[6a])(C[6]C[6]H)(H){1|P<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.1750	0.000	1	120.1750	0.000	1	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){2|C<4>,3|H<1>}	H(C[6]C[6]2)	122.2810	0.000	1	122.2810	0.000	1	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]HO)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]HO)(C[6]C[6]H)(H){1|C<3>,1|N<3>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|H<1>,1|O<2>,2|C<4>}	H(C[6]C[6]2)	119.0280	0.365	6	119.0280	0.133	6	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]HO)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]HO)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,1|O<1>}	C[6](C[6]C[5,6]O)(C[6]C[6]H)(H){1|O<2>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	117.4475	0.449	2	117.4475	0.202	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]HO)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]HO)(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|O<2>,2|H<1>}	H(C[6]C[6]2)	120.0980	0.000	1	120.0980	0.000	1	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]NdH)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]NdH)(C[6]C[6]H)(H){1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Nd<19>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	118.9760	0.000	1	118.9760	0.000	1	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]Os2)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]Os2)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Os<5>,1|Os<6>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	118.7995	0.327	2	118.7995	0.107	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]Ru2)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]Ru2)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(H){1|Ru<5>,1|Ru<7>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	119.3380	0.277	2	119.3380	0.077	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]C[6]Dy)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6]Dy)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)2(H){1|Dy<11>,1|C<3>,2|C<4>}	H(C[6]C[6]2)	120.8530	0.000	1	120.8530	0.000	1	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]C[6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H){1|C<3>,1|N<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	117.8505	0.052	2	117.8505	0.003	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]C[6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|N<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){2|C<3>,2|H<1>}	H(C[6]C[6]2)	118.4525	0.039	2	118.4525	0.002	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]C[6]Pd)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6]Pd)(C[6]C[6]H)(H){2|H<1>,4|C<3>}	C[6](C[6]C[6]H)2(H){1|Pd<5>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.3090	0.000	1	119.3090	0.000	1	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]C[6]Yb)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6]Yb)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|H<2>,1|N<3>,1|P<3>}	C[6](C[6]C[6]H)2(H){1|Yb<15>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.8090	0.000	1	119.8090	0.000	1	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]C[6]Zr)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6]Zr)(C[6]C[6]H)(H){1|C<3>,1|H<1>,3|C<4>}	C[6](C[6]C[6]H)2(H){1|Zr<13>,1|C<3>,1|C<5>,1|H<1>}	H(C[6]C[6]2)	120.2230	0.000	1	120.2230	0.000	1	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]N[6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5]N[6]H)(C[6]C[6]H)(H){1|Re<6>,1|C<3>,1|H<1>,2|N<3>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	121.2800	0.000	1	121.2800	0.000	1	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]OO)(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]OO)(C[6]C[6]H)(H){1|C<3>,1|O<1>,1|O<2>}	C[6](C[6]C[5a,6]O)(C[6]C[6]H)(H){2|C<3>,2|O<2>}	H(C[6]C[6]2)	117.4575	0.136	2	117.4575	0.019	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5x3,5x5,20x6]C[4,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[5x3,5x5,20x6]C[4,6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,2|C<6>,4|B<6>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|C<6>,2|H<1>}	H(C[6]C[6]2)	119.0970	0.000	1	119.0970	0.000	1	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]CC)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]CC)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|O<1>}	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H){5|C<4>}	H(C[6]C[6]2)	117.1890	0.000	1	117.2910	0.732	3	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]CC)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]CC)(C[6]C[6]H)(H){1|H<1>,1|O<1>,2|C<4>}	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H){1|H<1>,4|C<4>}	H(C[6]C[6]2)	116.4910	0.000	1	117.2910	0.732	3	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]CC)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]CC)(C[6]C[6]H)(H){1|H<1>,1|O<1>,2|C<4>}	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H){5|C<4>}	H(C[6]C[6]2)	118.1930	0.000	1	117.2910	0.732	3	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]CO)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]CO)(C[6]C[6]H)(H){1|H<1>,1|O<1>,2|C<4>}	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H){1|O<2>,4|C<4>}	H(C[6]C[6]2)	117.3740	0.000	1	117.3740	0.000	1	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|O<1>}	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H){2|C<4>,3|H<1>}	H(C[6]C[6]2)	118.2727	0.214	3	118.3825	0.363	6	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|O<2>}	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.5300	0.000	1	118.3825	0.363	6	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H){1|H<1>,1|O<1>,2|C<4>}	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H){2|C<4>,3|H<1>}	H(C[6]C[6]2)	118.1060	0.000	1	118.3825	0.363	6	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H){1|H<1>,1|O<1>,2|C<4>}	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H){2|H<1>,3|C<4>}	H(C[6]C[6]2)	117.8410	0.000	1	118.3825	0.363	6	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H)	C[6](C[6]N[6,6]O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>,1|O<1>}	C[6](C[6]N[6,6]O)(C[6]C[6]H)(H){2|C<4>,2|H<1>}	H(C[6]C[6]2)	123.3000	0.000	1	121.4210	7.061	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H)	C[6](C[6]N[6,6]O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,1|O<1>}	C[6](C[6]N[6,6]O)(C[6]C[6]H)(H){2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.5420	0.000	1	121.4210	7.061	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]HO)(C[6]C[6]H)(H)	C[6](C[6]N[6,6]O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]HO)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,1|O<1>}	C[6](C[6]N[6,6]O)(C[6]C[6]H)(H){1|H<1>,1|O<2>,2|C<4>}	H(C[6]C[6]2)	119.3140	0.000	1	119.3140	0.000	1	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]Li2)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]Li2)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<3>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Li<4>,1|Li<5>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	118.0350	0.000	1	118.0730	0.003	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]Li2)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]Li2)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<3>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Li<4>,1|Li<5>,2|C<4>}	H(C[6]C[6]2)	118.1110	0.000	1	118.0730	0.003	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]OO)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]OO)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<1>}	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H){2|C<3>,2|O<2>}	H(C[6]C[6]2)	118.7130	0.000	1	118.7130	0.000	1	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]TiO)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]TiO)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Ti<12>,1|C<3>,1|C<4>,1|O<2>}	H(C[6]C[6]2)	120.2794	0.570	5	120.2229	0.226	8	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]TiO)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]TiO)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Ti<8>,1|C<3>,1|C<4>,1|O<2>}	H(C[6]C[6]2)	120.4650	0.000	1	120.2229	0.226	8	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]TiO)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]TiO)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){1|Ti<9>,1|O<2>,2|C<3>}	H(C[6]C[6]2)	119.9605	0.267	2	120.2229	0.226	8	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]AgH)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]AgH)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H){1|Ag<5>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.6590	0.000	1	119.6590	0.000	1	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]C[6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C[6]H)(C[6]C[6]H)(H){1|H<1>,4|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H){1|H<1>,3|C<3>}	H(C[6]C[6]2)	118.7355	0.361	2	118.7355	0.131	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]HH)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H){2|C<3>,2|H<1>}	H(C[6]C[6]2)	117.4030	0.000	1	117.4030	0.000	1	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]Li2)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]Li2)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]H)(C[6]C[6]H)(H){2|Li<4>,2|C<3>}	H(C[6]C[6]2)	117.2810	0.000	1	117.2810	0.000	1	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]OO)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]OO)(C[6]C[6]H)(H){1|O<1>,2|C<3>}	C[6](C[6]C[6,6a]O)(C[6]C[6]H)(H){2|C<3>,2|O<2>}	H(C[6]C[6]2)	118.0640	0.000	1	118.0640	0.000	1	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2C)(C[6]C[6]H)(H){1|C<3>,1|O<1>,2|H<1>,3|C<4>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){5|C<4>}	H(C[6]C[6]2)	117.0510	0.288	3	117.0510	0.083	3	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2C)(C[6]C[6]H)(H){1|C<3>,3|C<4>,3|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,3|C<4>}	H(C[6]C[6]2)	118.0190	0.000	1	118.0190	0.000	1	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2Co)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2Co)(C[6]C[6]H)(H){1|Ni<7>,1|C<4>,1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|Co<8>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	120.1472	0.184	4	120.1472	0.034	4	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2Li)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2Li)(C[6]C[6]H)(H){1|Ni<7>,1|C<4>,1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|Li<5>,1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.6490	0.000	1	119.9490	0.093	3	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2Li)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2Li)(C[6]C[6]H)(H){1|Ni<7>,1|C<4>,1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|Li<6>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	120.0990	0.225	2	119.9490	0.093	3	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2Mn)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2Mn)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>,2|C<4>}	C[6](C[6]C[6]H)2(H){1|Mn<8>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.0831	0.287	7	119.1921	0.094	13	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2Mn)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2Mn)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|Mn<8>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.3192	0.299	6	119.1921	0.094	13	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2Ni)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2Ni)(C[6]C[6]H)(H){1|Ni<7>,1|C<4>,1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|Ni<8>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	120.2605	0.360	4	120.2425	0.100	6	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2Ni)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2Ni)(C[6]C[6]H)(H){1|Ni<7>,1|C<4>,1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|Ni<9>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	120.2065	0.327	2	120.2425	0.100	6	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2Pr)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2Pr)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|H<2>,2|C<4>}	C[6](C[6]C[6]H)2(H){1|Pr<17>,1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.9210	0.000	1	119.9210	0.000	1	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2Re)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2Re)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>,2|C<4>}	C[6](C[6]C[6]H)2(H){1|Re<8>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.8195	0.559	2	119.8227	0.156	3	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2Re)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2Re)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|Re<8>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.8290	0.000	1	119.8227	0.156	3	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2Ru)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2Ru)(C[6]C[6]H)(H){1|O<2>,2|C<3>,2|C<4>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Ru<10>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.3395	0.029	2	119.3395	0.001	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2Ta)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2Ta)(C[6]C[6]H)(H){1|C<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Ta<10>,1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.5050	0.338	2	119.5050	0.114	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2Ta)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2Ta)(C[6]C[6]H)(H){1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|Ta<10>,1|C<4>,2|C<3>}	H(C[6]C[6]2)	119.9770	0.000	1	119.9770	0.000	1	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2Zr)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2Zr)(C[6]C[6]H)(H){1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|Zr<14>,1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.1925	0.165	2	119.1925	0.027	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Al2)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Al2)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(H){2|Al<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	118.8500	0.000	1	118.8500	0.000	1	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]AlH)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]AlH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Al<4>,1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2590	0.429	4	120.2590	0.184	4	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]AlH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]AlH)(C[6]C[6]H)(H){1|C<2>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Al<7>,1|C<3>,1|H<2>}	H(C[6]C[6]2)	118.3890	0.000	1	119.0147	0.439	7	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]AlH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]AlH)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Al<7>,1|C<3>,1|H<1>,1|H<2>}	H(C[6]C[6]2)	118.6977	0.124	4	119.0147	0.439	7	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]AlH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]AlH)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|Al<4>,1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9615	0.035	2	119.0147	0.439	7	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]BH)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]BH)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>,1|P<4>}	H(C[6]C[6]2)	117.3050	0.000	1	117.3050	0.000	1	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]BaH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]BaH)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|Ba<10>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.3570	0.000	1	119.3570	0.000	1	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]BaN)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]BaN)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Ba<10>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.6760	0.000	1	119.6760	0.000	1	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CC)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CC)(C[6]C[6]H)(H){1|C<4>,1|H<1>,2|C<3>}	C[6](C[6]C[5,6]C)(C[6]C[6]H)(H){1|C<4>,4|C<3>}	H(C[6]C[6]2)	117.7940	0.000	1	117.7940	0.000	1	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CC)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CC)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|O<1>}	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H){5|C<4>}	H(C[6]C[6]2)	116.9300	0.000	1	117.0777	0.058	3	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CC)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CC)(C[6]C[6]H)(H){1|C<4>,1|O<1>,2|H<1>}	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H){5|C<4>}	H(C[6]C[6]2)	117.3560	0.000	1	117.0777	0.058	3	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CC)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CC)(C[6]C[6]H)(H){1|H<1>,1|O<1>,2|C<4>}	C[6](C[6]C[6,6]O)(C[6]C[6]H)(H){5|C<4>}	H(C[6]C[6]2)	116.9470	0.000	1	117.0777	0.058	3	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CC)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CC)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	117.7210	0.170	2	117.7210	0.029	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CC)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CC)(C[6]C[6]H)(H){1|C<4>,1|O<1>,2|H<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|H<1>,4|C<4>}	H(C[6]C[6]2)	117.7638	0.159	5	117.5968	0.125	8	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CC)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CC)(C[6]C[6]H)(H){1|C<4>,2|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|S<2>,3|C<4>}	H(C[6]C[6]2)	116.8110	0.000	1	117.5968	0.125	8	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CC)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CC)(C[6]C[6]H)(H){1|H<1>,1|O<1>,2|C<4>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){2|H<1>,3|C<4>}	H(C[6]C[6]2)	117.4860	0.000	1	117.5968	0.125	8	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CC)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CC)(C[6]C[6]H)(H){1|H<1>,1|O<1>,2|C<4>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){5|C<4>}	H(C[6]C[6]2)	117.6580	0.000	1	117.5968	0.125	8	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CC)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CC)(C[6]C[6]H)(H){1|N<2>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|Ni<4>,1|C<3>,2|C<4>}	H(C[6]C[6]2)	117.8690	0.045	2	117.8690	0.002	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CC)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CC)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,3|C<4>}	H(C[6]C[6]2)	118.6950	0.000	1	118.4543	0.043	3	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CC)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CC)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(H){1|H<1>,3|C<3>}	H(C[6]C[6]2)	118.3340	0.000	2	118.4543	0.043	3	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CH)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,2|H<1>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){2|C<4>,3|H<1>}	H(C[6]C[6]2)	117.8240	0.000	1	118.2240	0.502	4	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CH)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CH)(C[6]C[6]H)(H){1|C<3>,2|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.2400	0.000	1	118.2240	0.502	4	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CH)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CH)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	117.9160	0.352	2	118.2240	0.502	4	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CH)(C[6]C[6]H)(H){1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(H){2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.1690	0.000	1	120.0836	0.238	8	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CH)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<2>,1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0375	0.103	2	120.0836	0.238	8	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CH)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	120.2480	0.201	2	120.0836	0.238	8	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CH)(C[6]C[6]H)(H){1|C<3>,3|H<1>}	C[6](C[6]C[6]H)2(H){2|C<4>,2|H<1>}	H(C[6]C[6]2)	120.0025	0.012	2	120.0836	0.238	8	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CH)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	120.9240	0.000	1	120.0836	0.238	8	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CN)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CN)(C[6]C[6]H)(H){1|Br<1>,1|C<2>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	122.4240	0.000	1	120.7810	5.926	5	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CN)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CN)(C[6]C[6]H)(H){1|Br<1>,1|C<3>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	122.7640	0.000	1	120.7810	5.926	5	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CN)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CN)(C[6]C[6]H)(H){1|Br<1>,1|C<3>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	122.4760	0.000	1	120.7810	5.926	5	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CN)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CN)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	118.1205	0.204	2	120.7810	5.926	5	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CO)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CO)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|O<2>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	117.4220	0.000	1	119.0620	3.312	5	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CO)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CO)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	118.2790	0.165	2	119.0620	3.312	5	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CO)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CO)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|O<2>,2|C<4>}	H(C[6]C[6]2)	122.1080	0.000	1	119.0620	3.312	5	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CO)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CO)(C[6]C[6]H)(H){1|C<3>,1|O<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Si<4>,1|C<3>,1|C<4>,1|O<2>}	H(C[6]C[6]2)	119.2220	0.000	1	119.0620	3.312	5	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CO)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CO)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|O<2>,2|C<4>}	H(C[6]C[6]2)	119.8930	0.000	1	119.4040	0.180	3	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CO)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CO)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.1595	0.039	2	119.4040	0.180	3	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CU)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CU)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|U<11>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.0235	0.245	2	119.5912	0.384	6	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CU)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CU)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|H<2>}	C[6](C[6]C[6]H)2(H){1|U<22>,3|C<4>}	H(C[6]C[6]2)	119.8750	0.545	4	119.5912	0.384	6	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CW)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CW)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|W<12>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.5323	0.123	6	119.5323	0.015	6	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CY)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CY)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|H<2>}	C[6](C[6]C[6]H)2(H){1|Y<10>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	118.5750	0.000	1	118.9150	0.052	4	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CY)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CY)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|H<2>}	C[6](C[6]C[6]H)2(H){1|Y<17>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.0283	0.034	3	118.9150	0.052	4	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CaC)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CaC)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Ca<12>,1|C<4>,1|C<5>,1|H<1>}	H(C[6]C[6]2)	119.1350	0.105	2	118.5863	0.909	3	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CaC)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CaC)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Ca<8>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	117.4890	0.000	1	118.5863	0.909	3	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CaH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CaH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ca<8>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	120.3010	0.000	1	119.7630	0.217	3	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CaH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CaH)(C[6]C[6]H)(H){1|C<3>,1|C<5>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ca<12>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.4940	0.004	2	119.7630	0.217	3	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CeC)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CeC)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|H<2>}	C[6](C[6]C[6]H)2(H){1|Ce<18>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.0363	0.047	3	119.0363	0.002	3	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CeF)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CeF)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|Ce<22>,1|C<4>,1|F<2>,1|H<1>}	H(C[6]C[6]2)	121.2117	0.080	3	121.2117	0.006	3	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CeH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CeH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ce<18>,1|C<4>,1|H<1>,1|H<2>}	H(C[6]C[6]2)	119.1170	0.156	3	119.2690	0.109	4	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CeH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CeH)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|Ce<13>,1|C<4>,1|H<1>,1|H<2>}	H(C[6]C[6]2)	119.7250	0.000	1	119.2690	0.109	4	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CeN)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CeN)(C[6]C[6]H)(H){1|C<3>,1|F<2>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ce<22>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.0205	0.114	2	119.1343	0.045	3	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CeN)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CeN)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|H<2>}	C[6](C[6]C[6]H)2(H){1|Ce<13>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.3620	0.000	1	119.1343	0.045	3	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]ClZr)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]ClZr)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Zr<14>,1|Cl<2>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	121.9200	0.324	2	121.9200	0.105	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CoB)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CoB)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Co<6>,1|B<4>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.4920	0.000	1	119.4920	0.000	1	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CoC)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CoC)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|Co<5>,3|C<4>}	H(C[6]C[6]2)	119.2080	0.000	1	119.2080	0.000	1	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CoH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CoH)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Co<6>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	120.1320	0.000	1	120.1320	0.000	1	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CoNi)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CoNi)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Co<8>,1|Ni<7>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.7777	0.132	4	119.7777	0.017	4	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CrC)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CrC)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Cr<5>,3|C<4>}	H(C[6]C[6]2)	120.2805	1.197	4	119.8400	1.048	7	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CrC)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CrC)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|Cr<6>,3|C<4>}	H(C[6]C[6]2)	119.0210	0.000	1	119.8400	1.048	7	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CrC)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CrC)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Cr<5>,1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.3685	0.306	2	119.8400	1.048	7	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CrH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CrH)(C[6]C[6]H)(H){1|Si<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Cr<6>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	120.0840	0.000	1	119.9825	0.021	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CrH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CrH)(C[6]C[6]H)(H){1|Si<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Cr<7>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.8810	0.000	1	119.9825	0.021	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CrN)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CrN)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|Cr<6>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7705	0.043	2	119.7705	0.002	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CrO)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CrO)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Cr<8>,1|C<3>,1|H<1>,1|O<3>}	H(C[6]C[6]2)	121.7782	0.126	4	121.7782	0.016	4	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CrSi)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CrSi)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Cr<6>,1|Si<5>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.1220	0.000	1	119.1575	0.003	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CrSi)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CrSi)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Cr<7>,1|Si<5>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.1930	0.000	1	119.1575	0.003	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Cu2)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Cu2)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){2|Cu<2>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	118.8725	0.303	2	118.8725	0.092	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CuB)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CuB)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Cu<5>,1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	118.8085	0.231	2	118.6232	0.069	9	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CuB)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CuB)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Cu<6>,1|B<4>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	118.5703	0.263	7	118.6232	0.069	9	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CuC)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CuC)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Cu<4>,1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.4292	0.331	4	119.4292	0.109	4	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CuH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CuH)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Cu<6>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.7060	0.134	7	120.0742	0.618	15	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CuH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CuH)(C[6]C[6]H)(H){1|C<2>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Cu<5>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	121.9470	0.000	2	120.0742	0.618	15	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CuH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CuH)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Cu<4>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	120.0023	0.210	4	120.0742	0.618	15	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CuH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CuH)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|Cu<4>,1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.7760	0.000	1	120.0742	0.618	15	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CuH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CuH)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|Cu<4>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.4920	0.000	1	120.0742	0.618	15	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]DyH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]DyH)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|H<2>}	C[6](C[6]C[6]H)2(H){1|Dy<16>,1|B<4>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.7590	0.283	4	120.7590	0.080	4	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]DyN)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]DyN)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(H){1|Dy<15>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2200	0.000	1	120.2200	0.000	1	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]DyO)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]DyO)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|Dy<15>,1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	118.7380	0.000	1	119.9084	0.556	5	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]DyO)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]DyO)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(H){1|Dy<11>,1|C<3>,1|C<4>,1|O<3>}	H(C[6]C[6]2)	119.9115	0.097	2	119.9084	0.556	5	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]DyO)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]DyO)(C[6]C[6]H)(H){1|Dy<15>,1|C<4>,1|H<1>,1|O<3>}	C[6](C[6]C[6]H)2(H){2|Dy<15>,1|C<5>,2|O<3>}	H(C[6]C[6]2)	120.4905	0.407	2	119.9084	0.556	5	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]ErN)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]ErN)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Er<10>,1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	118.6368	0.368	4	118.6368	0.136	4	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]ErN)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]ErN)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Er<16>,1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.0574	0.367	8	119.0574	0.134	8	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]FF)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]O[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]FF)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]O[6]O)(H){1|C<4>,2|F<1>}	H(C[6]C[6]2)	122.4270	0.000	1	122.4270	0.000	1	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]FH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]O[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]FH)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]O[6]O)(H){1|C<4>,1|F<1>,1|H<1>}	H(C[6]C[6]2)	120.2005	0.110	2	120.2005	0.012	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Fe2)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Fe2)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){2|Fe<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	118.3195	0.115	11	118.3195	0.013	11	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]FeB)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]FeB)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<4>}	C[6](C[6]C[6]H)2(H){1|Fe<7>,1|B<4>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	118.7060	0.171	2	119.5657	0.747	8	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]FeB)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]FeB)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Fe<5>,1|C<3>,2|B<4>}	H(C[6]C[6]2)	119.4470	0.000	1	119.5657	0.747	8	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]FeB)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]FeB)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Fe<6>,1|B<4>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.9334	0.870	5	119.5657	0.747	8	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]FeC)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]FeC)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Fe<10>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	118.9530	0.000	1	118.9530	0.000	1	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]FeH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]FeH)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Fe<6>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	120.1456	0.963	5	119.9152	1.061	6	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]FeH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]FeH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Fe<10>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	118.7630	0.000	1	119.9152	1.061	6	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]FeP)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]FeP)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Fe<7>,1|C<4>,1|H<1>,1|P<4>}	H(C[6]C[6]2)	119.7920	0.143	2	119.7347	0.020	3	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]FeP)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]FeP)(C[6]C[6]H)(H){1|B<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Fe<8>,1|C<4>,1|H<1>,1|P<4>}	H(C[6]C[6]2)	119.6200	0.000	1	119.7347	0.020	3	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]FeS)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]FeS)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<3>}	C[6](C[6]C[6]H)2(H){1|Fe<9>,1|C<4>,1|H<1>,1|S<3>}	H(C[6]C[6]2)	120.0503	0.118	6	120.0503	0.014	6	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]GdO)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]GdO)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<3>}	C[6](C[6]C[6]H)2(H){1|Gd<17>,1|C<3>,1|C<4>,1|O<3>}	H(C[6]C[6]2)	119.8285	0.334	2	119.8285	0.112	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]GePd)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]GePd)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Ge<5>,1|Pd<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.4515	0.125	2	119.4515	0.016	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,3|H<1>}	H(C[6]C[6]2)	120.2095	0.163	2	121.1577	3.893	4	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<4>,3|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,4|H<1>}	H(C[6]C[6]2)	120.0990	0.000	1	121.1577	3.893	4	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){2|C<4>,2|H<1>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,4|H<1>}	H(C[6]C[6]2)	124.1130	0.000	1	121.1577	3.893	4	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<4>,1|O<1>,2|H<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<4>,4|H<1>}	H(C[6]C[6]2)	117.9090	1.930	2	118.4345	1.086	8	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<4>,1|O<1>,2|H<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Si<4>,1|C<4>,3|H<1>}	H(C[6]C[6]2)	120.2000	0.000	1	118.4345	1.086	8	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<4>,1|O<1>,2|H<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){2|C<4>,3|H<1>}	H(C[6]C[6]2)	118.2120	0.221	2	118.4345	1.086	8	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<4>,1|O<1>,2|H<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){2|H<1>,3|C<4>}	H(C[6]C[6]2)	118.4010	0.000	1	118.4345	1.086	8	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<4>,1|O<2>,2|H<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<4>,4|H<1>}	H(C[6]C[6]2)	118.1950	0.000	1	118.4345	1.086	8	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|H<1>,1|O<1>,2|C<4>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,3|H<1>}	H(C[6]C[6]2)	118.4380	0.000	1	118.4345	1.086	8	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1400	0.000	1	118.6165	4.642	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|N<2>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	117.0930	0.000	1	118.6165	4.642	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|N<2>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0190	0.000	1	120.0190	0.000	1	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>,1|O<1>}	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|C<4>,1|S<4>,2|H<1>}	H(C[6]C[6]2)	119.1590	0.000	1	120.1035	1.784	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,1|O<1>}	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	121.0480	0.000	1	120.1035	1.784	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]O[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]O[6]O)(H){1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.6517	0.247	7	119.6517	0.061	7	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|P<4>,2|H<1>}	H(C[6]C[6]2)	119.4420	0.000	1	119.7002	0.987	24	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,3|H<1>}	H(C[6]C[6]2)	120.1727	0.292	4	119.7002	0.987	24	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,3|H<1>}	H(C[6]C[6]2)	119.7765	0.047	2	119.7002	0.987	24	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(H){2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.7280	0.000	1	119.7002	0.987	24	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<4>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|P<4>,2|H<1>}	H(C[6]C[6]2)	118.7380	0.000	1	119.7002	0.987	24	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<4>}	C[6](C[6]C[6]H)2(H){1|C<3>,3|H<1>}	H(C[6]C[6]2)	119.7450	0.520	5	119.7002	0.987	24	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|B<4>,1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6060	0.000	1	119.7002	0.987	24	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<2>,1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.4990	0.000	1	119.7002	0.987	24	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.7400	0.000	1	119.7002	0.987	24	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|P<4>,2|H<1>}	H(C[6]C[6]2)	119.6670	0.000	1	119.7002	0.987	24	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){2|C<3>,2|H<1>}	H(C[6]C[6]2)	118.8760	0.423	2	119.7002	0.987	24	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<3>,3|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,3|H<1>}	H(C[6]C[6]2)	118.3740	3.367	2	119.7002	0.987	24	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,3|H<1>}	H(C[6]C[6]2)	120.4580	0.000	2	119.7002	0.987	24	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HN)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HN)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]C[6]N)(H){1|C<3>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	118.7980	0.018	2	118.7980	0.000	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HN)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HN)(C[6]C[6]H)(H){1|C<4>,1|O<1>,2|H<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<4>,1|N<3>,3|H<1>}	H(C[6]C[6]2)	118.6170	0.000	1	118.3295	0.165	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HN)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HN)(C[6]C[6]H)(H){1|H<1>,1|O<1>,2|C<4>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|H<1>,1|N<3>,1|O<2>,2|C<4>}	H(C[6]C[6]2)	118.0420	0.000	1	118.3295	0.165	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HN)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HN)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	118.0510	3.404	2	118.0510	11.587	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HO)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HO)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|O<2>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,2|H<1>,2|O<2>}	H(C[6]C[6]2)	118.8330	0.000	1	118.8330	0.000	1	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HO)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HO)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<4>,1|O<2>,3|H<1>}	H(C[6]C[6]2)	118.5000	0.000	1	118.9080	0.355	5	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HO)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HO)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|H<1>,2|C<4>,2|O<2>}	H(C[6]C[6]2)	119.0280	0.777	3	118.9080	0.355	5	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HO)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HO)(C[6]C[6]H)(H){1|H<1>,1|O<1>,2|C<4>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|O<2>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.9560	0.000	1	118.9080	0.355	5	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HO)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]O[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HO)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]O[6]O)(H){1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.3770	0.000	1	120.0710	0.963	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HO)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]O[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HO)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]O[6]O)(H){1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.7650	0.000	1	120.0710	0.963	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HO)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HO)(C[6]C[6]H)(H){1|C<3>,1|O<2>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|O<2>,1|S<3>}	H(C[6]C[6]2)	119.4755	0.063	2	119.7102	3.896	5	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HO)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HO)(C[6]C[6]H)(H){1|C<3>,1|O<2>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|O<2>,2|C<4>}	H(C[6]C[6]2)	119.6460	3.886	2	119.7102	3.896	5	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HO)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HO)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|O<1>,2|H<1>}	H(C[6]C[6]2)	120.3080	0.000	1	119.7102	3.896	5	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HP)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HP)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|P<4>,2|H<1>}	H(C[6]C[6]2)	118.9600	0.033	2	118.9600	0.001	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HP)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HP)(C[6]C[6]H)(H){1|C<2>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<2>,1|H<1>,1|P<4>}	H(C[6]C[6]2)	120.1720	0.000	1	120.1345	0.130	48	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HP)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HP)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<2>,1|P<4>,2|H<1>}	H(C[6]C[6]2)	120.1205	0.206	6	120.1345	0.130	48	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HP)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HP)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|P<4>,2|H<1>}	H(C[6]C[6]2)	120.1357	0.383	41	120.1345	0.130	48	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HU)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HU)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|U<11>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.4520	0.115	2	120.2260	1.472	4	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HU)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HU)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|U<16>,1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9980	0.000	1	120.2260	1.472	4	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HU)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HU)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|U<15>,1|C<3>,2|H<1>}	H(C[6]C[6]2)	122.0020	0.000	1	120.2260	1.472	4	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HW)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HW)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|O<2>,1|W<7>}	H(C[6]C[6]2)	123.5640	0.000	1	123.5640	0.000	1	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HY)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HY)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Y<10>,1|C<4>,1|H<1>,1|H<2>}	H(C[6]C[6]2)	118.5290	0.000	1	119.1675	0.261	4	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HY)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HY)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Y<17>,1|C<4>,1|H<1>,1|H<2>}	H(C[6]C[6]2)	119.3803	0.346	3	119.1675	0.261	4	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HfC)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HfC)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|Hf<10>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.0880	0.000	1	119.2102	0.034	5	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HfC)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HfC)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Hf<10>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.5340	0.000	1	119.2102	0.034	5	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HfC)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HfC)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Hf<9>,1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.1175	0.025	2	119.2102	0.034	5	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HfC)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HfC)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Hf<9>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.1940	0.000	1	119.2102	0.034	5	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HfH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HfH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Hf<10>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.9450	0.000	1	119.6930	0.127	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HfH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HfH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Hf<9>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.4410	0.000	1	119.6930	0.127	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HfN)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HfN)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Hf<10>,1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.2260	0.044	3	119.2930	0.033	12	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HfN)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HfN)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Hf<10>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7150	0.000	1	119.2930	0.033	12	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HfN)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HfN)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Hf<11>,1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.1660	0.094	3	119.2930	0.033	12	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HfN)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HfN)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Hf<9>,1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.3250	0.155	5	119.2930	0.033	12	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HfO)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HfO)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<4>}	C[6](C[6]C[6]H)2(H){1|Hf<13>,1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	122.2000	0.000	1	122.2000	0.000	1	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]IrC)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]IrC)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|Ir<9>,3|C<4>}	H(C[6]C[6]2)	119.3890	0.000	1	119.3890	0.000	1	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]IrH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]IrH)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|Ir<8>,1|B<6>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.6480	0.000	1	120.6480	0.000	1	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]IrRu)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]IrRu)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Ir<5>,1|Ru<6>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.1740	0.000	1	119.1740	0.000	1	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]LaC)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]LaC)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|H<2>}	C[6](C[6]C[6]H)2(H){1|La<18>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.0410	0.075	3	119.0410	0.006	3	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]LaH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]LaH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|La<18>,1|C<4>,1|H<1>,1|H<2>}	H(C[6]C[6]2)	119.1047	0.294	3	119.1047	0.086	3	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]LaO)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]LaO)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<4>}	C[6](C[6]C[6]H)2(H){1|La<14>,1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	118.6180	0.000	1	118.6180	0.000	1	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Li2)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Li2)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){2|Li<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	117.7310	0.051	2	117.7310	0.003	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Li2)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Li2)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){2|Li<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	117.6667	0.138	3	117.2909	0.515	12	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Li2)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Li2)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){2|Li<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	117.0831	0.808	8	117.2909	0.515	12	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Li2)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Li2)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(H){2|Li<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	117.8260	0.000	1	117.2909	0.515	12	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]LiC)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]LiC)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|Li<5>,1|C<3>,2|C<4>}	H(C[6]C[6]2)	119.2500	0.000	1	119.3683	0.031	4	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]LiC)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]LiC)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|Li<6>,3|C<4>}	H(C[6]C[6]2)	119.3360	0.000	1	119.3683	0.031	4	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]LiC)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]LiC)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Li<5>,1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.4435	0.258	2	119.3683	0.031	4	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]LiH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]LiH)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|Li<4>,1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1600	0.000	1	120.1600	0.000	1	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]LiN)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]LiN)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Li<4>,1|C<3>,1|H<1>,1|N<4>}	H(C[6]C[6]2)	118.8040	0.477	2	118.8040	0.227	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]LiNi)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]LiNi)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Li<5>,1|Ni<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.0410	0.000	1	119.1478	0.079	5	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]LiNi)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]LiNi)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Li<6>,1|Ni<7>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.3760	0.204	2	119.1478	0.079	5	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]LiNi)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]LiNi)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|Li<3>,1|Ni<7>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	118.7500	0.000	1	119.1478	0.079	5	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]LiNi)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]LiNi)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|Li<5>,1|Ni<7>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.1960	0.000	1	119.1478	0.079	5	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]LiO)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]LiO)(C[6]C[6]H)(H){1|Zn<3>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Li<5>,1|C<4>,1|H<1>,1|O<3>}	H(C[6]C[6]2)	120.9460	0.270	3	120.9460	0.073	3	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]LiTi)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]LiTi)(C[6]C[6]H)(H){1|C<2>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Li<6>,1|Ti<9>,1|C<4>}	H(C[6]C[6]2)	121.4970	0.000	1	121.4970	0.000	1	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]LiZn)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]LiZn)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<3>}	C[6](C[6]C[6]H)2(H){1|Li<5>,1|Zn<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	118.4187	0.540	3	118.4187	0.292	3	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]LuC)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]LuC)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<4>}	C[6](C[6]C[6]H)2(H){1|Lu<11>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	118.8530	0.000	1	118.8530	0.000	1	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]LuN)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]LuN)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Lu<11>,1|C<4>,1|H<1>,1|N<4>}	H(C[6]C[6]2)	120.3090	0.000	1	120.3090	0.000	1	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]MgH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]MgH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Mg<6>,1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.9710	0.000	1	120.1265	0.048	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]MgH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]MgH)(C[6]C[6]H)(H){1|Si<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Mg<7>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	120.2820	0.000	1	120.1265	0.048	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]MgSi)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]MgSi)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Mg<7>,1|Si<5>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.2180	0.000	1	119.2180	0.000	1	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]MnC)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]MnC)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Mn<8>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	118.5002	0.261	14	118.5532	0.105	15	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]MnC)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]MnC)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Mn<7>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.2950	0.000	1	118.5532	0.105	15	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]MnH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]MnH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Mn<7>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.2180	0.000	1	119.2180	0.000	1	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Mo2)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Mo2)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Mo<8>,1|Mo<9>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	118.3125	0.091	2	118.3125	0.008	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]MoC)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]MoC)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Mo<10>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.2980	0.000	1	119.4287	0.016	3	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]MoC)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]MoC)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Mo<5>,1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.4940	0.074	2	119.4287	0.016	3	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]MoH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]MoH)(C[6]C[6]H)(H){1|C<4>,1|N<2>,1|P<4>}	C[6](C[6]C[6]H)(C[6]N[6]C)(H){1|Mo<7>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.4600	0.000	1	120.4600	0.000	1	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]MoH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]MoH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Mo<10>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.6290	0.000	1	119.6265	0.000	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]MoH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]MoH)(C[6]C[6]H)(H){1|Mo<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Mo<9>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.6240	0.000	1	119.6265	0.000	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]MoN)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]MoN)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|Mo<7>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.5694	0.124	8	119.5694	0.015	8	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]MoSi)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]MoSi)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Mo<10>,1|Si<4>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.1620	0.000	1	119.1620	0.000	1	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]NU)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]NU)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|U<11>,1|C<3>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	119.5665	0.230	2	119.5665	0.053	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]NU)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]NU)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|U<16>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1623	0.219	8	119.9390	0.130	36	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]NU)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]NU)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|U<16>,1|C<4>,1|H<1>,1|N<4>}	H(C[6]C[6]2)	120.0716	0.323	9	119.9390	0.130	36	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]NU)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]NU)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|U<18>,1|C<4>,1|H<1>,1|N<4>}	H(C[6]C[6]2)	119.7523	0.282	3	119.9390	0.130	36	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]NU)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]NU)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<4>}	C[6](C[6]C[6]H)2(H){1|U<16>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9342	0.430	9	119.9390	0.130	36	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]NU)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]NU)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<4>}	C[6](C[6]C[6]H)2(H){1|U<18>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7227	0.202	3	119.9390	0.130	36	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]NU)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]NU)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|U<15>,1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.5070	0.186	4	119.9390	0.130	36	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]NV)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]NV)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>,1|V<8>}	H(C[6]C[6]2)	119.7480	0.146	2	119.9127	0.072	6	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]NV)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]NV)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<4>,1|V<9>}	H(C[6]C[6]2)	119.9950	0.293	4	119.9127	0.072	6	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]NV)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]NV)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|N<3>,1|V<9>}	H(C[6]C[6]2)	120.1110	0.167	17	120.1110	0.028	17	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]NW)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]NW)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|W<11>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7980	0.079	2	119.7980	0.006	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]NY)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]NY)(C[6]C[6]H)(H){1|C<3>,1|H<2>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Y<14>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.0120	0.000	1	119.0120	0.000	1	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]NY)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]NY)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Y<10>,1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.0740	0.136	2	119.0640	0.010	3	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]NY)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]NY)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<3>}	C[6](C[6]C[6]H)2(H){1|Y<12>,1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.0440	0.000	1	119.0640	0.010	3	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6]La)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6]La)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|La<16>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.4595	0.042	2	119.4595	0.002	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6]Th)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6]Th)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|Th<16>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.6185	0.163	2	120.0878	0.635	10	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6]Th)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6]Th)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|Th<17>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.3630	0.000	1	120.0878	0.635	10	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6]Th)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6]Th)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|Th<18>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.0765	0.043	2	120.0878	0.635	10	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6]Th)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6]Th)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|Th<21>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1920	1.020	2	120.0878	0.635	10	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6]Th)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6]Th)(C[6]C[6]H)(H){1|C<3>,1|C<5>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|Th<17>,1|H<1>,1|N<3>,2|C<4>}	H(C[6]C[6]2)	120.9510	0.000	1	120.0878	0.635	10	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6]Th)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6]Th)(C[6]C[6]H)(H){1|C<3>,1|C<5>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|Th<21>,1|C<4>,1|C<5>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8950	0.132	2	120.0878	0.635	10	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6]Ti)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6]Ti)(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|Ti<11>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.6490	0.132	2	119.6490	0.017	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6]Tm)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6]Tm)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|Tm<16>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8540	0.124	2	119.6116	0.057	5	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6]Tm)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6]Tm)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|Tm<17>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.4500	0.096	3	119.6116	0.057	5	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]NdC)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]NdC)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|H<2>}	C[6](C[6]C[6]H)2(H){1|Nd<18>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.0397	0.152	3	119.0397	0.023	3	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]NdH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]NdH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Nd<18>,1|C<4>,1|H<1>,1|H<2>}	H(C[6]C[6]2)	119.1963	0.241	3	119.1963	0.058	3	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]NdN)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]NdN)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Nd<12>,1|C<3>,1|H<1>,1|N<4>}	H(C[6]C[6]2)	119.6765	0.021	2	119.6765	0.000	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Ni2)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Ni2)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Ni<3>,1|Ni<4>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	118.7200	0.000	1	118.7200	0.000	1	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Ni2)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Ni2)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Ni<3>,1|Ni<4>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	118.7410	0.000	1	118.7410	0.000	1	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Ni2)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Ni2)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ni<7>,1|Ni<8>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.7092	0.341	4	119.4477	0.181	8	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Ni2)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Ni2)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ni<7>,1|Ni<9>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.4170	0.069	2	119.4477	0.181	8	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Ni2)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Ni2)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){2|Ni<4>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	118.6810	0.000	1	119.4477	0.181	8	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Ni2)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Ni2)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|Ni<4>,1|Ni<5>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.2300	0.000	1	119.4477	0.181	8	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]NiB)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]NiB)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Ni<5>,1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	119.0800	0.000	1	118.6750	0.148	3	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]NiB)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]NiB)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Ni<5>,1|B<4>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	118.4725	0.224	2	118.6750	0.148	3	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]NiC)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]NiC)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ni<5>,3|C<4>}	H(C[6]C[6]2)	119.5515	0.312	2	119.7543	1.406	11	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]NiC)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]NiC)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Ni<5>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.7993	1.316	9	119.7543	1.406	11	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]NiH)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]NiH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Ni<4>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.4220	0.000	1	119.4220	0.000	1	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]NiH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]NiH)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ni<5>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.3045	0.132	2	119.8681	0.575	18	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]NiH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]NiH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ni<5>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	120.0066	0.930	11	119.8681	0.575	18	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]NiH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]NiH)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Ni<6>,1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.4290	0.000	1	119.8681	0.575	18	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]NiH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]NiH)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|Ni<6>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.7680	0.000	1	119.8681	0.575	18	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]NiH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]NiH)(C[6]C[6]H)(H){1|Ni<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ni<4>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	120.0740	0.000	1	119.8681	0.575	18	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]NiH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]NiH)(C[6]C[6]H)(H){1|Ni<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ni<4>,1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.7410	0.000	1	119.8681	0.575	18	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]NiH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]NiH)(C[6]C[6]H)(H){1|Si<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ni<6>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.9310	0.000	1	119.8681	0.575	18	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]NiSi)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]NiSi)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Ni<6>,1|Si<5>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.2920	0.000	1	119.2920	0.000	1	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]OO)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]OO)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,2|O<2>}	H(C[6]C[6]2)	120.1810	0.000	1	120.1810	0.000	1	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]OO)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]OO)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|C<4>,2|O<2>}	H(C[6]C[6]2)	119.5240	0.000	1	119.4410	0.014	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]OO)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]OO)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,2|O<2>}	H(C[6]C[6]2)	119.3580	0.000	1	119.4410	0.014	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]OU)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]OU)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<3>}	C[6](C[6]C[6]H)2(H){1|U<16>,1|C<3>,1|C<4>,1|O<2>}	H(C[6]C[6]2)	119.6584	0.505	20	119.6584	0.256	20	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]OV)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]OV)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>,1|V<6>}	H(C[6]C[6]2)	121.4580	0.000	1	120.6775	1.218	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]OV)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]OV)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>,1|V<8>}	H(C[6]C[6]2)	119.8970	0.000	1	120.6775	1.218	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]OV)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]OV)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<4>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|O<2>,1|V<8>}	H(C[6]C[6]2)	120.1703	0.163	9	120.1551	0.589	34	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]OV)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]OV)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<4>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|O<2>,1|V<9>}	H(C[6]C[6]2)	119.8245	1.703	6	120.1551	0.589	34	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]OV)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]OV)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(H){1|V<12>,1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.2998	0.428	18	120.1551	0.589	34	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]OV)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]OV)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|H<1>,1|O<2>,1|V<6>}	H(C[6]C[6]2)	119.3960	0.000	1	120.1551	0.589	34	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]OW)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]OW)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<4>}	C[6](C[6]C[6]H)2(H){1|W<10>,1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.8210	0.280	2	120.8364	0.905	27	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]OW)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]OW)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|H<1>,1|O<2>,1|W<8>}	H(C[6]C[6]2)	120.8610	0.000	1	120.8364	0.905	27	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]OW)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]OW)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(H){1|W<10>,1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.7267	0.734	22	120.8364	0.905	27	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]OW)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]OW)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(H){1|W<11>,1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	123.0455	0.220	2	120.8364	0.905	27	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Os2)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Os2)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Os<7>,1|Os<9>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	118.9160	0.000	1	118.7692	0.934	12	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Os2)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Os2)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){2|Os<9>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.5380	0.000	1	118.7692	0.934	12	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Os2)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Os2)(C[6]C[6]H)(H){1|Os<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Os<5>,1|Os<6>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	118.3070	0.117	3	118.7692	0.934	12	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Os2)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Os2)(C[6]C[6]H)(H){1|Os<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){2|Os<5>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	117.5970	0.000	1	118.7692	0.934	12	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Os2)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Os2)(C[6]C[6]H)(H){1|Os<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Os<4>,1|Os<5>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.5460	0.000	1	118.7692	0.934	12	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Os2)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Os2)(C[6]C[6]H)(H){1|Os<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Os<4>,1|Os<6>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	118.1793	0.580	3	118.7692	0.934	12	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Os2)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Os2)(C[6]C[6]H)(H){1|Os<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){2|Os<5>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.5870	1.191	2	118.7692	0.934	12	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]OsC)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]OsC)(C[6]C[6]H)(H){1|Os<7>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Os<9>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.8540	0.000	1	120.2915	0.383	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]OsC)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]OsC)(C[6]C[6]H)(H){1|Os<9>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Os<9>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	120.7290	0.000	1	120.2915	0.383	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]OsRu)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]OsRu)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Os<9>,1|Ru<9>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.2300	0.000	1	119.2305	0.000	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]OsRu)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]OsRu)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|Os<9>,1|Ru<9>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.2310	0.000	1	119.2305	0.000	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]PdB)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]PdB)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Pd<5>,1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	118.9640	0.024	2	118.9223	0.005	3	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]PdB)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]PdB)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Pd<5>,1|B<4>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	118.8390	0.000	1	118.9223	0.005	3	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]PdC)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]PdC)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Pd<6>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.8300	0.000	1	119.8300	0.000	1	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]PdC)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]PdC)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|Pd<6>,3|C<4>}	H(C[6]C[6]2)	119.4640	0.000	1	119.5376	0.349	13	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]PdC)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]PdC)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Pd<4>,1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.1360	0.027	2	119.5376	0.349	13	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]PdC)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]PdC)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Pd<5>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.9075	0.167	4	119.5376	0.349	13	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]PdC)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]PdC)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Pd<6>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.4523	0.252	3	119.5376	0.349	13	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]PdC)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]PdC)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|Pd<5>,3|C<4>}	H(C[6]C[6]2)	119.3670	0.000	1	119.5376	0.349	13	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]PdC)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]PdC)(C[6]C[6]H)(H){1|Pd<6>,1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Pd<6>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	118.4495	0.537	2	119.5376	0.349	13	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]PdH)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]PdH)(C[6]C[6]H)(H){1|C<3>,2|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Pd<4>,1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.1460	0.000	1	120.1460	0.000	1	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]PdH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]PdH)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Pd<5>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.6590	0.000	1	119.9544	0.069	9	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]PdH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]PdH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Pd<5>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	120.0158	0.253	5	119.9544	0.069	9	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]PdH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]PdH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Pd<6>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.9507	0.307	3	119.9544	0.069	9	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]PdN)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]PdN)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Pd<5>,1|C<3>,1|H<1>,1|N<4>}	H(C[6]C[6]2)	122.4710	0.000	1	121.2665	2.902	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]PdN)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]PdN)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|Pd<5>,1|C<4>,2|N<3>}	H(C[6]C[6]2)	120.0620	0.000	1	121.2665	2.902	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]PrC)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]PrC)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|H<2>}	C[6](C[6]C[6]H)2(H){1|Pr<18>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.1130	0.163	3	119.1130	0.027	3	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]PrH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]PrH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Pr<18>,1|C<4>,1|H<1>,1|H<2>}	H(C[6]C[6]2)	119.0883	0.115	3	119.1246	0.614	5	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]PrH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]PrH)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|H<2>}	C[6](C[6]C[6]H)2(H){1|Pr<17>,1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	118.0790	0.000	1	119.1246	0.614	5	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]PrH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]PrH)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|Pr<17>,1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2790	0.000	1	119.1246	0.614	5	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]PtB)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]PtB)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Pt<6>,1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	118.8615	0.175	2	118.8615	0.031	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]PtC)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]PtC)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Pt<5>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.8895	0.299	2	119.8895	0.089	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]PtH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]PtH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Pt<5>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.5830	0.016	2	119.5830	0.000	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]ReC)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]ReC)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Re<8>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	118.2623	0.315	3	118.2623	0.099	3	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]ReH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]ReH)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Re<7>,1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.8280	0.000	1	119.0090	0.514	3	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]ReH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]ReH)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Re<7>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	118.5995	0.148	2	119.0090	0.514	3	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]RhB)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]RhB)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Rh<6>,1|B<4>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.2640	0.000	1	119.2640	0.000	1	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]RhC)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]RhC)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<4>}	C[6](C[6]C[6]H)2(H){1|Rh<9>,3|C<4>}	H(C[6]C[6]2)	119.8860	0.000	1	119.6457	0.050	3	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]RhC)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]RhC)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Rh<5>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.4410	0.000	1	119.6457	0.050	3	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]RhC)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]RhC)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Rh<6>,1|C<4>,1|C<5>,1|H<1>}	H(C[6]C[6]2)	119.6100	0.000	1	119.6457	0.050	3	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]RhH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]RhH)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Rh<8>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	118.5730	0.000	1	118.5730	0.000	1	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]RhH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]RhH)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Rh<6>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.9300	0.000	1	119.9200	0.254	4	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]RhH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]RhH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Rh<5>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.2260	0.000	1	119.9200	0.254	4	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]RhH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]RhH)(C[6]C[6]H)(H){1|C<3>,1|C<5>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Rh<6>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	120.1100	0.000	1	119.9200	0.254	4	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]RhH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]RhH)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|Rh<5>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.4140	0.000	1	119.9200	0.254	4	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Ru2)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Ru2)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ru<5>,1|Ru<7>,2|C<4>}	H(C[6]C[6]2)	119.5900	0.229	2	119.3757	0.164	3	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Ru2)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Ru2)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){2|Ru<6>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	118.9470	0.000	1	119.3757	0.164	3	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]RuC)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]RuC)(C[6]C[6]H)(H){1|Ru<5>,1|C<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Ru<7>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	120.2230	0.000	1	120.2230	0.000	1	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]RuC)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]RuC)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ru<7>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.2720	0.343	4	119.2841	0.151	11	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]RuC)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]RuC)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<4>}	C[6](C[6]C[6]H)2(H){1|Ru<10>,3|C<4>}	H(C[6]C[6]2)	118.9000	0.000	1	119.2841	0.151	11	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]RuC)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]RuC)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Ru<10>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.3780	0.000	1	119.2841	0.151	11	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]RuC)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]RuC)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Ru<6>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.3110	0.000	1	119.2841	0.151	11	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]RuC)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]RuC)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Ru<8>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.2140	0.000	1	119.2841	0.151	11	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]RuC)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]RuC)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Ru<9>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	118.6340	0.000	1	119.2841	0.151	11	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]RuC)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]RuC)(C[6]C[6]H)(H){1|Os<9>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ru<9>,1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.6650	0.000	1	119.2841	0.151	11	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]RuC)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]RuC)(C[6]C[6]H)(H){1|Os<9>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ru<9>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.9350	0.000	1	119.2841	0.151	11	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]RuH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]RuH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ru<10>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	118.7680	0.000	1	119.6334	0.319	8	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]RuH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]RuH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ru<6>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.5320	0.000	1	119.6334	0.319	8	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]RuH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]RuH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ru<8>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.4580	0.000	1	119.6334	0.319	8	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]RuH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]RuH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ru<9>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.3040	0.000	1	119.6334	0.319	8	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]RuH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]RuH)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|Ru<8>,1|H<2>,2|C<3>}	H(C[6]C[6]2)	120.4140	0.325	2	119.6334	0.319	8	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]RuH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]RuH)(C[6]C[6]H)(H){1|Ir<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ru<6>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.6420	0.000	1	119.6334	0.319	8	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]RuH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]RuH)(C[6]C[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ru<6>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.5350	0.000	1	119.6334	0.319	8	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]RuS)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]RuS)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<3>}	C[6](C[6]C[6]H)2(H){1|Ru<9>,1|C<4>,1|H<1>,1|S<3>}	H(C[6]C[6]2)	120.2194	0.239	8	120.2194	0.057	8	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]SY)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]SY)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Y<13>,1|C<3>,1|H<1>,1|S<3>}	H(C[6]C[6]2)	120.5580	0.000	1	120.5580	0.000	1	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]ScC)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]ScC)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<4>}	C[6](C[6]C[6]H)2(H){1|Sc<11>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.3430	0.000	1	119.3430	0.000	1	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]ScH)(C[6]C[6]H)(H)	C[6](C[6]C[6]B)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]ScH)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]B)(C[6]C[6]H)(H){1|Sc<13>,1|C<4>,1|H<1>,1|H<2>}	H(C[6]C[6]2)	121.7300	0.000	1	121.7300	0.000	1	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]ScH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]ScH)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<4>}	C[6](C[6]C[6]H)2(H){1|Sc<13>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.8100	0.000	1	119.8100	0.000	1	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]ScN)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]ScN)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|P<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Sc<9>,1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8090	0.000	1	119.8090	0.000	1	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]ScN)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]ScN)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Sc<11>,1|C<4>,1|H<1>,1|N<4>}	H(C[6]C[6]2)	119.8280	0.000	1	120.0070	0.064	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]ScN)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]ScN)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Sc<13>,1|C<4>,1|H<1>,1|N<4>}	H(C[6]C[6]2)	120.1860	0.000	1	120.0070	0.064	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]SiH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]SiH)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Si<4>,1|C<3>,2|H<1>}	H(C[6]C[6]2)	118.5265	0.258	2	118.5265	0.067	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]SiW)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]SiW)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Si<4>,1|W<10>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.4140	0.000	1	119.4140	0.000	1	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]TaC)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]TaC)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Ta<6>,1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.5710	0.518	2	119.5710	0.268	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]TaN)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]TaN)(C[6]C[6]H)(H){1|C<3>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Ta<12>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7610	0.150	2	119.7610	0.022	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]TaN)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]TaN)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|Ta<9>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9510	0.093	2	119.8712	0.666	13	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]TaN)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]TaN)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Ta<10>,1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2198	0.392	4	119.8712	0.666	13	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]TaN)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]TaN)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Ta<9>,1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.6493	1.055	7	119.8712	0.666	13	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]TaO)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]TaO)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Ta<7>,1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.7950	0.000	1	120.3260	0.256	3	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]TaO)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]TaO)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|S<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Ta<13>,1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.0915	0.428	2	120.3260	0.256	3	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]TbH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]TbH)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|H<2>}	C[6](C[6]C[6]H)2(H){1|Tb<16>,1|B<4>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	120.7985	0.355	4	120.7985	0.126	4	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]TbO)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]TbO)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(H){1|Tb<11>,1|C<3>,1|C<4>,1|O<3>}	H(C[6]C[6]2)	120.0235	0.473	2	120.2817	0.312	3	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]TbO)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]TbO)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<3>}	C[6](C[6]C[6]H)2(H){1|Tb<16>,1|C<3>,1|C<4>,1|O<3>}	H(C[6]C[6]2)	120.7980	0.000	1	120.2817	0.312	3	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]TeU)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]TeU)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Te<2>,1|U<13>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	120.4660	0.000	1	120.4660	0.000	1	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]ThC)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]ThC)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|H<2>}	C[6](C[6]C[6]H)2(H){1|Th<17>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	118.6670	0.000	1	118.9370	0.036	4	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]ThC)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]ThC)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|H<2>}	C[6](C[6]C[6]H)2(H){1|Th<20>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.0270	0.074	3	118.9370	0.036	4	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]ThH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]ThH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Th<17>,1|C<4>,1|H<1>,1|H<2>}	H(C[6]C[6]2)	119.5970	0.000	1	119.5693	0.313	6	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]ThH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]ThH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Th<20>,1|C<4>,1|H<1>,1|H<2>}	H(C[6]C[6]2)	119.2370	0.116	3	119.5693	0.313	6	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]ThH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]ThH)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|Th<21>,1|C<4>,1|H<1>,1|H<2>}	H(C[6]C[6]2)	120.0540	0.858	2	119.5693	0.313	6	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]ThN)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]ThN)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Th<16>,1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	118.8765	0.575	2	119.0097	0.218	3	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]ThN)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]ThN)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<2>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Th<14>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.2760	0.000	1	119.0097	0.218	3	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]ThN)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]ThN)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|H<2>}	C[6](C[6]C[6]H)2(H){1|Th<21>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	118.7595	0.916	2	119.7199	0.200	24	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]ThN)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]ThN)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|Th<17>,1|C<4>,1|H<1>,1|N<4>}	H(C[6]C[6]2)	119.8966	0.279	8	119.7199	0.200	24	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]ThN)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]ThN)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|Th<18>,1|C<4>,1|H<1>,1|N<4>}	H(C[6]C[6]2)	119.9947	0.351	3	119.7199	0.200	24	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]ThN)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]ThN)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<4>}	C[6](C[6]C[6]H)2(H){1|Th<17>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7042	0.280	9	119.7199	0.200	24	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]ThN)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]ThN)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<4>}	C[6](C[6]C[6]H)2(H){1|Th<18>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.6315	0.040	2	119.7199	0.200	24	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]TiC)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]TiC)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<2>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Ti<11>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.4290	0.000	1	119.4290	0.000	1	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]TiC)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]TiC)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Ti<11>,1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	121.0135	1.882	2	121.0135	3.540	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]TiH)(C[6]C[6]H)(H)	C[6](C[6]C[6]B)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]TiH)(C[6]C[6]H)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]B)(C[6]C[6]H)(H){1|Ti<12>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	120.9660	0.000	1	120.9660	0.000	1	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]TiN)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]TiN)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Ti<8>,1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.5060	0.143	4	119.9397	0.657	10	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]TiN)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]TiN)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Ti<9>,1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0640	0.016	2	119.9397	0.657	10	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]TiN)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]TiN)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|P<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Ti<6>,1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.2250	0.000	1	119.9397	0.657	10	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]TiN)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]TiN)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|P<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Ti<7>,1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6733	1.213	3	119.9397	0.657	10	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]TiN)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]TiN)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Ti<10>,1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.6350	0.212	2	119.6350	0.045	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]TiN)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]TiN)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|Ti<11>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9813	0.270	4	119.8951	0.061	13	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]TiN)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]TiN)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<3>}	C[6](C[6]C[6]H)2(H){1|Ti<11>,1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7205	0.046	2	119.8951	0.061	13	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]TiN)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]TiN)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Ti<10>,1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.0465	0.032	2	119.8951	0.061	13	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]TiN)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]TiN)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Ti<10>,1|C<3>,1|N<3>,1|P<4>}	H(C[6]C[6]2)	120.0113	0.165	3	119.8951	0.061	13	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]TiN)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]TiN)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Ti<8>,1|C<3>,1|N<3>,1|P<4>}	H(C[6]C[6]2)	119.5715	0.272	2	119.8951	0.061	13	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]TiO)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]TiO)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|S<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Ti<8>,1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.1100	0.000	1	120.1100	0.000	1	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]TiO)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]TiO)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<3>}	C[6](C[6]C[6]H)2(H){1|Ti<12>,1|C<3>,1|C<4>,1|O<2>}	H(C[6]C[6]2)	120.4892	0.173	8	120.4369	0.036	10	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]TiO)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]TiO)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<3>}	C[6](C[6]C[6]H)2(H){1|Ti<8>,1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.2275	0.073	2	120.4369	0.036	10	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]YbC)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]YbC)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Yb<15>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.6268	0.538	4	119.6268	0.290	4	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]YbH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]YbH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Yb<15>,1|C<4>,1|H<1>,1|H<2>}	H(C[6]C[6]2)	120.0220	0.000	1	120.1054	0.170	5	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]YbH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]YbH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Yb<15>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	120.1262	0.473	4	120.1054	0.170	5	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]YbN)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]YbN)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Yb<10>,1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	118.5217	0.266	8	118.5217	0.071	8	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]YbN)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]YbN)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Yb<12>,1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.0400	0.156	2	119.3301	0.181	11	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]YbN)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]YbN)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|Yb<10>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.6570	0.154	2	119.3301	0.181	11	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]YbN)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]YbN)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|Yb<15>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	118.9070	0.033	2	119.3301	0.181	11	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]YbN)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]YbN)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|Yb<16>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8200	0.146	2	119.3301	0.181	11	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]YbN)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]YbN)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<3>}	C[6](C[6]C[6]H)2(H){1|Yb<12>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	118.9050	0.000	1	119.3301	0.181	11	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]YbN)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]YbN)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<3>}	C[6](C[6]C[6]H)2(H){1|Yb<14>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.0420	0.000	1	119.3301	0.181	11	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]YbN)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]YbN)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<3>}	C[6](C[6]C[6]H)2(H){1|Yb<12>,1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.8360	0.000	1	119.3301	0.181	11	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]YbO)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]YbO)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|Yb<12>,1|C<4>,1|H<1>,1|O<3>}	H(C[6]C[6]2)	120.4590	0.000	1	120.4610	0.000	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]YbO)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]YbO)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|Yb<14>,1|C<4>,1|H<1>,1|O<3>}	H(C[6]C[6]2)	120.4630	0.000	1	120.4610	0.000	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Zn2)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Zn2)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){2|Zn<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	118.8160	0.242	2	118.8160	0.058	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]ZnH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]ZnH)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Zn<4>,1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1155	0.441	2	120.1155	0.194	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]ZrC)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]ZrC)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|Zr<10>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.0845	0.269	2	119.2965	0.212	29	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]ZrC)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]ZrC)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Zr<14>,1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.8217	0.187	3	119.2965	0.212	29	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]ZrC)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]ZrC)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Zr<15>,1|C<3>,1|C<5>,1|H<1>}	H(C[6]C[6]2)	119.4850	0.000	1	119.2965	0.212	29	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]ZrC)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]ZrC)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Zr<10>,1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.2995	0.266	4	119.2965	0.212	29	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]ZrC)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]ZrC)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Zr<10>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.1860	0.062	2	119.2965	0.212	29	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]ZrC)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]ZrC)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Zr<12>,1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	118.3330	0.033	2	119.2965	0.212	29	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]ZrC)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]ZrC)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Zr<12>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.2967	0.217	3	119.2965	0.212	29	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]ZrC)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]ZrC)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Zr<13>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.7635	0.097	4	119.2965	0.212	29	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]ZrC)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]ZrC)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Zr<8>,1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.5605	0.749	2	119.2965	0.212	29	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]ZrC)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]ZrC)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Zr<9>,1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.1870	0.217	4	119.2965	0.212	29	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]ZrC)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]ZrC)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Zr<9>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	118.7150	0.412	2	119.2965	0.212	29	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]ZrH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]ZrH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Zr<10>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.6900	0.171	2	120.3656	1.421	12	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]ZrH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]ZrH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Zr<12>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.9657	0.138	3	120.3656	1.421	12	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]ZrH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]ZrH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Zr<9>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	120.4510	0.983	2	120.3656	1.421	12	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]ZrH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]ZrH)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|Zr<14>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.5320	0.000	1	120.3656	1.421	12	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]ZrH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]ZrH)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Zr<13>,1|C<3>,2|H<1>}	H(C[6]C[6]2)	123.7680	0.000	1	120.3656	1.421	12	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]ZrH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]ZrH)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Zr<15>,1|C<3>,1|H<1>,1|H<2>}	H(C[6]C[6]2)	120.6910	0.000	2	120.3656	1.421	12	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]ZrH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]ZrH)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|Zr<15>,1|C<3>,1|H<1>,1|H<2>}	H(C[6]C[6]2)	119.5260	0.000	1	120.3656	1.421	12	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]ZrN)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]ZrN)(C[6]C[6]H)(H){1|C<2>,1|C<4>,1|H<1>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Zr<13>,1|C<3>,1|N<3>}	H(C[6]C[6]2)	107.9450	0.000	1	107.9450	0.000	1	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]ZrN)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]ZrN)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Zr<10>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.4465	0.217	2	119.4452	0.395	19	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]ZrN)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]ZrN)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Zr<11>,1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.3015	0.387	4	119.4452	0.395	19	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]ZrN)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]ZrN)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Zr<9>,1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.3710	0.221	2	119.4452	0.395	19	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]ZrN)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]ZrN)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|Zr<10>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1855	0.288	2	119.4452	0.395	19	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]ZrN)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]ZrN)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(H){1|Zr<12>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	118.1815	0.087	2	119.4452	0.395	19	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]ZrN)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]ZrN)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Zr<11>,1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.6550	0.559	6	119.4452	0.395	19	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]ZrN)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]ZrN)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Zr<14>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9540	0.000	1	119.4452	0.395	19	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]ZrO)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]ZrO)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Zr<16>,1|O<2>,2|C<4>}	H(C[6]C[6]2)	120.4093	0.142	4	120.4093	0.020	4	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]ZrO)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]ZrO)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<4>}	C[6](C[6]C[6]H)2(H){1|Zr<13>,1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.4785	0.197	2	120.5998	0.844	4	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]ZrO)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]ZrO)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|P<4>}	C[6](C[6]C[6]H)2(H){1|Zr<14>,1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.6180	0.000	1	120.5998	0.844	4	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]ZrO)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]ZrO)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Zr<13>,1|C<3>,1|O<2>,1|O<3>}	H(C[6]C[6]2)	121.8240	0.000	1	120.5998	0.844	4	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]2C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]2C[6])(C[6]C[6]H)(H){1|C<4>,1|O<1>,2|H<1>,4|C<3>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|H<1>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	118.2230	0.000	1	118.2080	0.000	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]2C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]2C[6])(C[6]C[6]H)(H){1|H<1>,1|O<1>,5|C<3>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|Se<2>,3|C<3>}	H(C[6]C[6]2)	118.1930	0.000	1	118.2080	0.000	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<1>,3|C<3>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.8485	1.538	2	118.2135	1.340	4	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]C)(C[6]C[6]H)(H){1|H<1>,1|O<1>,3|C<3>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	117.5785	0.204	2	118.2135	1.340	4	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]C)(C[6]C[6]H)(H){1|N<2>,1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]N)(H){1|C<3>,3|C<4>}	H(C[6]C[6]2)	119.4080	0.098	2	119.4080	0.010	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6]Cu)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]Cu)(C[6]C[6]H)(H){2|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|Cu<4>,1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.3410	0.000	1	119.3410	0.000	1	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6]Fe)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]Fe)(C[6]C[6]H)(H){1|Fe<5>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|Fe<6>,1|C<4>,2|C<3>}	H(C[6]C[6]2)	120.1372	1.594	5	119.4757	2.375	8	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6]Fe)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]Fe)(C[6]C[6]H)(H){1|Fe<6>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|Fe<6>,1|C<4>,2|C<3>}	H(C[6]C[6]2)	118.3733	0.562	3	119.4757	2.375	8	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]H)(C[6]C[6]H)(H){1|N<3>,1|O<1>,2|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]O)(H){1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.4323	0.308	3	119.4323	0.095	3	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]H)(C[6]C[6]H)(H){1|N<3>,2|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|Si<4>,1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.4070	0.000	1	119.4070	0.000	1	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6]N[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]H)(C[6]C[6]H)(H){1|N<3>,2|H<1>,3|C<3>}	C[6](C[6]C[6]N[5])(C[6]C[6]H)(H){1|Br<1>,1|H<1>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	119.1110	0.000	1	119.1110	0.000	1	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6]Ni)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]Ni)(C[6]C[6]H)(H){2|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|Ni<6>,1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.2790	0.000	1	119.2790	0.000	1	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6]Ta)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]Ta)(C[6]C[6]H)(H){1|C<4>,1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|Ta<7>,3|C<3>}	H(C[6]C[6]2)	119.9695	0.223	2	119.9695	0.050	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6]C)(C[6]C[6]H)(H){1|C<4>,4|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	117.5740	0.192	3	117.5740	0.037	3	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6]H)(C[6]C[6]H)(H){1|B<3>,1|H<1>,3|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.1320	0.000	1	119.0925	0.003	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6]H)(C[6]C[6]H)(H){1|H<1>,4|C<3>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.0530	0.000	1	119.0925	0.003	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]O[6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]O[6]H)(C[6]C[6]H)(H){4|C<3>}	C[6](C[6]C[5]C[6])(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>,1|O<2>,2|S<2>}	H(C[6]C[6]2)	118.5585	0.047	2	118.5585	0.002	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]AlC)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]AlC)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Al<5>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.2547	0.177	3	120.2547	0.031	3	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]AlN)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]AlN)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Al<5>,1|N<2>,2|N<3>}	H(C[6]C[6]2)	121.1380	0.000	1	121.1278	0.013	6	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]AlN)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]AlN)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Al<5>,3|N<3>}	H(C[6]C[6]2)	121.0933	0.102	3	121.1278	0.013	6	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]AlN)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]AlN)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Al<7>,1|N<2>,2|N<3>}	H(C[6]C[6]2)	121.1745	0.196	2	121.1278	0.013	6	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]CH)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]CH)(C[6]C[6]H)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|C<4>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	118.5700	0.000	1	118.5700	0.000	1	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]CH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]CH)(C[6]C[6]H)(H){1|Al<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<3>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.9820	0.310	2	119.8685	1.968	4	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]CH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]CH)(C[6]C[6]H)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	118.1040	0.000	1	119.8685	1.968	4	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]CH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]CH)(C[6]C[6]H)(H){1|Li<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|C<4>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.4060	0.000	1	119.8685	1.968	4	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]CU)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]CU)(C[6]C[6]H)(H){1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|U<13>,1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	119.0090	0.158	2	120.1967	1.483	6	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]CU)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]CU)(C[6]C[6]H)(H){1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|U<14>,1|N<3>,2|C<4>}	H(C[6]C[6]2)	120.7905	1.026	4	120.1967	1.483	6	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]CeC)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]CeC)(C[6]C[6]H)(H){1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ce<21>,1|N<3>,2|C<4>}	H(C[6]C[6]2)	120.7346	0.246	21	120.7346	0.060	21	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]CeH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]CeH)(C[6]C[6]H)(H){1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ce<20>,1|H<1>,1|N<3>,1|N<4>}	H(C[6]C[6]2)	121.3715	0.091	2	121.3715	0.008	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]CeN)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]CeN)(C[6]C[6]H)(H){1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ce<20>,1|H<1>,1|N<3>,1|N<4>}	H(C[6]C[6]2)	120.5310	0.133	2	120.5310	0.018	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]CeO)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]CeO)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(H){1|Ce<16>,1|H<1>,1|N<4>,1|O<2>}	H(C[6]C[6]2)	119.8772	0.398	6	119.9710	0.155	8	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]CeO)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]CeO)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Ce<12>,1|C<4>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.4520	0.000	1	119.9710	0.155	8	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]CeO)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]CeO)(C[6]C[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(H){1|Ce<13>,1|C<4>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.0530	0.000	1	119.9710	0.155	8	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]CoO)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]CoO)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Co<6>,1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.6090	0.000	1	120.4590	0.045	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]CoO)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]CoO)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Co<7>,1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.3090	0.000	1	120.4590	0.045	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]CrN)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]CrN)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Cr<5>,1|C<3>,2|N<3>}	H(C[6]C[6]2)	120.9185	0.152	2	121.1748	0.116	12	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]CrN)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]CrN)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Cr<6>,1|C<3>,2|N<3>}	H(C[6]C[6]2)	121.3167	0.556	3	121.1748	0.116	12	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]CrN)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]CrN)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Cr<7>,1|C<3>,2|N<3>}	H(C[6]C[6]2)	120.8180	0.052	2	121.1748	0.116	12	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]CrN)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]CrN)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Cr<8>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	121.3350	0.123	5	121.1748	0.116	12	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]CuN)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]CuN)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Cu<5>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.8280	0.000	1	120.8280	0.000	1	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]DyC)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]DyC)(C[6]C[6]H)(H){1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Dy<15>,1|N<3>,2|C<4>}	H(C[6]C[6]2)	118.8720	0.000	1	120.3766	0.728	5	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]DyC)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]DyC)(C[6]C[6]H)(H){1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Dy<17>,1|N<3>,2|C<5>}	H(C[6]C[6]2)	120.6385	0.117	2	120.3766	0.728	5	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]DyC)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]DyC)(C[6]C[6]H)(H){1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Dy<21>,1|N<3>,2|C<4>}	H(C[6]C[6]2)	120.8670	0.132	2	120.3766	0.728	5	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]ErN)(C[6]C[6]H)(H)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]ErN)(C[6]C[6]H)(H){1|Cl<1>,1|C<3>}	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|Er<15>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	119.8860	0.000	1	119.8860	0.000	1	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]ErN)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]ErN)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Er<15>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	121.3200	0.230	3	121.3200	0.053	3	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]EuN)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]EuN)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Eu<9>,1|C<4>,2|N<3>}	H(C[6]C[6]2)	120.3690	0.000	1	120.3690	0.000	1	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]FeO)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]FeO)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Fe<7>,1|C<4>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	121.4837	0.161	3	121.4290	0.029	4	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]FeO)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]FeO)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Fe<7>,1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	121.2650	0.000	1	121.4290	0.029	4	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]GdC)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]GdC)(C[6]C[6]H)(H){1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Gd<17>,1|N<3>,2|C<5>}	H(C[6]C[6]2)	120.6933	0.228	3	120.6933	0.052	3	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]HH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|S<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|N<3>,4|H<1>}	H(C[6]C[6]2)	117.9480	0.000	1	117.9480	0.000	1	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]HH)(C[6]C[6]H)(H){1|C<4>,1|O<1>,1|S<4>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|N<3>,3|H<1>}	H(C[6]C[6]2)	117.8470	0.000	1	117.8470	0.000	1	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]HH)(C[6]C[6]H)(H){1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(H){1|N<3>,4|H<1>}	H(C[6]C[6]2)	120.6710	1.382	2	121.6605	2.323	4	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]HH)(C[6]C[6]H)(H){1|Mg<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,3|H<1>}	H(C[6]C[6]2)	123.4060	0.000	1	121.6605	2.323	4	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]HH)(C[6]C[6]H)(H){1|Mg<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|N<3>,3|H<1>}	H(C[6]C[6]2)	121.8940	0.000	1	121.6605	2.323	4	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]HO)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]HO)(C[6]C[6]H)(H){1|C<4>,1|O<1>,1|S<4>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<3>,1|N<3>,1|O<2>,2|H<1>}	H(C[6]C[6]2)	117.7960	0.000	1	117.7960	0.000	1	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]HfN)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]HfN)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Hf<10>,1|C<4>,2|N<3>}	H(C[6]C[6]2)	120.6890	0.000	1	120.6745	0.000	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]HfN)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]HfN)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Hf<10>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.6600	0.000	1	120.6745	0.000	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]IrC)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]IrC)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ir<7>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6830	0.000	1	120.6830	0.000	1	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]IrN)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]IrN)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ir<7>,1|H<1>,1|N<3>,1|N<4>}	H(C[6]C[6]2)	121.1910	0.000	1	120.8620	0.216	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]IrN)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]IrN)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ir<7>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.5330	0.000	1	120.8620	0.216	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]IrO)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]IrO)(C[6]C[6]H)(H){1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(H){1|Ir<9>,1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.6000	0.000	1	120.6000	0.000	1	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]IrO)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]IrO)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ir<7>,1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.8840	0.000	1	121.1365	0.128	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]IrO)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]IrO)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ir<9>,1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	121.3890	0.000	1	121.1365	0.128	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]LaH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]LaH)(C[6]C[6]H)(H){1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|La<16>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.9805	0.571	2	120.9805	0.326	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]LiN)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]LiN)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Li<5>,1|H<1>,1|N<3>,1|N<4>}	H(C[6]C[6]2)	120.4155	0.432	2	120.3843	0.096	3	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]LiN)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]LiN)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Li<5>,3|N<3>}	H(C[6]C[6]2)	120.3220	0.000	1	120.3843	0.096	3	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]MnS)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]MnS)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Mn<7>,1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	120.7880	0.000	1	120.7880	0.000	1	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]MoN)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]MoN)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Mo<8>,1|C<3>,2|N<3>}	H(C[6]C[6]2)	122.0455	7.311	2	122.0455	53.447	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]NW)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]NW)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|W<7>,2|N<3>}	H(C[6]C[6]2)	121.6317	0.357	3	121.6317	0.128	3	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]NY)(C[6]C[6]H)(H)	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]NY)(C[6]C[6]H)(H){1|Cl<1>,1|C<3>}	C[6](C[6]C[6]Cl)(C[6]C[6]H)(H){1|Y<15>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	119.8920	0.000	1	119.8920	0.000	1	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]NdN)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]NdN)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Nd<12>,1|C<4>,2|N<3>}	H(C[6]C[6]2)	120.4667	0.250	3	120.4667	0.063	3	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]NiN)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]NiN)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ni<5>,1|N<4>,2|N<3>}	H(C[6]C[6]2)	122.4925	0.090	2	122.4925	0.008	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]NiO)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]NiO)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Cl<1>,1|Ni<6>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.3700	0.000	1	121.1595	1.247	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]NiO)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]NiO)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ni<6>,1|C<4>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	121.9490	0.000	1	121.1595	1.247	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]OsC)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]OsC)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Os<10>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.2140	0.000	1	120.8980	0.125	5	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]OsC)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]OsC)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Os<7>,1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	120.5470	0.000	1	120.8980	0.125	5	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]OsC)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]OsC)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Os<8>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.9097	0.372	3	120.8980	0.125	5	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]PdN)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]PdN)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Pd<5>,3|N<3>}	H(C[6]C[6]2)	121.4760	0.000	1	121.4760	0.000	1	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]ReS)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]ReS)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Re<8>,1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	120.9730	0.000	1	120.9730	0.000	1	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]RhN)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]RhN)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Rh<6>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.4495	0.138	2	121.0479	0.216	7	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]RhN)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]RhN)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Rh<8>,1|C<3>,2|N<3>}	H(C[6]C[6]2)	121.5340	0.170	2	121.0479	0.216	7	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]RhN)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]RhN)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Rh<9>,1|C<3>,2|N<3>}	H(C[6]C[6]2)	121.1227	0.151	3	121.0479	0.216	7	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]RhS)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]RhS)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Rh<9>,1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	120.8860	0.253	2	120.8860	0.064	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]RuC)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]RuC)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ru<10>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.2090	0.102	2	120.9906	0.190	10	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]RuC)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]RuC)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ru<7>,1|C<4>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.8525	0.018	2	120.9906	0.190	10	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]RuC)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]RuC)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ru<8>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.2297	0.017	3	120.9906	0.190	10	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]RuC)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]RuC)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ru<8>,1|C<4>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.6040	1.042	2	120.9906	0.190	10	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]RuC)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]RuC)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ru<9>,1|C<5>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	120.8860	0.000	1	120.9906	0.190	10	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]RuN)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]RuN)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ru<6>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.7850	0.000	1	121.6090	0.199	7	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]RuN)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]RuN)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ru<7>,1|C<4>,2|N<3>}	H(C[6]C[6]2)	121.3390	0.000	1	121.6090	0.199	7	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]RuN)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]RuN)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ru<7>,1|H<1>,1|N<3>,1|N<4>}	H(C[6]C[6]2)	121.6350	0.000	1	121.6090	0.199	7	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]RuN)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]RuN)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ru<7>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	121.6930	0.124	2	121.6090	0.199	7	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]RuN)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]RuN)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ru<9>,1|H<1>,1|N<3>,1|N<4>}	H(C[6]C[6]2)	122.0590	0.091	2	121.6090	0.199	7	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]RuO)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]RuO)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ru<7>,1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	121.1220	0.000	1	121.0280	0.018	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]RuO)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]RuO)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ru<7>,1|N<2>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	120.9340	0.000	1	121.0280	0.018	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]SU)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]SU)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|U<13>,1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	120.5025	0.116	4	120.5025	0.014	4	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]SW)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]SW)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>,1|W<8>}	H(C[6]C[6]2)	120.8212	0.224	4	120.8485	0.056	6	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]SW)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]SW)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|H<1>,1|N<3>,1|S<2>,1|W<9>}	H(C[6]C[6]2)	120.9030	0.345	2	120.8485	0.056	6	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]ScS)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]ScS)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Sc<13>,1|H<1>,1|N<3>,1|S<2>}	H(C[6]C[6]2)	126.1720	0.000	1	126.1720	0.000	1	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]SeW)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]SeW)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Se<2>,1|H<1>,1|N<3>,1|W<9>}	H(C[6]C[6]2)	120.9355	0.209	2	120.9355	0.044	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]SmN)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]SmN)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Sm<9>,1|C<4>,2|N<3>}	H(C[6]C[6]2)	120.6100	0.000	1	120.6100	0.000	1	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]SnN)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]SnN)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Sn<6>,1|C<4>,2|N<3>}	H(C[6]C[6]2)	121.0820	0.157	4	121.0820	0.025	4	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]TaC)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]TaC)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ta<10>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8310	0.542	2	120.7290	0.142	6	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]TaC)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]TaC)(C[6]C[6]H)(H){1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ta<14>,1|N<3>,2|C<4>}	H(C[6]C[6]2)	120.9735	0.091	2	120.7290	0.142	6	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]TaC)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]TaC)(C[6]C[6]H)(H){1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ta<14>,1|N<3>,2|C<5>}	H(C[6]C[6]2)	120.3825	0.172	2	120.7290	0.142	6	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]TaN)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]TaN)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ta<9>,3|N<3>}	H(C[6]C[6]2)	122.0145	0.083	2	122.0145	0.007	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]ThC)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]ThC)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(H){1|Th<19>,1|N<4>,2|C<4>}	H(C[6]C[6]2)	119.5230	0.000	1	120.5674	0.221	7	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]ThC)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]ThC)(C[6]C[6]H)(H){1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Th<21>,1|N<3>,2|C<4>}	H(C[6]C[6]2)	120.7415	0.106	6	120.5674	0.221	7	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]ThH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]ThH)(C[6]C[6]H)(H){1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Th<16>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6890	0.269	2	120.6257	0.128	7	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]ThH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]ThH)(C[6]C[6]H)(H){1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Th<17>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.8200	0.000	1	120.6257	0.128	7	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]ThH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]ThH)(C[6]C[6]H)(H){1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Th<18>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.9170	0.158	2	120.6257	0.128	7	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]ThH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]ThH)(C[6]C[6]H)(H){1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Th<21>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1740	0.211	2	120.6257	0.128	7	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]TiC)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]TiC)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ti<10>,1|C<5>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.7990	0.000	1	119.7990	0.000	1	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]TiN)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]TiN)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ti<7>,1|C<3>,2|N<3>}	H(C[6]C[6]2)	121.3473	0.527	4	121.2894	0.150	7	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]TiN)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]TiN)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ti<7>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	121.0940	0.000	1	121.2894	0.150	7	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]TiN)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]TiN)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ti<9>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	121.2715	0.117	2	121.2894	0.150	7	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]TiO)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]TiO)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ti<8>,1|C<4>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	121.4750	0.245	4	121.4750	0.060	4	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]TmH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]TmH)(C[6]C[6]H)(H){1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Tm<16>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.1945	0.135	2	121.1762	0.032	6	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]TmH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]TmH)(C[6]C[6]H)(H){1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Tm<17>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.1670	0.215	4	121.1762	0.032	6	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]YbC)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]YbC)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Yb<14>,1|C<4>,1|C<5>,1|N<3>}	H(C[6]C[6]2)	120.1840	0.000	1	120.1840	0.000	1	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]YbN)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]YbN)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Yb<14>,1|N<2>,2|N<3>}	H(C[6]C[6]2)	120.7480	0.000	1	120.8322	0.108	5	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]YbN)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]YbN)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Yb<15>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	121.0890	0.000	1	120.8322	0.108	5	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]YbN)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]YbN)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Yb<9>,1|C<4>,2|N<3>}	H(C[6]C[6]2)	120.2940	0.000	1	120.8322	0.108	5	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]YbN)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]YbN)(C[6]C[6]H)(H){1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){2|Yb<12>,3|N<3>}	H(C[6]C[6]2)	120.9740	0.000	1	120.8322	0.108	5	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]YbN)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]YbN)(C[6]C[6]H)(H){1|Yb<12>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){2|Yb<12>,3|N<3>}	H(C[6]C[6]2)	121.0560	0.000	1	120.8322	0.108	5	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]ZrC)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]ZrC)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Zr<14>,1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.6820	0.155	3	120.6820	0.024	3	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]ZrH)(C[6]C[6]H)(H)	C[6](C[6]B[6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]ZrH)(C[6]C[6]H)(H){1|B<3>,1|H<1>}	C[6](C[6]B[6]H)(C[6]C[6]H)(H){1|Zr<15>,1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.9670	0.000	1	120.1230	0.049	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]ZrH)(C[6]C[6]H)(H)	C[6](C[6]B[6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]ZrH)(C[6]C[6]H)(H){1|B<3>,1|H<1>}	C[6](C[6]B[6]H)(C[6]C[6]H)(H){1|Zr<15>,1|C<3>,1|H<2>,1|N<3>}	H(C[6]C[6]2)	120.2790	0.000	1	120.1230	0.049	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]ZrN)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]ZrN)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Zr<11>,1|C<3>,2|N<3>}	H(C[6]C[6]2)	120.8665	0.394	2	120.5960	0.157	4	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]ZrN)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]ZrN)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Zr<8>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.3255	0.149	2	120.5960	0.157	4	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]ZrO)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]ZrO)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(H){1|Zr<16>,1|C<3>,1|N<4>,1|O<2>}	H(C[6]C[6]2)	120.2005	0.015	2	120.2005	0.000	2	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]O[6]HO)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]O[6]HO)(C[6]C[6]H)(H){1|C<4>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(H){1|C<4>,2|H<1>,2|O<2>}	H(C[6]C[6]2)	118.9580	0.000	1	118.9580	0.000	1	119.7494	1.342	1366	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:I-1:	C[6]-3:	C[6](C[6]C[6]HO)(C[6]C[6]I)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(I)	H(C[6]C[6]2)	C[6](C[6]C[6]HO)(C[6]C[6]I)(H){1|H<1>,1|O<1>,2|C<4>}	C[6](C[6]C[6]H)(C[6]C[6]O)(I){1|O<2>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.0208	0.443	4	119.0208	0.196	4	119.0208	0.196	4	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(O)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]O)(H){1|C<3>,3|H<1>}	C[6](C[6]C[6]H)2(O){1|C<4>,1|O<2>,2|H<1>}	H(C[6]C[6]2)	100.9090	0.000	1	100.9090	0.000	1	100.9090	0.000	1	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6]H)(C[6]N[6]H)(H){1|C<2>,1|H<1>,4|C<3>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	117.6460	0.000	1	117.6460	0.000	1	118.3981	1.127	31	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]S)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6]H)(C[6]N[6]H)(H){1|H<1>,1|S<4>,3|C<3>}	C[6](C[6]C[6]H)(N[6]C[6]S)(H){2|C<3>,2|H<1>}	H(C[6]C[6]2)	117.8150	0.030	2	117.8150	0.001	2	118.3981	1.127	31	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]DH)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]DH)(C[6]N[6]H)(H){1|C<2>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<3>,1|D<1>,2|H<1>}	H(C[6]C[6]2)	118.1530	0.000	1	118.1530	0.000	1	118.3981	1.127	31	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]B[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]N[6]H)(H){1|B<3>,1|C<4>,2|H<1>}	C[6](C[6]C[6]H)(N[6]B[6]C)(H){1|C<4>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	120.0830	2.116	2	120.0830	4.476	2	118.3981	1.127	31	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]B)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]N[6]H)(H){1|B<3>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]B)(H){1|C<3>,3|H<1>}	H(C[6]C[6]2)	118.1875	0.443	2	118.1875	0.197	2	118.3981	1.127	31	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]N[6]H)(H){1|C<2>,1|C<3>,1|C<4>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,3|H<1>}	H(C[6]C[6]2)	117.7660	0.311	2	118.3060	1.745	4	118.3981	1.127	31	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.2550	0.000	1	118.3060	1.745	4	118.3981	1.127	31	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]N[6]H)(H){1|C<4>,2|C<3>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,3|H<1>}	H(C[6]C[6]2)	117.4370	0.000	1	118.3060	1.745	4	118.3981	1.127	31	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]S)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|S<4>}	C[6](C[6]C[6]H)(N[6]C[6]S)(H){1|C<3>,4|H<1>}	H(C[6]C[6]2)	118.0250	0.000	1	118.0250	0.000	1	118.3981	1.127	31	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HW)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HW)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<3>,1|C<4>,1|W<7>,2|H<1>}	H(C[6]C[6]2)	118.1000	0.874	2	117.8238	2.480	5	118.3981	1.127	31	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HW)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HW)(C[6]N[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|W<7>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	117.6397	2.110	3	117.8238	2.480	5	118.3981	1.127	31	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HW)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HW)(C[6]N[6]H)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(H){1|C<4>,1|W<7>,2|H<1>}	H(C[6]C[6]2)	118.5690	0.000	1	118.5690	0.000	1	118.3981	1.127	31	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]H)(C[6]N[6]H)(H){1|C<4>,4|C<3>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	118.5320	0.000	1	118.2145	0.202	2	118.3981	1.127	31	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]H)(C[6]N[6]H)(H){1|C<4>,4|C<3>}	C[6](C[6]C[6]H)(N[6]C[6]C)(H){2|C<3>,2|H<1>}	H(C[6]C[6]2)	117.8970	0.000	1	118.2145	0.202	2	118.3981	1.127	31	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]O)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]H)(C[6]N[6]H)(H){1|O<1>,4|C<3>}	C[6](C[6]C[6]H)(N[6]C[6]O)(H){1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.0320	0.192	2	119.0320	0.037	2	118.3981	1.127	31	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]S)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]H)(C[6]N[6]H)(H){1|C<4>,1|H<1>,1|S<4>,3|C<3>}	C[6](C[6]C[6]H)(N[6]C[6]S)(H){1|C<3>,1|C<4>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	118.9420	0.000	1	118.2348	0.276	5	118.3981	1.127	31	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]S)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]H)(C[6]N[6]H)(H){1|C<4>,1|S<4>,3|C<3>}	C[6](C[6]C[6]H)(N[6]C[6]S)(H){2|C<3>,2|H<1>}	H(C[6]C[6]2)	117.8970	0.190	2	118.2348	0.276	5	118.3981	1.127	31	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]S)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]H)(C[6]N[6]H)(H){1|H<1>,1|S<4>,2|C<3>,2|C<4>}	C[6](C[6]C[6]H)(N[6]C[6]S)(H){1|C<3>,1|C<4>,3|H<1>}	H(C[6]C[6]2)	118.6310	0.000	1	118.2348	0.276	5	118.3981	1.127	31	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]S)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]H)(C[6]N[6]H)(H){1|S<4>,4|C<3>}	C[6](C[6]C[6]H)(N[6]C[6]S)(H){2|C<3>,2|H<1>}	H(C[6]C[6]2)	117.8070	0.000	1	118.2348	0.276	5	118.3981	1.127	31	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6]H)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]N[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]H)(C[6]N[6]H)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6]H)(N[6]N[6]H)(H){1|Re<6>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.8340	0.000	1	119.8340	0.000	1	118.3981	1.127	31	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:N[6]-3:H-1:	C[6]-3:	C[6](C[6]O[6]HH)(C[6]N[6]H)(H)	C[6](C[6]C[6]H)(N[6]C[6]S)(H)	H(C[6]C[6]2)	C[6](C[6]O[6]HH)(C[6]N[6]H)(H){1|C<3>,1|S<4>}	C[6](C[6]C[6]H)(N[6]C[6]S)(H){1|C<3>,1|O<2>,2|H<1>}	H(C[6]C[6]2)	118.9665	0.083	2	118.9665	0.007	2	118.3981	1.127	31	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	N[5,6]-3:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[5,3x6]HH)(C[6]N[5,6]O)(H)	C[6](N[5,6]C[5,3x6]C[5])(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[5,3x6]HH)(C[6]N[5,6]O)(H){4|C<4>}	C[6](N[5,6]C[5,3x6]C[5])(C[6]C[6]H)(O){1|C<3>,3|C<4>,4|H<1>}	H(C[6]C[6]2)	121.4900	0.000	1	121.4900	0.000	1	121.4900	0.000	1	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	N[6,6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5a,6]HH)(C[6]N[6,6]H)(H)	C[6](N[6,6]C[5a,6,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5a,6]HH)(C[6]N[6,6]H)(H){3|C<3>}	C[6](N[6,6]C[5a,6,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|N<2>,1|N<3>,3|H<1>}	H(C[6]C[6]2)	116.5620	0.000	1	116.5620	0.000	1	116.5620	0.000	1	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]C[6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[5,6]S)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C[6a]H)(C[6]N[6]H)(H){1|C<4>,1|H<1>,1|S<4>,3|C<3>}	C[6](N[6]C[5,6]S)(C[6]C[6]H)(H){1|C<4>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	118.4345	1.240	13	118.4345	1.537	13	119.0445	1.677	55	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]C[6a]H)(C[6]N[6]H)(H)	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C[6a]H)(C[6]N[6]H)(H){1|C<4>,5|C<3>}	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<1>,3|C<3>}	H(C[6]C[6]2)	119.1585	0.135	2	119.1585	0.018	2	119.0445	1.677	55	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]CC)(C[6]N[6]H)(H)	C[6](N[6]C[6,6a]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]CC)(C[6]N[6]H)(H){1|C<4>,2|C<3>}	C[6](N[6]C[6,6a]C)(C[6]C[6]H)(H){2|C<3>,2|C<4>}	H(C[6]C[6]2)	119.2740	0.382	2	119.2740	0.146	2	119.0445	1.677	55	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2H)(C[6]N[6]H)(H)	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2H)(C[6]N[6]H)(H){2|H<1>,4|C<3>}	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	118.3000	0.020	2	118.3000	0.000	2	119.0445	1.677	55	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2N)(C[6]N[6]H)(H)	C[6](N[6]B[5a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2N)(C[6]N[6]H)(H){1|B<3>,1|H<1>,1|N<3>,3|C<3>}	C[6](N[6]B[5a]C[6])(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,3|N<3>}	H(C[6]C[6]2)	117.6345	0.274	4	117.6345	0.075	4	119.0445	1.677	55	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CH)(C[6]N[6]H)(H)	C[6](N[6]C[6]Al)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CH)(C[6]N[6]H)(H){1|Al<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Al)(C[6]C[6]H)(H){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	120.8490	0.711	8	120.8490	0.505	8	119.0445	1.677	55	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CH)(C[6]N[6]H)(H)	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CH)(C[6]N[6]H)(H){1|Fe<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Fe)(C[6]C[6]H)(H){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	118.6185	0.187	2	118.6185	0.035	2	119.0445	1.677	55	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]FeH)(C[6]N[6]H)(H)	C[6](N[6]C[6]Si)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]FeH)(C[6]N[6]H)(H){1|Si<4>,1|C<4>,1|H<1>}	C[6](N[6]C[6]Si)(C[6]C[6]H)(H){1|Fe<9>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.6360	0.000	3	119.6360	0.000	3	119.0445	1.677	55	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]N[6]H)(H)	C[6](N[6]B[5]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]N[6]H)(H){1|B<3>,1|C<3>,1|H<1>}	C[6](N[6]B[5]C[6])(C[6]C[6]H)(H){2|C<3>,2|H<1>,2|O<2>}	H(C[6]C[6]2)	119.2420	0.000	1	119.2420	0.000	1	119.0445	1.677	55	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]N[6]H)(H)	C[6](N[6]C[6]Al)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]N[6]H)(H){1|Al<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Al)(C[6]C[6]H)(H){1|C<3>,3|H<1>}	H(C[6]C[6]2)	120.0353	0.505	4	120.0353	0.255	4	119.0445	1.677	55	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]N[6]H)(H)	C[6](N[6]C[6]Mg)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]N[6]H)(H){1|Mg<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mg)(C[6]C[6]H)(H){1|C<3>,3|H<1>}	H(C[6]C[6]2)	118.5915	0.120	6	118.5982	0.118	8	119.0445	1.677	55	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]N[6]H)(H)	C[6](N[6]C[6]Mg)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]N[6]H)(H){1|Mg<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Mg)(C[6]C[6]H)(H){1|C<3>,3|H<1>}	H(C[6]C[6]2)	118.6185	0.868	2	118.5982	0.118	8	119.0445	1.677	55	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6]H)(C[6]N[6]H)(H){1|Si<4>,1|H<1>,1|N<3>,3|C<3>}	C[6](N[6]C[6a]Si[6])(C[6]C[6]H)(H){1|Cl<1>,1|C<4>,1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	115.8180	0.000	1	115.8180	0.000	1	119.0445	1.677	55	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]H)(C[6]N[6]H)(H){5|C<3>}	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(H){1|C<4>,1|H<1>,4|C<3>}	H(C[6]C[6]2)	119.7600	0.000	1	118.7340	2.105	2	119.0445	1.677	55	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]H)(C[6]N[6]H)(H){5|C<3>}	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	117.7080	0.000	1	118.7340	2.105	2	119.0445	1.677	55	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6]H)(C[6]N[6]H)(H)	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6]H)(C[6]N[6]H)(H){5|C<3>}	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>,3|C<3>}	H(C[6]C[6]2)	118.5380	0.000	1	118.5380	0.000	1	119.0445	1.677	55	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]HO)(C[6]N[6]H)(H)	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]HO)(C[6]N[6]H)(H){1|Pt<4>,1|C<3>,1|C<4>}	C[6](N[6]C[6]Pt)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	119.2670	0.000	1	119.2670	0.000	1	119.0445	1.677	55	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]OsO)(C[6]N[6]H)(H)	C[6](N[6]C[5]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]OsO)(C[6]N[6]H)(H){1|C<3>,1|C<4>}	C[6](N[6]C[5]C[6])(C[6]C[6]H)(H){1|Os<8>,1|C<4>,1|H<1>,1|N<3>,1|O<1>,2|O<2>}	H(C[6]C[6]2)	121.5960	0.000	1	121.5960	0.000	1	119.0445	1.677	55	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	C[6]-4:C[6]-3:H-1:	P[6]-3:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6,6a]CC)(C[6]P[6]Br)(H)	C[6](P[6]C[6,6a]C[6a])(C[6]C[6]H)(Br)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]CC)(C[6]P[6]Br)(H){3|C<3>}	C[6](P[6]C[6,6a]C[6a])(C[6]C[6]H)(Br){2|C<4>,4|C<3>}	H(C[6]C[6]2)	116.2425	0.098	2	116.2425	0.010	2	116.2425	0.010	2	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	N[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]CeO)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]CeO)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ce<16>,1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[6]N[6])	120.0939	0.344	8	120.0939	0.119	8	119.5609	1.743	15	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	N[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru2)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru2)(C[6]C[6]H)(H){1|C<3>,2|C<4>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ru<7>,1|Ru<9>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	118.3460	0.123	2	118.4983	0.077	3	119.5609	1.743	15	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	N[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru2)(C[6]C[6]H)(H)	C[6](C[6]C[6]C)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru2)(C[6]C[6]H)(H){1|Rh<8>,1|C<3>,1|C<4>}	C[6](C[6]C[6]C)(C[6]N[6]H)(H){1|Ru<8>,1|Ru<9>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	118.8030	0.000	1	118.4983	0.077	3	119.5609	1.743	15	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	N[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru2)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru2)(C[6]C[6]H)(H){1|Ru<9>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){2|Ru<9>,1|C<5>,1|H<1>}	H(C[6]C[6]N[6])	116.3110	0.000	1	116.3110	0.000	1	119.5609	1.743	15	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	N[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]Ru2)(C[6]C[6]H)(H)	C[6](C[6]C[6]O)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]Ru2)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<2>}	C[6](C[6]C[6]O)(C[6]N[6]H)(H){1|Ru<10>,1|Ru<8>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	118.3500	0.000	1	118.3500	0.000	1	119.5609	1.743	15	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	N[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](N[6]C[6]RuC)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(H)	H(C[6]C[6]N[6])	C[6](N[6]C[6]RuC)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(H){1|Ru<10>,1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]N[6])	121.2530	0.083	2	121.2530	0.007	2	119.5609	1.743	15	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	P[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](P[6]C[6]Cu2)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]P[6]H)(H)	H(C[6]C[6]P[6])	C[6](P[6]C[6]Cu2)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]P[6]H)(H){2|Cu<4>,1|C<3>,1|H<1>}	H(C[6]C[6]P[6])	118.6260	0.000	1	118.6260	0.000	1	118.7612	0.716	5	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	P[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](P[6]C[6]N[6]2)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]P[6]H)(H)	H(C[6]C[6]P[6])	C[6](P[6]C[6]N[6]2)(C[6]C[6]H)(H){1|C<3>,2|H<1>,4|C<4>}	C[6](C[6]C[6]H)(C[6]P[6]H)(H){1|C<3>,1|H<1>,2|N<3>}	H(C[6]C[6]P[6])	118.4780	1.556	2	118.4780	2.420	2	118.7612	0.716	5	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	P[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](P[6]C[6]RuO)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)(C[6]P[6]H)(H)	H(C[6]C[6]P[6])	C[6](P[6]C[6]RuO)(C[6]C[6]H)(H){1|C<3>,1|P<4>,2|H<1>}	C[6](C[6]C[6]H)(C[6]P[6]H)(H){1|Ru<9>,1|O<2>,2|C<4>}	H(C[6]C[6]P[6])	119.1120	0.139	2	119.1120	0.019	2	118.7612	0.716	5	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	S[6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:H-1:	C[6]-3:	C[6](S[6]C[6a]N[6]O)(C[6]C[6,6a]H)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]S[6]H)(H)	H(C[6]C[6]S[6])	C[6](S[6]C[6a]N[6]O)(C[6]C[6,6a]H)(H){4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]S[6]H)(H){1|H<1>,1|N<2>,1|O<1>,3|C<3>}	H(C[6]C[6]S[6])	119.9995	0.309	2	119.9995	0.095	2	119.9995	0.095	2	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	S[6]-4:C[6]-3:H-1:	N[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](S[6]C[6,6]OO)(C[6]N[6]H)(H)	C[6](N[6]C[6,6]H)(C[6]S[6]H)(H)	H(C[6]C[6]S[6])	C[6](S[6]C[6,6]OO)(C[6]N[6]H)(H){1|H<1>,2|C<3>}	C[6](N[6]C[6,6]H)(C[6]S[6]H)(H){2|C<3>,2|O<1>}	H(C[6]C[6]S[6])	118.2325	0.482	2	118.2325	0.232	2	118.2325	0.232	2	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:1:	3:	Si[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](Si[5,6]C[5]2C[6])(C[6]C[6]H)(H)	C[6](C[6]Si[5,6]H)(C[6]C[6]C)(H)	H(C[6]Si[5,6]C[6])	C[6](Si[5,6]C[5]2C[6])(C[6]C[6]H)(H){4|Si<4>,1|H<1>,2|C<3>,2|C<4>}	C[6](C[6]Si[5,6]H)(C[6]C[6]C)(H){2|C<3>,2|C<4>}	H(C[6]Si[5,6]C[6])	119.5450	0.000	1	119.5450	0.000	1	119.5450	0.000	1	119.7390	1.812	3133	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:2:	3:	C[3,5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[3,5,6]C[3,5,6]C[3]C[5])(C[6]C[6]O)(H)	C[6](C[6]C[3,5,6]H)(C[6]C[6]C)(OC)	H(C[6]C[3,5,6]C[6])	C[6](C[3,5,6]C[3,5,6]C[3]C[5])(C[6]C[6]O)(H){2|Cl<1>,1|C<3>,2|H<1>,3|C<4>}	C[6](C[6]C[3,5,6]H)(C[6]C[6]C)(OC){1|H<1>,3|C<4>}	H(C[6]C[3,5,6]C[6])	119.7450	0.000	1	119.7450	0.000	1	119.7450	0.000	1	118.6651	2.575	140	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:2:	3:	C[3,5,6]-4:C[6]-3:H-1:	C[6]-3:C[6a]-3:O[6]-2:	C[6]-3:	C[6](C[3,5,6]C[3,5]C[3,6]C[5])(C[6]C[6a]O[6])(H)	C[6](C[6]C[3,5,6]H)(C[6a]C[6a]2)(O[6]C[6])	H(C[6]C[3,5,6]C[6])	C[6](C[3,5,6]C[3,5]C[3,6]C[5])(C[6]C[6a]O[6])(H){2|C<4>,3|H<1>,4|C<3>}	C[6](C[6]C[3,5,6]H)(C[6a]C[6a]2)(O[6]C[6]){1|O<1>,2|C<3>,2|H<1>,3|C<4>}	H(C[6]C[3,5,6]C[6])	119.0590	0.000	1	119.0590	0.000	1	119.0590	0.000	1	118.6651	2.575	140	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:2:	3:	C[3,6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[3,6]C[3,6]C[6a]C[3])(C[6]C[6,6a]O)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[3,6]H)(OC)	H(C[6]C[3,6]C[6])	C[6](C[3,6]C[3,6]C[6a]C[3])(C[6]C[6,6a]O)(H){1|C<4>,2|H<1>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[3,6]H)(OC){1|H<1>,2|C<4>,3|C<3>}	H(C[6]C[3,6]C[6])	118.7115	0.121	4	118.7115	0.015	4	118.7115	0.015	4	118.6651	2.575	140	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:2:	3:	C[3x6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[3x6]C[3x6]C[6,6]H)(C[6]C[6]O)(H)	C[6](C[6]C[3x6]H)(C[6]C[6]O)(OC)	H(C[6]C[3x6]C[6])	C[6](C[3x6]C[3x6]C[6,6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>,1|O<1>,3|C<4>}	C[6](C[6]C[3x6]H)(C[6]C[6]O)(OC){2|C<4>,3|H<1>}	H(C[6]C[3x6]C[6])	118.9296	0.346	9	118.9748	0.127	10	118.6755	0.295	15	118.6651	2.575	140	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:2:	3:	C[3x6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[3x6]C[3x6]C[6,6]H)(C[6]C[6]O)(H)	C[6](C[6]C[3x6]H)(C[6]C[6]O)(OC)	H(C[6]C[3x6]C[6])	C[6](C[3x6]C[3x6]C[6,6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<4>,1|O<1>,3|C<4>}	C[6](C[6]C[3x6]H)(C[6]C[6]O)(OC){2|C<4>,3|H<1>}	H(C[6]C[3x6]C[6])	119.3820	0.000	1	118.9748	0.127	10	118.6755	0.295	15	118.6651	2.575	140	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:2:	3:	C[3x6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[3x6]C[5,3x6]C[6,6]H)(C[6]C[6]O)(H)	C[6](C[6]C[3x6]H)(C[6]C[5,6]O)(OC)	H(C[6]C[3x6]C[6])	C[6](C[3x6]C[5,3x6]C[6,6]H)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>,1|O<1>,3|C<4>}	C[6](C[6]C[3x6]H)(C[6]C[5,6]O)(OC){1|O<2>,2|C<4>,2|H<1>}	H(C[6]C[3x6]C[6])	118.3320	0.000	1	118.3320	0.000	1	118.6755	0.295	15	118.6651	2.575	140	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:2:	3:	C[3x6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[3x6]C[6,6,6a]C[6,6]C[6])(C[6]C[6]O)(H)	C[6](C[6]C[3x6]H)(C[6]C[6]O)(OC)	H(C[6]C[3x6]C[6])	C[6](C[3x6]C[6,6,6a]C[6,6]C[6])(C[6]C[6]O)(H){1|O<1>,2|C<3>,3|C<4>,3|H<1>}	C[6](C[6]C[3x6]H)(C[6]C[6]O)(OC){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[3x6]C[6])	117.7980	0.107	2	117.7980	0.012	2	118.6755	0.295	15	118.6651	2.575	140	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:2:	3:	C[3x6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[3x6]C[6,6a]C[3x6]C[6])(C[6]C[6]O)(H)	C[6](C[6]C[3x6]H)(C[6]C[6]O)(OC)	H(C[6]C[3x6]C[6])	C[6](C[3x6]C[6,6a]C[3x6]C[6])(C[6]C[6]O)(H){1|O<1>,2|C<3>,3|C<4>,3|H<1>}	C[6](C[6]C[3x6]H)(C[6]C[6]O)(OC){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[3x6]C[6])	118.3490	0.000	1	118.2280	0.029	2	118.6755	0.295	15	118.6651	2.575	140	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:2:	3:	C[3x6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[3x6]C[6,6a]C[3x6]C[6])(C[6]C[6]O)(H)	C[6](C[6]C[3x6]H)(C[6]C[6]O)(OC)	H(C[6]C[3x6]C[6])	C[6](C[3x6]C[6,6a]C[3x6]C[6])(C[6]C[6]O)(H){1|O<1>,2|C<4>,2|H<1>,3|C<3>}	C[6](C[6]C[3x6]H)(C[6]C[6]O)(OC){1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[3x6]C[6])	118.1070	0.000	1	118.2280	0.029	2	118.6755	0.295	15	118.6651	2.575	140	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:2:	3:	C[5,6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[5,6,6]C[5,6]2C[6])(C[6]C[6]O)(H)	C[6](C[6]C[5,6,6]H)(C[6]C[6]O)(OC)	H(C[6]C[5,6,6]C[6])	C[6](C[5,6,6]C[5,6]2C[6])(C[6]C[6]O)(H){1|C<3>,1|O<1>,1|O<2>,3|C<4>,3|H<1>}	C[6](C[6]C[5,6,6]H)(C[6]C[6]O)(OC){1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[5,6,6]C[6])	119.4650	0.000	1	119.4650	0.000	1	119.4650	0.000	1	118.6651	2.575	140	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:2:	3:	C[5,6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[5,6]C[5]N[5]N[6])(C[6]C[6,6a]O)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(OC)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5]N[5]N[6])(C[6]C[6,6a]O)(H){1|C<4>,1|N<3>,1|O<1>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,6]H)(OC){1|H<1>,2|N<3>,3|C<3>}	H(C[6]C[5,6]C[6])	118.5570	0.000	1	118.5570	0.000	1	118.5570	0.000	1	118.6651	2.575	140	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:2:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[5,6]C[5,5,6]C[5,6a]C)(C[6]C[6]O)(H)	C[6](C[6]C[5,6]H)(C[6]N[5,6]O)(OC)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,5,6]C[5,6a]C)(C[6]C[6]O)(H){1|O<1>,2|C<3>,3|N<3>}	C[6](C[6]C[5,6]H)(C[6]N[5,6]O)(OC){2|C<3>,2|C<4>}	H(C[6]C[5,6]C[6])	123.3380	0.000	1	123.3380	0.000	1	119.9536	2.558	8	118.6651	2.575	140	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:2:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[5,6]C[5,5,6]S[5]H)(C[6]C[6]O)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(OC)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,5,6]S[5]H)(C[6]C[6]O)(H){1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(OC){1|C<4>,1|S<2>,2|H<1>}	H(C[6]C[5,6]C[6])	120.3760	0.160	2	120.3760	0.026	2	119.9536	2.558	8	118.6651	2.575	140	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:2:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]O)(H)	C[6](C[6]C[5,6]H)(C[6]C[5,6]O)(OC)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]O)(H){1|H<1>,2|O<1>,3|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[5,6]O)(OC){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[5,6]C[6])	120.3530	0.000	1	120.3530	0.000	1	119.9536	2.558	8	118.6651	2.575	140	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:2:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[5,6]C[5]2C[6])(C[6]C[6]O)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(OC)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5]2C[6])(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|N<3>,1|O<2>,2|H<1>,2|O<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]O)(OC){1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[5,6]C[6])	118.3920	0.000	1	118.5973	0.038	3	119.9536	2.558	8	118.6651	2.575	140	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:2:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[5,6]C[5]2C[6])(C[6]C[6]O)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(OC)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5]2C[6])(C[6]C[6]O)(H){1|O<1>,1|O<2>,2|C<3>,2|C<4>,3|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]O)(OC){1|C<3>,1|O<2>,2|C<4>}	H(C[6]C[5,6]C[6])	118.7000	0.116	2	118.5973	0.038	3	119.9536	2.558	8	118.6651	2.575	140	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:2:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[5,6]C[5]C[6]O[5])(C[6]C[6]O)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(OC)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5]C[6]O[5])(C[6]C[6]O)(H){1|O<2>,2|O<1>,3|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]O)(OC){1|H<1>,1|O<2>,2|C<3>}	H(C[6]C[5,6]C[6])	119.3940	0.000	1	119.3940	0.000	1	119.9536	2.558	8	118.6651	2.575	140	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:2:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6a]-3:O[6]-2:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6a]O[6])(H)	C[6](C[6]C[5,6]H)(C[6a]C[6a]2)(O[6]C[6])	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6a]O[6])(H){1|C<4>,1|N<3>,1|O<1>,4|C<3>}	C[6](C[6]C[5,6]H)(C[6a]C[6a]2)(O[6]C[6]){1|C<4>,4|C<3>,4|H<1>}	H(C[6]C[5,6]C[6])	119.1350	0.000	1	118.2158	0.328	5	118.3112	0.274	9	118.6651	2.575	140	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:2:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6a]-3:O[6]-2:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6a]O[6])(H)	C[6](C[6]C[5,6]H)(C[6a]C[6a]2)(O[6]C[6])	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6a]O[6])(H){1|C<4>,6|C<3>}	C[6](C[6]C[5,6]H)(C[6a]C[6a]2)(O[6]C[6]){1|C<4>,1|O<1>,3|C<3>,3|H<1>}	H(C[6]C[5,6]C[6])	118.2205	0.114	2	118.2158	0.328	5	118.3112	0.274	9	118.6651	2.575	140	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:2:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6a]-3:O[6]-2:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6a]O[6])(H)	C[6](C[6]C[5,6]H)(C[6a]C[6a]2)(O[6]C[6])	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6a]O[6])(H){2|C<4>,3|C<3>,3|H<1>}	C[6](C[6]C[5,6]H)(C[6a]C[6a]2)(O[6]C[6]){1|O<1>,2|C<3>,2|C<4>,3|H<1>}	H(C[6]C[5,6]C[6])	117.7515	0.155	2	118.2158	0.328	5	118.3112	0.274	9	118.6651	2.575	140	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:2:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6a]-3:O[6]-2:	C[6]-3:	C[6](C[5,6]C[5,6a]C[5,6]H)(C[6]C[6a]O[6])(H)	C[6](C[6]C[5,6]H)(C[6a]C[6a]2)(O[6]C[6])	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6a]C[5,6]H)(C[6]C[6a]O[6])(H){1|C<4>,1|H<1>,5|C<3>}	C[6](C[6]C[5,6]H)(C[6a]C[6a]2)(O[6]C[6]){1|C<4>,1|O<1>,3|C<3>,3|H<1>}	H(C[6]C[5,6]C[6])	118.4305	0.509	4	118.4305	0.259	4	118.3112	0.274	9	118.6651	2.575	140	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:2:	3:	C[6,6]-4:C[6]-3:H-1:	C[5a]-3:C[6]-3:O[6]-2:	C[6]-3:	C[6](C[6,6]C[6,6]2C)(C[6]C[5a]O[6])(H)	C[6](C[5a]C[5a]2)(C[6]C[6,6]H)(O[6]C[6])	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2C)(C[6]C[5a]O[6])(H){1|H<1>,1|O<2>,2|C<4>,4|C<3>}	C[6](C[5a]C[5a]2)(C[6]C[6,6]H)(O[6]C[6]){1|C<3>,1|O<1>,1|O<2>,2|H<1>,3|C<4>}	H(C[6]C[6,6]C[6])	118.4010	0.000	1	118.4010	0.000	1	118.4010	0.000	1	118.6651	2.575	140	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:2:	3:	C[6,6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6,6]C[6]2O[6])(C[6]C[6,6a]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(CN)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6]2O[6])(C[6]C[6,6a]C)(H){2|C<3>,2|C<4>,4|H<1>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(CN){1|H<1>,1|O<2>,2|C<3>,2|C<4>}	H(C[6]C[6,6]C[6])	119.5590	0.000	1	119.5590	0.000	1	119.5590	0.000	1	118.6651	2.575	140	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:2:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6,6]C[6,6]2C)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(CN)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2C)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|O<1>,3|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]O)(CN){1|C<3>,4|C<4>}	H(C[6]C[6,6]C[6])	118.7830	0.363	3	118.9580	0.210	4	118.7003	0.287	6	118.6651	2.575	140	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:2:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6,6]C[6,6]2C)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(CN)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2C)(C[6]C[6]C)(H){1|C<3>,1|O<1>,2|H<1>,3|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]O)(CN){1|C<3>,4|C<4>}	H(C[6]C[6,6]C[6])	119.4830	0.000	1	118.9580	0.210	4	118.7003	0.287	6	118.6651	2.575	140	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:2:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(CN)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]C)(H){1|C<3>,1|O<1>,2|C<4>,2|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]O)(CN){1|C<2>,1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6,6]C[6])	118.1850	0.086	2	118.1850	0.007	2	118.7003	0.287	6	118.6651	2.575	140	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:2:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6,6]C[6,6]2N)(C[6]C[6]N)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(NN)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2N)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<1>,3|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]O)(NN){1|C<3>,1|C<4>,2|N<2>}	H(C[6]C[6,6]C[6])	118.2630	0.000	1	118.2630	0.000	1	118.9320	0.895	2	118.6651	2.575	140	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:2:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:N-2:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]Cr)(C[6]C[6]N)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(NN)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]Cr)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|O<2>,2|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(NN){1|Cr<9>,1|H<1>,2|C<4>}	H(C[6]C[6,6]C[6])	119.6010	0.000	1	119.6010	0.000	1	118.9320	0.895	2	118.6651	2.575	140	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:2:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6,6]C[5a,6]C[6,6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(OC)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5a,6]C[6,6]C)(C[6]C[6]O)(H){1|N<3>,1|O<1>,3|C<3>}	C[6](C[6]C[6,6]H)(C[6]C[6]O)(OC){1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6,6]C[6])	117.9990	0.322	4	117.9990	0.103	4	118.8527	1.432	26	118.6651	2.575	140	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:2:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]2)(C[6]C[6]O)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(OC)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]2)(C[6]C[6]O)(H){1|C<2>,1|O<1>,2|C<3>,2|C<4>,3|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(OC){1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6,6]C[6])	118.8410	0.000	1	118.8410	0.000	1	118.8527	1.432	26	118.6651	2.575	140	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:2:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(OH)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|O<1>,3|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]O)(OH){1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6,6]C[6])	117.5346	0.178	5	117.5346	0.032	5	118.8527	1.432	26	118.6651	2.575	140	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:2:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]Cr)(C[6]C[6]O)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]Ni)(OP)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]Cr)(C[6]C[6]O)(H){1|Ni<4>,1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]Ni)(OP){1|Cr<9>,1|O<2>,2|C<4>}	H(C[6]C[6,6]C[6])	120.4870	0.000	1	120.4870	0.000	1	118.8527	1.432	26	118.6651	2.575	140	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:2:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]Cr)(C[6]C[6]O)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]Pd)(OP)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]Cr)(C[6]C[6]O)(H){1|Pd<4>,1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]Pd)(OP){1|Cr<9>,1|O<2>,2|C<4>}	H(C[6]C[6,6]C[6])	120.6420	0.000	1	120.6420	0.000	1	118.8527	1.432	26	118.6651	2.575	140	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:2:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]Cr)(C[6]C[6]O)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]Pt)(OP)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]Cr)(C[6]C[6]O)(H){1|Pt<4>,1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]Pt)(OP){1|Cr<9>,1|O<2>,2|C<4>}	H(C[6]C[6,6]C[6])	120.6900	0.000	1	120.6900	0.000	1	118.8527	1.432	26	118.6651	2.575	140	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:2:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]Ru)(C[6]C[6]O)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]Ni)(OP)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]Ru)(C[6]C[6]O)(H){1|Ni<4>,1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]Ni)(OP){1|Ru<11>,1|O<2>,2|C<4>}	H(C[6]C[6,6]C[6])	120.5695	0.162	2	120.5695	0.026	2	118.8527	1.432	26	118.6651	2.575	140	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:2:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]Ru)(C[6]C[6]O)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]Pt)(OP)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]Ru)(C[6]C[6]O)(H){1|Pt<4>,1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]Pt)(OP){1|Ru<11>,1|O<2>,2|C<4>}	H(C[6]C[6,6]C[6])	120.9840	0.000	1	120.9840	0.000	1	118.8527	1.432	26	118.6651	2.575	140	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:2:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6,6]C[6,6]O[6,6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6,6]H)(C[6]C[6,6]O)(OC)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]O[6,6]C)(C[6]C[6]O)(H){1|C<4>,1|O<1>,1|O<2>,2|C<3>}	C[6](C[6]C[6,6]H)(C[6]C[6,6]O)(OC){1|H<1>,1|O<2>,3|C<4>}	H(C[6]C[6,6]C[6])	119.0870	0.000	1	119.0870	0.000	1	118.8527	1.432	26	118.6651	2.575	140	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:2:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6,6]C[6,6]O[6,6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6,6]H)(C[6]C[6,6]O)(OC)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]O[6,6]H)(C[6]C[6]O)(H){1|C<4>,1|O<1>,1|O<2>,2|C<3>}	C[6](C[6]C[6,6]H)(C[6]C[6,6]O)(OC){1|H<1>,1|O<2>,3|C<4>}	H(C[6]C[6,6]C[6])	119.8505	0.012	2	119.8505	0.000	2	118.8527	1.432	26	118.6651	2.575	140	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:2:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6,6]C[6,6]O[6]C)(C[6]C[6]O)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(OH)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]O[6]C)(C[6]C[6]O)(H){1|O<1>,3|C<3>}	C[6](C[6]C[6,6]H)(C[6]C[6]O)(OH){1|C<4>,1|O<2>,2|C<3>}	H(C[6]C[6,6]C[6])	118.6555	0.064	2	118.6555	0.004	2	118.8527	1.432	26	118.6651	2.575	140	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:2:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6,6]C[6,6a]C[5,6]C[6])(C[6]C[6]O)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(OC)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]C[5,6]C[6])(C[6]C[6]O)(H){1|C<4>,1|O<1>,1|O<2>,2|H<1>,3|C<3>}	C[6](C[6]C[6,6]H)(C[6]C[6]O)(OC){1|C<4>,1|O<2>,2|C<3>}	H(C[6]C[6,6]C[6])	118.5750	0.368	2	118.5750	0.135	2	118.8527	1.432	26	118.6651	2.575	140	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:2:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6,6]C[6,6a]C[6]2)(C[6]C[6]O)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(OC)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]C[6]2)(C[6]C[6]O)(H){1|C<4>,1|O<1>,3|C<3>,3|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]O)(OC){1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6,6]C[6])	118.4500	0.000	1	118.4500	0.000	1	118.8527	1.432	26	118.6651	2.575	140	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:2:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6,6]C[6]3)(C[6]C[6]O)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(OC)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6]3)(C[6]C[6]O)(H){1|O<1>,1|O<2>,2|C<3>,2|H<1>,3|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]O)(OC){1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6,6]C[6])	117.8470	0.000	1	118.0100	0.053	2	118.8527	1.432	26	118.6651	2.575	140	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:2:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6,6]C[6]3)(C[6]C[6]O)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(OC)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6]3)(C[6]C[6]O)(H){1|O<1>,1|O<2>,2|C<4>,2|H<1>,3|C<3>}	C[6](C[6]C[6,6]H)(C[6]C[6]O)(OC){1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6,6]C[6])	118.1730	0.000	1	118.0100	0.053	2	118.8527	1.432	26	118.6651	2.575	140	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:2:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6a]-3:O[6]-2:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6a]O[6])(H)	C[6](C[6]C[6,6]H)(C[6a]C[6a]2)(O[6]C[6])	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6a]O[6])(H){1|N<3>,1|O<1>,4|C<3>}	C[6](C[6]C[6,6]H)(C[6a]C[6a]2)(O[6]C[6]){1|C<4>,2|H<1>,5|C<3>}	H(C[6]C[6,6]C[6])	117.8460	0.000	1	117.9250	0.012	2	118.1215	0.208	15	118.6651	2.575	140	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:2:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6a]-3:O[6]-2:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6a]O[6])(H)	C[6](C[6]C[6,6]H)(C[6a]C[6a]2)(O[6]C[6])	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6a]O[6])(H){1|N<3>,2|H<1>,4|C<3>}	C[6](C[6]C[6,6]H)(C[6a]C[6a]2)(O[6]C[6]){1|C<4>,2|H<1>,5|C<3>}	H(C[6]C[6,6]C[6])	118.0040	0.000	1	117.9250	0.012	2	118.1215	0.208	15	118.6651	2.575	140	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:2:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6a]-3:O[6]-2:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6a]O[6])(H)	C[6](C[6]C[6,6]H)(C[6a]C[6a]2)(O[6]C[6])	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6a]O[6])(H){1|O<2>,3|H<1>,4|C<3>}	C[6](C[6]C[6,6]H)(C[6a]C[6a]2)(O[6]C[6]){1|O<1>,2|C<3>,2|C<4>,3|H<1>}	H(C[6]C[6,6]C[6])	118.5570	0.083	2	118.5570	0.007	2	118.1215	0.208	15	118.6651	2.575	140	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:2:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6a]-3:O[6]-2:	C[6]-3:	C[6](C[6,6]C[6,6a]C[6,6]H)(C[6]C[6a]O[6])(H)	C[6](C[6]C[6,6]H)(C[6a]C[6a]2)(O[6]C[6])	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]C[6,6]H)(C[6]C[6a]O[6])(H){1|C<4>,1|H<1>,5|C<3>}	C[6](C[6]C[6,6]H)(C[6a]C[6a]2)(O[6]C[6]){1|C<4>,1|O<1>,3|C<3>,3|H<1>}	H(C[6]C[6,6]C[6])	119.0005	0.064	2	118.6880	0.295	3	118.1215	0.208	15	118.6651	2.575	140	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:2:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6a]-3:O[6]-2:	C[6]-3:	C[6](C[6,6]C[6,6a]C[6,6]H)(C[6]C[6a]O[6])(H)	C[6](C[6]C[6,6]H)(C[6a]C[6a]2)(O[6]C[6])	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]C[6,6]H)(C[6]C[6a]O[6])(H){1|H<1>,2|C<4>,4|C<3>}	C[6](C[6]C[6,6]H)(C[6a]C[6a]2)(O[6]C[6]){3|C<3>,3|C<4>,3|H<1>}	H(C[6]C[6,6]C[6])	118.0630	0.000	1	118.6880	0.295	3	118.1215	0.208	15	118.6651	2.575	140	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:2:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6a]-3:O[6]-2:	C[6]-3:	C[6](C[6,6]C[6,6a]C[6]O[6])(C[6]C[6a]O[6])(H)	C[6](C[6]C[6,6]H)(C[6a]C[6a]2)(O[6]C[6,6a])	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]C[6]O[6])(C[6]C[6a]O[6])(H){1|C<4>,2|H<1>,5|C<3>}	C[6](C[6]C[6,6]H)(C[6a]C[6a]2)(O[6]C[6,6a]){1|C<4>,1|H<1>,2|O<2>,4|C<3>}	H(C[6]C[6,6]C[6])	118.0750	0.000	1	117.8494	0.043	8	118.1215	0.208	15	118.6651	2.575	140	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:2:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6a]-3:O[6]-2:	C[6]-3:	C[6](C[6,6]C[6,6a]C[6]O[6])(C[6]C[6a]O[6])(H)	C[6](C[6]C[6,6]H)(C[6a]C[6a]2)(O[6]C[6,6a])	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]C[6]O[6])(C[6]C[6a]O[6])(H){1|C<4>,2|H<1>,5|C<3>}	C[6](C[6]C[6,6]H)(C[6a]C[6a]2)(O[6]C[6,6a]){1|C<4>,1|O<2>,2|H<1>,4|C<3>}	H(C[6]C[6,6]C[6])	117.6233	0.057	3	117.8494	0.043	8	118.1215	0.208	15	118.6651	2.575	140	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:2:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6a]-3:O[6]-2:	C[6]-3:	C[6](C[6,6]C[6,6a]C[6]O[6])(C[6]C[6a]O[6])(H)	C[6](C[6]C[6,6]H)(C[6a]C[6a]2)(O[6]C[6,6a])	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]C[6]O[6])(C[6]C[6a]O[6])(H){1|H<1>,6|C<3>}	C[6](C[6]C[6,6]H)(C[6a]C[6a]2)(O[6]C[6,6a]){1|H<1>,2|O<2>,5|C<3>}	H(C[6]C[6,6]C[6])	117.9625	0.109	4	117.8494	0.043	8	118.1215	0.208	15	118.6651	2.575	140	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:2:	3:	C[6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6a]2N[6])(C[6]C[6,6a]S)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(SC)	H(C[6]C[6]2)	C[6](C[6]C[6a]2N[6])(C[6]C[6,6a]S)(H){1|S<4>,6|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(SC){1|H<1>,1|N<3>,4|C<3>}	H(C[6]C[6]2)	119.6340	0.000	1	119.6340	0.000	1	119.1717	0.428	3	118.6651	2.575	140	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:2:	3:	C[6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:S-2:	C[6]-3:	C[6](C[6]C[6a]2O[6])(C[6]C[6,6a]S)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(SC)	H(C[6]C[6]2)	C[6](C[6]C[6a]2O[6])(C[6]C[6,6a]S)(H){6|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(SC){1|H<1>,1|O<2>,4|C<3>}	H(C[6]C[6]2)	118.9405	0.732	2	118.9405	0.536	2	119.1717	0.428	3	118.6651	2.575	140	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:2:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CC)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(CC){1|C<3>,3|H<1>}	H(C[6]C[6]2)	119.4260	0.000	1	119.4260	0.000	1	119.4260	0.000	1	118.6651	2.575	140	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:2:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[5,6]C[6]Pd)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(OC)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C[6]Pd)(C[6]C[6]O)(H){1|C<3>,1|H<1>,2|C<4>,2|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(OC){1|Pd<5>,1|C<3>,1|C<5>,1|H<1>}	H(C[6]C[6]2)	119.3020	0.000	1	119.3020	0.000	1	119.8724	1.284	21	118.6651	2.575	140	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:2:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]2Ru)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]2Ru)(C[6]C[6]O)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6]H)2(OC){1|Ru<10>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	119.8310	0.035	2	119.8310	0.001	2	119.8724	1.284	21	118.6651	2.575	140	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:2:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]CC)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]CC)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)2(OC){1|C<3>,3|C<4>}	H(C[6]C[6]2)	119.8512	1.934	6	119.8512	3.742	6	119.8724	1.284	21	118.6651	2.575	140	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:2:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]O)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]O)(H){2|C<3>,2|H<1>}	C[6](C[6]C[6]C)(C[6]C[6]H)(OC){1|C<4>,1|O<1>,2|H<1>}	H(C[6]C[6]2)	119.9740	0.000	1	119.9740	0.000	1	119.8724	1.284	21	118.6651	2.575	140	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:2:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]O)(H){1|O<1>,3|C<4>}	C[6](C[6]C[6]H)(C[6]C[6]O)(OH){1|C<4>,4|H<1>}	H(C[6]C[6]2)	118.7450	0.000	1	118.7450	0.000	1	119.8724	1.284	21	118.6651	2.575	140	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:2:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]HO)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]HO)(C[6]C[6]O)(H){1|C<4>,1|O<1>,2|H<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(OC){1|C<4>,1|O<2>,3|H<1>}	H(C[6]C[6]2)	118.8290	0.000	1	118.8290	0.000	1	119.8724	1.284	21	118.6651	2.575	140	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:2:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]HY)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]HY)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(OC){1|Y<14>,1|C<4>,1|H<1>,1|H<2>}	H(C[6]C[6]2)	120.1890	0.000	1	120.1890	0.000	1	119.8724	1.284	21	118.6651	2.575	140	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:2:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]N[6]Ru)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6]Ru)(C[6]C[6]O)(H){1|Ru<8>,1|C<3>,1|C<4>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)2(OC){1|Ru<10>,1|C<4>,1|H<1>,1|N<4>}	H(C[6]C[6]2)	120.5920	0.000	1	120.5920	0.000	1	119.8724	1.284	21	118.6651	2.575	140	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:2:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]NiH)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]NiH)(C[6]C[6]O)(H){1|Ni<3>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(OC){1|Ni<4>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	120.2480	0.000	1	120.2480	0.000	1	119.8724	1.284	21	118.6651	2.575	140	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:2:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]PtC)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]PtC)(C[6]C[6]O)(H){1|H<1>,2|C<4>}	C[6](C[6]C[6]H)2(OC){1|Pt<6>,3|C<4>}	H(C[6]C[6]2)	119.9690	0.195	2	119.9690	0.038	2	119.8724	1.284	21	118.6651	2.575	140	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:2:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]Ru2)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]Ru2)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(OC){1|Ru<5>,1|Ru<7>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.9440	0.000	1	119.9440	0.000	1	119.8724	1.284	21	118.6651	2.575	140	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:2:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]TaN)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)2(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]TaN)(C[6]C[6]O)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(OC){1|Ta<12>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.9640	0.195	2	120.9640	0.038	2	119.8724	1.284	21	118.6651	2.575	140	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:2:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:O-2:	C[6]-3:	C[6](C[6]O[6]CH)(C[6]C[6]O)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(OC)	H(C[6]C[6]2)	C[6](C[6]O[6]CH)(C[6]C[6]O)(H){1|C<4>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(OC){1|C<4>,2|H<1>,2|O<2>}	H(C[6]C[6]2)	118.8630	0.000	1	118.8630	0.000	1	119.8724	1.284	21	118.6651	2.575	140	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:2:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:Se-2:	C[6]-3:	C[6](C[6]C[6a]2C[6])(C[6]C[6]Se)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(SeSe)	H(C[6]C[6]2)	C[6](C[6]C[6a]2C[6])(C[6]C[6]Se)(H){1|H<1>,1|O<1>,5|C<3>}	C[6](C[6]C[6]H)(C[6]C[6]O)(SeSe){1|H<1>,3|C<3>}	H(C[6]C[6]2)	117.7130	0.000	1	117.7130	0.000	1	117.7130	0.000	1	118.6651	2.575	140	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:2:	3:	C[6]-4:C[6]-3:H-1:	C[6a]-3:C[6]-3:N[6]-2:	C[6]-3:	C[6](C[6]C[6]N[6]Mn)(C[6]C[6a]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6]N[6]Mn)(C[6]C[6a]N[6])(H){1|C<4>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]){1|Mn<8>,1|N<3>,2|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	121.0350	0.000	1	121.0350	0.000	1	120.2500	1.232	2	118.6651	2.575	140	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:2:	3:	C[6]-4:C[6]-3:H-1:	C[6a]-3:C[6]-3:N[6]-2:	C[6]-3:	C[6](C[6]C[6a]N[6]H)(C[6]C[6a]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6]H)(C[6]C[6a]N[6])(H){1|H<1>,5|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]){1|N<2>,2|C<3>,2|N<3>,3|H<1>}	H(C[6]C[6]2)	119.4650	0.000	1	119.4650	0.000	1	120.2500	1.232	2	118.6651	2.575	140	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:2:	3:	C[6]-4:C[6]-3:H-1:	C[6a]-3:C[6]-3:O[6]-2:	C[6]-3:	C[6](C[6]C[6a]C[6]H)(C[6]C[6a]O[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(O[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]H)(C[6]C[6a]O[6])(H){1|C<4>,1|H<1>,5|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(O[6]C[6]){1|C<4>,1|O<1>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.2003	0.420	3	118.9465	0.173	6	118.6485	0.749	8	118.6651	2.575	140	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:2:	3:	C[6]-4:C[6]-3:H-1:	C[6a]-3:C[6]-3:O[6]-2:	C[6]-3:	C[6](C[6]C[6a]C[6]H)(C[6]C[6a]O[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(O[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]H)(C[6]C[6a]O[6])(H){1|C<4>,1|N<3>,5|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(O[6]C[6]){1|C<4>,1|O<1>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	118.5430	0.000	1	118.9465	0.173	6	118.6485	0.749	8	118.6651	2.575	140	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:2:	3:	C[6]-4:C[6]-3:H-1:	C[6a]-3:C[6]-3:O[6]-2:	C[6]-3:	C[6](C[6]C[6a]C[6]H)(C[6]C[6a]O[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(O[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]H)(C[6]C[6a]O[6])(H){6|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(O[6]C[6]){1|C<4>,3|H<1>,4|C<3>}	H(C[6]C[6]2)	118.7675	0.301	2	118.9465	0.173	6	118.6485	0.749	8	118.6651	2.575	140	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:2:	3:	C[6]-4:C[6]-3:H-1:	C[6a]-3:C[6]-3:O[6]-2:	C[6]-3:	C[6](C[6]C[6a]C[6]H)(C[6]C[6a]O[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(O[6]P[6])	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]H)(C[6]C[6a]O[6])(H){1|H<1>,1|P<4>,5|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(O[6]P[6]){1|C<4>,1|O<1>,1|O<2>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	116.6940	0.000	1	116.6940	0.000	1	118.6485	0.749	8	118.6651	2.575	140	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:2:	3:	C[6]-4:C[6]-3:H-1:	C[6a]-3:C[6]-3:O[6]-2:	C[6]-3:	C[6](C[6]C[6a]N[6]H)(C[6]C[6a]O[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(O[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6]H)(C[6]C[6a]O[6])(H){1|H<1>,5|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(O[6]C[6]){2|N<3>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	118.8150	0.000	1	118.8150	0.000	1	118.6485	0.749	8	118.6651	2.575	140	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:2:	3:	C[6]-4:C[6]-3:H-1:	C[6a]-3:C[6]-3:S[6]-2:	C[6]-3:	C[6](C[6]C[6a]C[6]C)(C[6]C[6a]S[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(S[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]C)(C[6]C[6a]S[6])(H){1|H<1>,5|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(S[6]C[6]){1|C<4>,2|H<1>,5|C<3>}	H(C[6]C[6]2)	115.8892	0.348	6	115.8892	0.121	6	115.9984	0.176	8	118.6651	2.575	140	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:2:	3:	C[6]-4:C[6]-3:H-1:	C[6a]-3:C[6]-3:S[6]-2:	C[6]-3:	C[6](C[6]C[6a]C[6]H)(C[6]C[6a]S[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(S[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]H)(C[6]C[6a]S[6])(H){3|C<4>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(S[6]C[6]){1|C<4>,3|C<3>,5|H<1>}	H(C[6]C[6]2)	116.3260	0.581	2	116.3260	0.338	2	115.9984	0.176	8	118.6651	2.575	140	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:2:	3:	C[6]-4:C[6]-3:H-1:	C[6a]-3:C[6]-3:Se[6]-2:	C[6]-3:	C[6](C[6]C[6a]C[6]2)(C[6]C[6a]Se[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(Se[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]2)(C[6]C[6a]Se[6])(H){1|C<2>,1|H<1>,6|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(Se[6]C[6]){2|H<1>,6|C<3>}	H(C[6]C[6]2)	111.0430	4.748	2	113.1317	24.357	3	113.1317	24.357	3	118.6651	2.575	140	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:2:	3:	C[6]-4:C[6]-3:H-1:	C[6a]-3:C[6]-3:Se[6]-2:	C[6]-3:	C[6](C[6]C[6a]C[6]2)(C[6]C[6a]Se[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(Se[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]2)(C[6]C[6a]Se[6])(H){7|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(Se[6]C[6]){1|C<2>,2|H<1>,5|C<3>}	H(C[6]C[6]2)	117.3090	0.000	1	113.1317	24.357	3	113.1317	24.357	3	118.6651	2.575	140	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:2:	3:	C[6]-4:C[6]-3:H-1:	N[6]-3:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]CC)(C[6]N[6]C)(H)	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(CN)	H(C[6]C[6]2)	C[6](C[6]C[6]CC)(C[6]N[6]C)(H){2|C<3>,2|H<1>}	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(CN){1|O<1>,2|C<3>,3|C<4>}	H(C[6]C[6]2)	118.6600	0.000	1	118.6600	0.000	1	118.6600	0.000	1	118.6651	2.575	140	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:2:	3:	Si[6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:O-2:	C[6]-3:	C[6](Si[6]C[6,6a]CC)(C[6]C[6,6a]O)(H)	C[6](C[6,6a]C[6,6a,6a]C[6a])(C[6]Si[6]H)(OC[6a])	H(C[6]Si[6]C[6])	C[6](Si[6]C[6,6a]CC)(C[6]C[6,6a]O)(H){3|C<3>}	C[6](C[6,6a]C[6,6a,6a]C[6a])(C[6]Si[6]H)(OC[6a]){1|H<1>,2|C<4>,3|C<3>}	H(C[6]Si[6]C[6])	119.1610	0.000	1	119.1610	0.000	1	119.1610	0.000	1	118.6651	2.575	140	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:3:	3:	B[6]-4:C[6]-3:H-1:	S[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](B[6]C[6a]2C[6])(C[6]S[6]C)(H)	C[6](S[6]C[6a]C[6])(C[6]B[6]H)(CCC)	H(C[6]B[6]C[6])	C[6](B[6]C[6a]2C[6])(C[6]S[6]C)(H){7|C<3>}	C[6](S[6]C[6a]C[6])(C[6]B[6]H)(CCC){6|C<3>}	H(C[6]B[6]C[6])	114.5950	0.000	1	114.5950	0.000	1	114.5950	0.000	1	118.5663	1.894	100	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:3:	3:	B[6]-4:C[6]-3:H-1:	S[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](B[6]C[6a]2C[6])(C[6]C[6a]S[6])(H)	C[6](S[6]C[6a]C[6])(C[6a]C[6a]2)(C[6]B[6]H)	H(C[6]B[6]C[6])	C[6](B[6]C[6a]2C[6])(C[6]C[6a]S[6])(H){9|C<3>}	C[6](S[6]C[6a]C[6])(C[6a]C[6a]2)(C[6]B[6]H){2|H<1>,8|C<3>}	H(C[6]B[6]C[6])	114.8890	0.000	1	114.8890	0.000	1	114.8890	0.000	1	118.5663	1.894	100	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:3:	3:	C[4,6]-4:C[6]-3:H-1:	C[6]-3:C[6a]-3:N[6]-3:	C[6]-3:	C[6](C[4,6]C[4,6a]C[4,6]H)(C[6]C[6a]N[6])(H)	C[6](C[6]C[4,6]H)(C[6a]C[6a]2)(N[6]C[6]C)	H(C[6]C[4,6]C[6])	C[6](C[4,6]C[4,6a]C[4,6]H)(C[6]C[6a]N[6])(H){1|C<4>,1|H<1>,5|C<3>}	C[6](C[6]C[4,6]H)(C[6a]C[6a]2)(N[6]C[6]C){1|C<4>,4|C<3>,4|H<1>}	H(C[6]C[4,6]C[6])	118.8020	0.000	1	118.8020	0.000	1	118.8020	0.000	1	118.5663	1.894	100	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:3:	3:	C[5,3x6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:C[6a]-3:	C[6]-3:	C[6](C[5,3x6]C[5,3x6]C[5,6,6]2)(C[6]C[6,6a]C[6a])(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,3x6]H)(C[6a]C[6a]2)	H(C[6]C[5,3x6]C[6])	C[6](C[5,3x6]C[5,3x6]C[5,6,6]2)(C[6]C[6,6a]C[6a])(H){2|C<4>,8|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[5,3x6]H)(C[6a]C[6a]2){1|C<4>,3|H<1>,6|C<3>}	H(C[6]C[5,3x6]C[6])	116.8630	0.000	1	116.8630	0.000	1	116.8630	0.000	1	118.5663	1.894	100	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:3:	3:	C[5,6]-4:C[6]-3:H-1:	C[5,6]-3:C[6]-3:C[6a]-3:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[5,6]C[6a])(H)	C[6](C[5,6]C[5,5,6]C[5])(C[6]C[5,6]H)(C[6a]C[6a]2)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[5,6]C[6a])(H){2|C<4>,6|C<3>}	C[6](C[5,6]C[5,5,6]C[5])(C[6]C[5,6]H)(C[6a]C[6a]2){1|C<4>,1|N<2>,3|H<1>,6|C<3>}	H(C[6]C[5,6]C[6])	120.3160	0.000	1	120.3160	0.000	1	120.3160	0.000	1	118.5663	1.894	100	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:3:	3:	C[5,6]-4:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C[6a]-3:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]N[5])(C[6]C[6,6]C[6a])(H)	C[6](C[6,6]C[6,6a]C[6,6])(C[6]C[5,6]H)(C[6a]C[6a]2)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]N[5])(C[6]C[6,6]C[6a])(H){3|H<1>,4|C<3>,4|C<4>}	C[6](C[6,6]C[6,6a]C[6,6])(C[6]C[5,6]H)(C[6a]C[6a]2){1|N<3>,2|H<1>,3|C<4>,4|C<3>}	H(C[6]C[5,6]C[6])	118.0760	0.000	1	118.0760	0.000	1	118.0760	0.000	1	118.5663	1.894	100	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:3:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Pd)(C[6]C[6]C)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]Br)(CCH)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Pd)(C[6]C[6]C)(H){1|Br<1>,1|C<3>,3|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]Br)(CCH){1|Pd<7>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.0790	0.000	1	119.9860	0.017	2	119.9860	0.017	2	118.5663	1.894	100	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:3:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Pd)(C[6]C[6]C)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]Br)(CCH)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Pd)(C[6]C[6]C)(H){1|Br<1>,2|C<3>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]Br)(CCH){1|Pd<7>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	119.8930	0.000	1	119.9860	0.017	2	119.9860	0.017	2	118.5663	1.894	100	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:3:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C[6a]-3:	C[6]-3:	C[6](C[5,6]O[5,6]O[5]H)(C[6]C[6a]C[6])(H)	C[6](C[6]C[5,6]H)(C[6]C[5,6]O)(C[6a]C[6a]2)	H(C[6]C[5,6]C[6])	C[6](C[5,6]O[5,6]O[5]H)(C[6]C[6a]C[6])(H){1|O<1>,2|C<3>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[5,6]O)(C[6a]C[6a]2){1|C<4>,1|N<3>,2|C<3>,2|O<2>,3|H<1>}	H(C[6]C[5,6]C[6])	119.7790	0.027	2	119.7790	0.001	2	119.7790	0.001	2	118.5663	1.894	100	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:3:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[5,6]C[5,6a]C[5]C[6])(C[6]C[6a]C[6])(H)	C[6](C[6]C[5,6]H)(C[6a]C[6a]2)(C[6]C[6]O)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6a]C[5]C[6])(C[6]C[6a]C[6])(H){1|C<4>,1|N<3>,2|H<1>,2|O<1>,4|C<3>}	C[6](C[6]C[5,6]H)(C[6a]C[6a]2)(C[6]C[6]O){2|C<4>,3|H<1>,4|C<3>}	H(C[6]C[5,6]C[6])	116.3780	0.000	1	116.3780	0.000	1	117.5460	2.728	2	118.5663	1.894	100	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:3:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[5,6]N[5,6]C[5]H)(C[6]C[6a]C[6])(H)	C[6](C[6]C[5,6]H)(C[6a]C[6a]2)(C[6]C[6]C)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]C[5]H)(C[6]C[6a]C[6])(H){1|C<4>,1|H<1>,1|N<3>,2|C<2>,3|C<3>}	C[6](C[6]C[5,6]H)(C[6a]C[6a]2)(C[6]C[6]C){1|C<4>,2|C<3>,2|N<3>,3|H<1>}	H(C[6]C[5,6]C[6])	118.7140	0.000	1	118.7140	0.000	1	117.5460	2.728	2	118.5663	1.894	100	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:3:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6a]-3:N[6]-3:	C[6]-3:	C[6](C[5,6]C[5,6a]C[5]C[6])(C[6]C[6a]N[6])(H)	C[6](C[6]C[5,6]H)(C[6a]C[6a]2)(N[6]C[6]S)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6a]C[5]C[6])(C[6]C[6a]N[6])(H){1|C<4>,1|H<1>,1|N<3>,1|O<1>,1|S<4>,5|C<3>}	C[6](C[6]C[5,6]H)(C[6a]C[6a]2)(N[6]C[6]S){1|C<4>,1|O<1>,2|H<1>,4|C<3>}	H(C[6]C[5,6]C[6])	119.1940	0.000	1	119.1940	0.000	1	119.1940	0.000	1	118.5663	1.894	100	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:3:	3:	C[5,6]-4:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[5,6]O[5,6]C[5]H)(C[6]C[6a]C[6])(H)	C[6](C[6a]C[6a]N[6a])(C[6]C[5,6]H)(C[6]C[5,6]O)	H(C[6]C[5,6]C[6])	C[6](C[5,6]O[5,6]C[5]H)(C[6]C[6a]C[6])(H){1|C<3>,1|C<4>,1|N<2>,1|O<1>,1|O<2>,2|H<1>}	C[6](C[6a]C[6a]N[6a])(C[6]C[5,6]H)(C[6]C[5,6]O){1|C<4>,1|N<3>,2|C<3>,2|H<1>,2|O<2>}	H(C[6]C[5,6]C[6])	119.8345	0.146	2	119.8345	0.021	2	119.9123	0.029	3	118.5663	1.894	100	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:3:	3:	C[5,6]-4:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[5,6]O[5,6]O[5]H)(C[6]C[6a]C[6])(H)	C[6](C[6a]C[6a]N[6a])(C[6]C[5,6]H)(C[6]C[5,6]O)	H(C[6]C[5,6]C[6])	C[6](C[5,6]O[5,6]O[5]H)(C[6]C[6a]C[6])(H){1|C<3>,1|N<2>,1|O<1>,2|C<4>}	C[6](C[6a]C[6a]N[6a])(C[6]C[5,6]H)(C[6]C[5,6]O){1|C<4>,1|N<3>,2|C<3>,2|H<1>,2|O<2>}	H(C[6]C[5,6]C[6])	120.0680	0.000	1	120.0680	0.000	1	119.9123	0.029	3	118.5663	1.894	100	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:3:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(CCO)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|O<1>,3|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]O)(CCO){1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6,6]C[6])	116.6335	0.234	2	116.6335	0.055	2	118.0194	1.683	5	118.5663	1.894	100	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:3:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]Cr)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(CCH)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]Cr)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|O<2>,2|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(CCH){1|Cr<9>,1|H<1>,2|C<4>}	H(C[6]C[6,6]C[6])	118.9433	0.371	3	118.9433	0.138	3	118.0194	1.683	5	118.5663	1.894	100	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:3:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(NC[6a]H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]N)(H){1|O<1>,2|H<1>,4|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]O)(NC[6a]H){2|C<4>,3|H<1>}	H(C[6]C[6,6]C[6])	118.2383	0.253	4	118.2383	0.064	4	118.7579	0.231	10	118.5663	1.894	100	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:3:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]Ru)(C[6]C[6]N)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]N)(NRuH)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]Ru)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|N<3>,2|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]N)(NRuH){1|Ru<11>,1|H<1>,2|C<4>}	H(C[6]C[6,6]C[6])	119.1043	0.130	6	119.1043	0.017	6	118.7579	0.231	10	118.5663	1.894	100	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:3:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6a]-3:N[6]-3:	C[6]-3:	C[6](C[6,6]O[6,6]O[6]C)(C[6]C[6a]N[6])(H)	C[6](C[6]C[6,6]H)(C[6a]C[6a]2)(N[6]C[6,6]N)	H(C[6]C[6,6]C[6])	C[6](C[6,6]O[6,6]O[6]C)(C[6]C[6a]N[6])(H){1|C<4>,1|N<3>,3|C<3>}	C[6](C[6]C[6,6]H)(C[6a]C[6a]2)(N[6]C[6,6]N){2|O<2>,3|H<1>,4|C<3>}	H(C[6]C[6,6]C[6])	118.4650	0.000	1	118.4650	0.000	1	118.4650	0.000	1	118.5663	1.894	100	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:3:	3:	C[6,6]-4:C[6]-3:H-1:	N[5a,6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6,6]C[3x6]C[6]C)(C[6]N[5a,6]C)(H)	C[6](N[5a,6]C[5a,6,6]C[5a,6a])(C[6]C[6,6]H)(COO)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[3x6]C[6]C)(C[6]N[5a,6]C)(H){1|C<4>,1|N<4>,2|C<3>,3|H<1>}	C[6](N[5a,6]C[5a,6,6]C[5a,6a])(C[6]C[6,6]H)(COO){3|C<3>,3|C<4>}	H(C[6]C[6,6]C[6])	118.0760	0.000	1	118.0760	0.000	1	118.0760	0.000	1	118.5663	1.894	100	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6a]O[6]O)(C[6]C[6,6]C)(H)	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6]H)(CC[6a]O)	H(C[6]C[6]2)	C[6](C[6]C[6a]O[6]O)(C[6]C[6,6]C)(H){1|C<4>,3|C<3>}	C[6](C[6,6]C[5,6]C[6,6])(C[6]C[6]H)(CC[6a]O){2|O<2>,5|C<3>}	H(C[6]C[6]2)	119.9000	0.000	1	119.9000	0.000	1	119.9000	0.000	1	118.5663	1.894	100	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6a]N[6]H)(C[6]C[6,6a]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6]H)(C[6]C[6,6a]C)(H){1|C<4>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(COO){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	118.2320	0.000	1	118.2320	0.000	1	118.2320	0.000	1	118.5663	1.894	100	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[5]C[6]O)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CCC)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6]O)(C[6]C[6]C)(H){1|O<1>,2|H<1>,4|C<4>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CCC){1|O<2>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	117.3080	0.000	1	117.3080	0.000	1	118.2880	0.701	8	118.5663	1.894	100	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){1|C<3>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CHN){1|C<2>,1|O<2>,2|H<1>}	H(C[6]C[6]2)	119.4020	0.000	1	119.4020	0.000	1	118.2880	0.701	8	118.5663	1.894	100	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(CCC)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){1|C<3>,1|N<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]C)(CCC){1|C<4>,1|S<4>,2|H<1>}	H(C[6]C[6]2)	117.9245	0.111	2	117.9245	0.012	2	118.2880	0.701	8	118.5663	1.894	100	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]O)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){1|N<3>,1|O<1>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]O)(CNO){2|C<4>,2|H<1>}	H(C[6]C[6]2)	117.3020	0.000	1	117.3020	0.000	1	118.2880	0.701	8	118.5663	1.894	100	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CC[6a]N)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(CC[6a]N){1|C<3>,3|H<1>}	H(C[6]C[6]2)	119.4210	0.000	1	119.4210	0.000	1	118.2880	0.701	8	118.5663	1.894	100	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6a]C[6]H)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]O[6]O)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]H)(C[6]C[6]C)(H){1|H<1>,1|O<1>,1|O<2>,3|C<3>}	C[6](C[6]C[6]H)(C[6]O[6]O)(COO){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	118.5110	0.272	2	118.5110	0.074	2	118.2880	0.701	8	118.5663	1.894	100	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]AgH)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(NC[6a]2)	H(C[6]C[6]2)	C[6](C[6]C[6]AgH)(C[6]C[6]N)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(NC[6a]2){1|Ag<5>,1|C<3>,2|H<1>}	H(C[6]C[6]2)	120.0820	0.000	1	120.0820	0.000	1	119.9695	0.448	6	118.5663	1.894	100	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]HN)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]C[6]S)(NOO)	H(C[6]C[6]2)	C[6](C[6]C[6]HN)(C[6]C[6]N)(H){1|C<3>,1|H<1>,1|S<4>}	C[6](C[6]C[6]H)(C[6]C[6]S)(NOO){1|C<3>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.3170	1.120	2	120.3170	1.255	2	119.9695	0.448	6	118.5663	1.894	100	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6a]C[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)(C[6]O[6]O)(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]H)(C[6]C[6]N)(H){1|O<1>,1|O<2>,2|C<3>,2|H<1>}	C[6](C[6]C[6]H)(C[6]O[6]O)(NCC){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.1280	0.000	1	119.1280	0.000	1	119.9695	0.448	6	118.5663	1.894	100	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]N[6]HP)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(NCC)	H(C[6]C[6]2)	C[6](C[6]N[6]HP)(C[6]C[6]N)(H){1|Si<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NCC){1|N<3>,1|P<4>,2|H<1>}	H(C[6]C[6]2)	120.0910	0.000	1	120.0910	0.000	1	119.9695	0.448	6	118.5663	1.894	100	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](C[6]N[6]ZrH)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(NCC)	H(C[6]C[6]2)	C[6](C[6]N[6]ZrH)(C[6]C[6]N)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(NCC){1|Zr<13>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.8820	0.000	1	119.8820	0.000	1	119.9695	0.448	6	118.5663	1.894	100	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6]C)(C[6]C[6]N[6])(H)	C[6](C[6]C[6]N[6])(N[6]C[6]Al)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]C)(C[6]C[6]N[6])(H){1|Al<5>,1|H<1>,1|N<2>,1|N<3>,3|C<3>}	C[6](C[6]C[6]N[6])(N[6]C[6]Al)(C[6]C[6]H){1|C<4>,1|H<1>,5|C<3>}	H(C[6]C[6]2)	118.3310	0.030	2	118.3310	0.001	2	118.3310	0.001	2	118.5663	1.894	100	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5,6]C[6a]H)(C[6]C[6a]C[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]C)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C[6a]H)(C[6]C[6a]C[6])(H){1|C<2>,1|C<4>,6|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]C)(C[6]C[6]H){1|C<4>,1|N<3>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	118.0820	0.000	1	118.0820	0.000	1	118.6968	0.398	9	118.5663	1.894	100	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]2N[6])(C[6]C[6a]C[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]C)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]2N[6])(C[6]C[6a]C[6])(H){1|C<2>,1|H<1>,7|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]C)(C[6]C[6]H){1|N<3>,2|H<1>,5|C<3>}	H(C[6]C[6]2)	119.7390	0.000	1	118.9987	0.573	3	118.6968	0.398	9	118.5663	1.894	100	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]2N[6])(C[6]C[6a]C[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]C)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]2N[6])(C[6]C[6a]C[6])(H){9|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]C)(C[6]C[6]H){1|N<3>,3|H<1>,4|C<3>}	H(C[6]C[6]2)	118.6285	0.569	2	118.9987	0.573	3	118.6968	0.398	9	118.5663	1.894	100	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6]C)(C[6]C[6a]C[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]C)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]C)(C[6]C[6a]C[6])(H){3|C<2>,5|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]C)(C[6]C[6]H){1|N<3>,2|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	118.9080	0.000	1	118.9080	0.000	1	118.6968	0.398	9	118.5663	1.894	100	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6]C)(C[6]C[6a]C[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]C)(C[6]C[6a]C[6])(H){2|H<1>,6|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{2|C<4>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	117.9810	0.000	1	117.9810	0.000	1	118.6968	0.398	9	118.5663	1.894	100	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6]H)(C[6]C[6a]C[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]C)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6]H)(C[6]C[6a]C[6])(H){1|S<4>,6|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]C)(C[6]C[6]H){1|N<3>,3|H<1>,4|C<3>}	H(C[6]C[6]2)	118.9780	0.000	1	118.9780	0.000	1	118.6968	0.398	9	118.5663	1.894	100	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6]H)(C[6]C[6a]C[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6]H)(C[6]C[6a]C[6])(H){1|H<1>,6|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|N<3>,3|H<1>,4|C<3>}	H(C[6]C[6]2)	119.2740	0.000	1	119.2740	0.000	1	118.6968	0.398	9	118.5663	1.894	100	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[6a]-3:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]S[6]C)(C[6]C[6a]C[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6a]S[6]C)(C[6]C[6a]C[6])(H){1|H<1>,5|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)2{1|C<4>,1|S<2>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	118.0520	0.000	1	118.0520	0.000	1	118.6968	0.398	9	118.5663	1.894	100	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[6a]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6]H)(C[6]C[6a]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]C)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]H)(C[6]C[6a]N[6])(H){1|C<4>,1|H<1>,6|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]C){1|C<4>,1|O<1>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.3790	0.000	1	120.1080	1.063	2	119.1495	1.868	17	118.5663	1.894	100	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[6a]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6]H)(C[6]C[6a]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]C)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]H)(C[6]C[6a]N[6])(H){1|C<4>,1|N<3>,6|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]C){1|C<4>,1|O<1>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.8370	0.000	1	120.1080	1.063	2	119.1495	1.868	17	118.5663	1.894	100	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[6a]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6]H)(C[6]C[6a]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]H)(C[6]C[6a]N[6])(H){1|C<2>,2|H<1>,5|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]H){1|C<4>,1|O<1>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	120.2010	0.000	1	118.8827	0.655	6	119.1495	1.868	17	118.5663	1.894	100	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[6a]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6]H)(C[6]C[6a]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]H)(C[6]C[6a]N[6])(H){1|C<4>,1|H<1>,1|N<2>,5|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]H){1|C<4>,1|O<1>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	117.7940	0.000	1	118.8827	0.655	6	119.1495	1.868	17	118.5663	1.894	100	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[6a]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6]H)(C[6]C[6a]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]H)(C[6]C[6a]N[6])(H){1|H<1>,1|N<2>,6|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]H){1|C<4>,1|O<1>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.1180	0.000	1	118.8827	0.655	6	119.1495	1.868	17	118.5663	1.894	100	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[6a]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6]H)(C[6]C[6a]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]H)(C[6]C[6a]N[6])(H){1|H<1>,6|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]H){3|H<1>,5|C<3>}	H(C[6]C[6]2)	118.5950	0.344	2	118.8827	0.655	6	119.1495	1.868	17	118.5663	1.894	100	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[6a]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6]H)(C[6]C[6a]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]H)(C[6]C[6a]N[6])(H){3|H<1>,5|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]H){1|C<4>,1|O<1>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	118.9930	0.000	1	118.8827	0.655	6	119.1495	1.868	17	118.5663	1.894	100	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[6a]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6]H)(C[6]C[6a]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]S)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]H)(C[6]C[6a]N[6])(H){1|C<4>,1|S<4>,2|H<1>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]S){1|C<4>,1|O<2>,3|C<3>,4|H<1>}	H(C[6]C[6]2)	122.8560	0.000	1	120.0395	5.380	4	119.1495	1.868	17	118.5663	1.894	100	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[6a]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6]H)(C[6]C[6a]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]S)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]H)(C[6]C[6a]N[6])(H){1|H<1>,1|S<4>,6|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]S){1|C<4>,1|O<1>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	119.1007	1.668	3	120.0395	5.380	4	119.1495	1.868	17	118.5663	1.894	100	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[6a]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6]H)(C[6]C[6a]N[6])(H)	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)(N[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]H)(C[6]C[6a]N[6])(H){1|C<2>,1|H<1>,1|N<2>,4|C<3>}	C[6](C[6a]C[6a]N[6a])(C[6]C[6]H)(N[6]C[6]H){2|H<1>,5|C<3>}	H(C[6]C[6]2)	118.7920	0.000	2	118.7920	0.000	2	119.1495	1.868	17	118.5663	1.894	100	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[6a]-3:C[6]-3:N[6]-3:	C[6]-3:	C[6](C[6]C[6a]N[6]H)(C[6]C[6a]N[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6]H)(C[6]C[6a]N[6])(H){2|H<1>,5|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(N[6]C[6]H){1|N<3>,1|S<1>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	118.0957	0.439	3	118.0957	0.193	3	119.1495	1.868	17	118.5663	1.894	100	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[6a]-3:C[6]-3:S[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6]C)(C[6]C[6a]S[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]H)(S[6]C[6]O)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]C)(C[6]C[6a]S[6])(H){1|H<1>,1|O<1>,5|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]H)(S[6]C[6]O){1|C<4>,2|H<1>,5|C<3>}	H(C[6]C[6]2)	115.5710	0.330	4	115.5710	0.109	4	115.5710	0.109	4	118.5663	1.894	100	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[6a]-3:N[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]N[6]Mn)(C[6]C[6a]N[6])(H)	C[6](C[6a]C[6a]2)(N[6]C[6]Mn)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6]Mn)(C[6]C[6a]N[6])(H){1|Mn<6>,1|C<4>,4|C<3>}	C[6](C[6a]C[6a]2)(N[6]C[6]Mn)(C[6]C[6]H){1|Mn<8>,1|C<4>,1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	121.0060	0.000	1	121.0060	0.000	1	121.0060	0.000	1	118.5663	1.894	100	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[6a]-3:O[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[5,6]C[6a]H)(C[6]C[6a]O[6])(H)	C[6](C[6a]C[6a]2)(O[6]B[6]Li)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C[6a]H)(C[6]C[6a]O[6])(H){1|Li<3>,1|B<4>,6|C<3>}	C[6](C[6a]C[6a]2)(O[6]B[6]Li)(C[6]C[6]H){1|C<4>,3|H<1>,5|C<3>}	H(C[6]C[6]2)	117.1035	0.012	2	117.1035	0.000	2	117.1035	0.000	2	118.5663	1.894	100	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:3:	3:	C[6]-4:C[6]-3:H-1:	N[5a,6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6]C[6a]H)(C[6]N[5a,6]C[6a])(H)	C[6](N[5a,6]C[5a,6,6]C[5a,6a])(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]C[6a]H)(C[6]N[5a,6]C[6a])(H){1|C<4>,1|H<1>,6|C<3>}	C[6](N[5a,6]C[5a,6,6]C[5a,6a])(C[6a]C[6a]2)(C[6]C[6]H){1|C<4>,3|H<1>,6|C<3>}	H(C[6]C[6]2)	118.4420	0.000	1	118.4420	0.000	1	118.4420	0.000	1	118.5663	1.894	100	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:3:	3:	C[6]-4:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[5,6]C[6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[5,6]S)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C[6a]H)(C[6]N[6]C)(H){1|H<1>,1|S<4>,2|C<3>,2|C<4>}	C[6](N[6]C[5,6]S)(C[6]C[6]H)(COO){1|C<4>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	117.6910	0.000	1	117.6910	0.000	1	118.1458	0.353	5	118.5663	1.894	100	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:3:	3:	C[6]-4:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6]C[6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[6,6]S)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6,6]C[6a]H)(C[6]N[6]C)(H){1|H<1>,1|S<4>,2|C<3>,2|C<4>}	C[6](N[6]C[6,6]S)(C[6]C[6]H)(COO){1|C<3>,1|C<4>,1|O<2>,2|H<1>}	H(C[6]C[6]2)	117.7800	0.000	1	117.7800	0.000	1	118.1458	0.353	5	118.5663	1.894	100	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:3:	3:	C[6]-4:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6]HH)(C[6]N[6]C)(H)	C[6](N[6]C[6,6]Ni)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6,6]HH)(C[6]N[6]C)(H){1|Ni<4>,2|C<3>}	C[6](N[6]C[6,6]Ni)(C[6]C[6]H)(CCN){1|C<3>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	118.9330	0.000	1	118.9330	0.000	1	118.1458	0.353	5	118.5663	1.894	100	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:3:	3:	C[6]-4:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]CH)(C[6]N[6]C)(H)	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CCN)	H(C[6]C[6]2)	C[6](C[6]C[6]CH)(C[6]N[6]C)(H){1|Zn<4>,1|C<3>,1|H<1>}	C[6](N[6]C[6]Zn)(C[6]C[6]H)(CCN){1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	118.6370	0.000	1	118.6370	0.000	1	118.1458	0.353	5	118.5663	1.894	100	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:3:	3:	C[6]-4:C[6]-3:H-1:	N[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](C[6]N[5a,6]C[6a]H)(C[6]N[6]C)(H)	C[6](N[6]C[5a,6]H)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]N[5a,6]C[6a]H)(C[6]N[6]C)(H){1|H<1>,1|N<2>,3|C<3>}	C[6](N[6]C[5a,6]H)(C[6]C[6]H)(COO){1|C<3>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	117.6880	0.000	1	117.6880	0.000	1	118.1458	0.353	5	118.5663	1.894	100	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:3:	3:	C[6]-4:C[6]-3:H-1:	N[6]-3:C[6]-3:O-3:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]N[6]O)(H)	C[6](N[6]C[6]Si)(C[6]C[6]H)(OLiC)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]N[6]O)(H){1|Si<5>,1|C<4>,2|H<1>}	C[6](N[6]C[6]Si)(C[6]C[6]H)(OLiC){1|C<4>,4|H<1>}	H(C[6]C[6]2)	119.4090	0.000	1	119.4090	0.000	1	119.4090	0.000	1	118.5663	1.894	100	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:3:	3:	C[6]-4:C[6]-3:H-1:	N[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6]H)(C[6]C[6a]N[6])(H)	C[6](N[6]C[6a]C[6])(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]H)(C[6]C[6a]N[6])(H){1|H<1>,7|C<3>}	C[6](N[6]C[6a]C[6])(C[6a]C[6a]2)(C[6]C[6]H){1|C<4>,1|O<1>,3|H<1>,5|C<3>}	H(C[6]C[6]2)	118.4020	0.000	1	118.4020	0.000	1	117.8325	0.165	4	118.5663	1.894	100	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:3:	3:	C[6]-4:C[6]-3:H-1:	N[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](C[6]N[5a,6]C[6a]H)(C[6]C[6a]N[6])(H)	C[6](N[6]C[5a,6]H)(C[6a]C[6a]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]N[5a,6]C[6a]H)(C[6]C[6a]N[6])(H){1|H<1>,1|N<2>,5|C<3>}	C[6](N[6]C[5a,6]H)(C[6a]C[6a]2)(C[6]C[6]H){1|N<2>,1|N<3>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	117.6427	0.175	3	117.6427	0.031	3	117.8325	0.165	4	118.5663	1.894	100	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:3:	3:	P[6]-4:C[6]-3:H-1:	N[6]-3:C[6a]-3:C[6]-3:	C[6]-3:	C[6](P[6]C[6,6a]C[6a]2)(C[6]C[6a]N[6])(H)	C[6](N[6]C[6,6a]C[6a])(C[6a]C[6a]2)(C[6]P[6]H)	H(C[6]C[6]P[6])	C[6](P[6]C[6,6a]C[6a]2)(C[6]C[6a]N[6])(H){9|C<3>}	C[6](N[6]C[6,6a]C[6a])(C[6a]C[6a]2)(C[6]P[6]H){2|H<1>,8|C<3>}	H(C[6]C[6]P[6])	118.4610	0.000	1	118.4610	0.000	1	118.4610	0.000	1	118.5663	1.894	100	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:3:	3:	Si[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](Si[5,6]C[5]2C[6])(C[6]C[6]C)(H)	C[6](C[6]Si[5,6]H)(C[6]C[6]C)(CCC)	H(C[6]Si[5,6]C[6])	C[6](Si[5,6]C[5]2C[6])(C[6]C[6]C)(H){4|Si<4>,1|H<1>,2|C<3>,2|C<4>}	C[6](C[6]Si[5,6]H)(C[6]C[6]C)(CCC){1|C<3>,3|C<4>}	H(C[6]Si[5,6]C[6])	117.8400	0.000	1	117.8400	0.000	1	117.1445	0.967	2	118.5663	1.894	100	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:3:	3:	Si[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-3:	C[6]-3:	C[6](Si[5,6]C[5]2C[6])(C[6]C[6]C)(H)	C[6](C[6]Si[5,6]H)(C[6]C[6]C)(CCH)	H(C[6]Si[5,6]C[6])	C[6](Si[5,6]C[5]2C[6])(C[6]C[6]C)(H){4|Si<4>,1|H<1>,2|C<3>,2|C<4>}	C[6](C[6]Si[5,6]H)(C[6]C[6]C)(CCH){1|C<3>,1|H<1>,2|C<4>}	H(C[6]Si[5,6]C[6])	116.4490	0.000	1	116.4490	0.000	1	117.1445	0.967	2	118.5663	1.894	100	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:3:	3:	Si[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](Si[6]N[6]Br2)(C[6]C[6]N)(H)	C[6](C[6]Si[6]H)(C[6]C[6]H)(NC[6a]H)	H(C[6]Si[6]C[6])	C[6](Si[6]N[6]Br2)(C[6]C[6]N)(H){1|H<1>,2|C<3>}	C[6](C[6]Si[6]H)(C[6]C[6]H)(NC[6a]H){2|Br<1>,1|C<4>,1|N<3>}	H(C[6]Si[6]C[6])	120.4830	0.000	1	120.4830	0.000	1	120.2165	0.142	2	118.5663	1.894	100	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:3:	3:	Si[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:N-3:	C[6]-3:	C[6](Si[6]N[6]Br2)(C[6]C[6]N)(H)	C[6](C[6]Si[6]H)(C[6]C[6]H)(NC[6a]Si)	H(C[6]Si[6]C[6])	C[6](Si[6]N[6]Br2)(C[6]C[6]N)(H){1|H<1>,2|C<3>}	C[6](C[6]Si[6]H)(C[6]C[6]H)(NC[6a]Si){2|Br<1>,1|C<4>,1|N<3>}	H(C[6]Si[6]C[6])	119.9500	0.000	1	119.9500	0.000	1	120.2165	0.142	2	118.5663	1.894	100	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	B[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](B[6]C[6]MgN)(C[6]C[6]C)(H)	C[6](C[6]B[6]H)(C[6]C[6]H)(CH3)	H(C[6]B[6]C[6])	C[6](B[6]C[6]MgN)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]B[6]H)(C[6]C[6]H)(CH3){1|Mg<6>,1|C<3>,1|C<4>,1|N<4>}	H(C[6]B[6]C[6])	116.1283	3.253	4	116.1283	10.583	4	116.1283	10.583	4	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[3,5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[3,5,6]C[3,5,6]C[3]C[5])(C[6]C[6]C)(H)	C[6](C[6]C[3,5,6]H)(C[6]C[6]O)(CClHH)	H(C[6]C[3,5,6]C[6])	C[6](C[3,5,6]C[3,5,6]C[3]C[5])(C[6]C[6]C)(H){2|Cl<1>,1|C<3>,1|O<2>,2|C<4>,2|H<1>}	C[6](C[6]C[3,5,6]H)(C[6]C[6]O)(CClHH){1|H<1>,3|C<4>}	H(C[6]C[3,5,6]C[6])	118.8780	0.000	1	118.8780	0.000	1	118.7330	0.042	2	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[3,5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[3,5,6]C[3,5]C[3,6]C[5])(C[6]C[6]C)(H)	C[6](C[6]C[3,5,6]H)(C[6]C[6]H)(CH3)	H(C[6]C[3,5,6]C[6])	C[6](C[3,5,6]C[3,5]C[3,6]C[5])(C[6]C[6]C)(H){1|C<3>,1|O<2>,3|C<4>,3|H<1>}	C[6](C[6]C[3,5,6]H)(C[6]C[6]H)(CH3){4|C<4>}	H(C[6]C[3,5,6]C[6])	118.5880	0.000	1	118.5880	0.000	1	118.7330	0.042	2	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[3,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[3,6]C[3,5,6]P[3,5]C)(C[6]C[6]C)(H)	C[6](C[6]C[3,6]H)(C[6]C[6]H)(CH3)	H(C[6]C[3,6]C[6])	C[6](C[3,6]C[3,5,6]P[3,5]C)(C[6]C[6]C)(H){1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[3,6]H)(C[6]C[6]H)(CH3){1|P<3>,3|C<4>}	H(C[6]C[3,6]C[6])	117.9060	0.000	1	117.9060	0.000	1	118.2326	0.060	8	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[3,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[3,6]C[3,5]C[3]C[6])(C[6]C[6]C)(H)	C[6](C[6]C[3,6]H)(C[6]C[6]O)(CC3)	H(C[6]C[3,6]C[6])	C[6](C[3,6]C[3,5]C[3]C[6])(C[6]C[6]C)(H){1|O<1>,2|H<1>,4|C<3>}	C[6](C[6]C[3,6]H)(C[6]C[6]O)(CC3){1|C<3>,3|C<4>}	H(C[6]C[3,6]C[6])	118.3110	0.458	2	118.3110	0.210	2	118.2326	0.060	8	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[3,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[3,6]C[3]2C[6])(C[6]C[6]C)(H)	C[6](C[6]C[3,6]H)(C[6]C[6]O)(CC3)	H(C[6]C[3,6]C[6])	C[6](C[3,6]C[3]2C[6])(C[6]C[6]C)(H){1|O<1>,3|C<3>,3|H<1>}	C[6](C[6]C[3,6]H)(C[6]C[6]O)(CC3){1|C<3>,3|C<4>}	H(C[6]C[3,6]C[6])	118.2666	0.145	5	118.2666	0.021	5	118.2326	0.060	8	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[3,6]-4:C[6]-3:H-1:	N[5,6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[3,6]C[3]H[3]N[6])(C[6]N[5,6]C)(H)	C[6](N[5,6]C[5,6]N[5])(C[6]C[3,6]H)(CH3)	H(C[6]C[3,6]C[6])	C[6](C[3,6]C[3]H[3]N[6])(C[6]N[5,6]C)(H){1|C<3>,1|N<2>,2|H<1>}	C[6](N[5,6]C[5,6]N[5])(C[6]C[3,6]H)(CH3){1|C<3>,1|C<4>,1|H<2>,1|N<2>,1|N<3>}	H(C[6]C[3,6]C[6])	119.6400	0.000	1	119.6400	0.000	1	119.6400	0.000	1	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[3x6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[3x6]C[3x6]2C)(C[6]C[6]C)(H)	C[6](C[6]C[3x6]H)(C[6]C[5,6]O)(CH3)	H(C[6]C[3x6]C[6])	C[6](C[3x6]C[3x6]2C)(C[6]C[6]C)(H){1|H<1>,1|O<1>,2|C<3>,3|C<4>}	C[6](C[6]C[3x6]H)(C[6]C[5,6]O)(CH3){1|O<2>,4|C<4>}	H(C[6]C[3x6]C[6])	116.6680	0.000	1	116.6680	0.000	1	116.9108	0.118	8	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[3x6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[3x6]C[3x6]2C)(C[6]C[6]C)(H)	C[6](C[6]C[3x6]H)(C[6]C[6]O)(CH3)	H(C[6]C[3x6]C[6])	C[6](C[3x6]C[3x6]2C)(C[6]C[6]C)(H){1|H<1>,1|O<1>,2|C<3>,3|C<4>}	C[6](C[6]C[3x6]H)(C[6]C[6]O)(CH3){1|O<2>,4|C<4>}	H(C[6]C[3x6]C[6])	116.8960	0.000	1	116.8960	0.000	1	116.9108	0.118	8	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[3x6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[3x6]C[3x6]2C[6a])(C[6]C[6]C)(H)	C[6](C[6]C[3x6]H)(C[6]C[5,6]O)(CCHH)	H(C[6]C[3x6]C[6])	C[6](C[3x6]C[3x6]2C[6a])(C[6]C[6]C)(H){1|H<1>,1|O<1>,3|C<4>,4|C<3>}	C[6](C[6]C[3x6]H)(C[6]C[5,6]O)(CCHH){1|C<3>,1|O<2>,3|C<4>}	H(C[6]C[3x6]C[6])	116.1900	0.000	1	116.1900	0.000	1	116.9108	0.118	8	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[3x6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[3x6]C[3x6]2H)(C[6]C[6]C)(H)	C[6](C[6]C[3,6]O)(C[6]C[3x6]H)(CCHH)	H(C[6]C[3x6]C[6])	C[6](C[3x6]C[3x6]2H)(C[6]C[6]C)(H){1|H<1>,1|O<1>,2|C<3>,3|C<4>}	C[6](C[6]C[3,6]O)(C[6]C[3x6]H)(CCHH){1|H<1>,1|O<2>,3|C<4>}	H(C[6]C[3x6]C[6])	117.1095	0.103	2	117.1095	0.011	2	116.9108	0.118	8	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[3x6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[3x6]C[6,6]2C[6])(C[6]C[6]C)(H)	C[6](C[6]C[3x6]H)(C[6]C[6]O)(CCCH)	H(C[6]C[3x6]C[6])	C[6](C[3x6]C[6,6]2C[6])(C[6]C[6]C)(H){1|O<1>,2|C<4>,3|C<3>,3|H<1>}	C[6](C[6]C[3x6]H)(C[6]C[6]O)(CCCH){1|C<3>,1|O<2>,2|C<4>}	H(C[6]C[3x6]C[6])	117.1043	0.148	3	117.1043	0.022	3	116.9108	0.118	8	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[4,5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[4,5,6]C[3,5,6]C[4,5,6]O[4])(C[6]C[6]C)(H)	C[6](C[6]C[4,5,6]H)(C[6]C[3,6]O)(CHHO)	H(C[6]C[4,5,6]C[6])	C[6](C[4,5,6]C[3,5,6]C[4,5,6]O[4])(C[6]C[6]C)(H){1|O<1>,1|O<2>,5|C<4>}	C[6](C[6]C[4,5,6]H)(C[6]C[3,6]O)(CHHO){1|H<1>,2|C<4>,2|O<2>}	H(C[6]C[4,5,6]C[6])	119.2293	0.113	3	119.2293	0.013	3	119.2293	0.013	3	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[4,6]-4:C[6]-3:H-1:	C[5,6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[4,6]C[4,6]2H)(C[6]C[5,6]C)(H)	C[6](C[5,6]C[5,6]N[5])(C[6]C[4,6]H)(CH3)	H(C[6]C[4,6]C[6])	C[6](C[4,6]C[4,6]2H)(C[6]C[5,6]C)(H){1|C<3>,1|N<2>,2|C<4>,2|H<1>}	C[6](C[5,6]C[5,6]N[5])(C[6]C[4,6]H)(CH3){1|H<1>,2|C<3>,3|C<4>}	H(C[6]C[4,6]C[6])	117.1865	0.162	4	117.1865	0.026	4	117.1865	0.026	4	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[4,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[4,6]C[4,6]C[4]C)(C[6]C[6]C)(H)	C[6](C[6]C[4,6]H)(C[6]C[6]H)(CH3)	H(C[6]C[4,6]C[6])	C[6](C[4,6]C[4,6]C[4]C)(C[6]C[6]C)(H){1|C<4>,2|C<3>,3|H<1>}	C[6](C[6]C[4,6]H)(C[6]C[6]H)(CH3){4|C<4>}	H(C[6]C[4,6]C[6])	118.1420	0.000	1	118.1420	0.000	1	117.6495	0.485	2	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[4,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[4,6]C[5x3,4,5x5,20x6]C[4,6]H)(C[6]C[6]C)(H)	C[6](C[6]C[4,6]H)(C[6]C[6]O)(CH3)	H(C[6]C[4,6]C[6])	C[6](C[4,6]C[5x3,4,5x5,20x6]C[4,6]H)(C[6]C[6]C)(H){1|C<4>,1|C<6>,1|H<1>,1|O<1>,4|B<6>}	C[6](C[6]C[4,6]H)(C[6]C[6]O)(CH3){1|C<4>,1|C<6>,3|H<1>}	H(C[6]C[4,6]C[6])	117.1570	0.000	1	117.1570	0.000	1	117.6495	0.485	2	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[5,5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[5,5,6]C[5,5,6,6]C[3x5,6]O)(C[6]C[6]C)(H)	C[6](C[6]C[5,5,6]H)(C[6]C[5,6,6]O)(CH3)	H(C[6]C[5,5,6]C[6])	C[6](C[5,5,6]C[5,5,6,6]C[3x5,6]O)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|O<1>,4|C<4>}	C[6](C[6]C[5,5,6]H)(C[6]C[5,6,6]O)(CH3){1|O<2>,4|C<4>}	H(C[6]C[5,5,6]C[6])	124.5260	0.000	1	124.5260	0.000	1	120.0107	16.048	3	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[5,5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[5,5,6]C[5,6]N[5,5]C[5])(C[6]C[6]C)(H)	C[6](C[6]C[5,5,6]H)(C[6]C[6]H)(CH3)	H(C[6]C[5,5,6]C[6])	C[6](C[5,5,6]C[5,6]N[5,5]C[5])(C[6]C[6]C)(H){1|O<2>,2|C<3>,3|C<4>,3|H<1>}	C[6](C[6]C[5,5,6]H)(C[6]C[6]H)(CH3){1|H<1>,1|N<3>,2|C<4>}	H(C[6]C[5,5,6]C[6])	118.6230	0.000	1	118.6230	0.000	1	120.0107	16.048	3	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[5,5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[5,5,6]C[5,6]N[5,5]C[5])(C[6]C[6]C)(H)	C[6](C[6]C[5,5,6]H)(C[6]C[6]O)(CH3)	H(C[6]C[5,5,6]C[6])	C[6](C[5,5,6]C[5,6]N[5,5]C[5])(C[6]C[6]C)(H){1|H<1>,1|O<1>,2|C<4>,4|C<3>}	C[6](C[6]C[5,5,6]H)(C[6]C[6]O)(CH3){1|C<3>,1|H<1>,1|N<3>,2|C<4>}	H(C[6]C[5,5,6]C[6])	116.8830	0.000	1	116.8830	0.000	1	120.0107	16.048	3	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[5,6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[5,6,6]C[5,5,6]O[5,6]C[6])(C[6]C[6]C)(H)	C[6](C[6]C[5,6,6]H)(C[6]C[5,6]O)(CH3)	H(C[6]C[5,6,6]C[6])	C[6](C[5,6,6]C[5,5,6]O[5,6]C[6])(C[6]C[6]C)(H){1|H<1>,1|O<1>,2|C<3>,3|C<4>}	C[6](C[6]C[5,6,6]H)(C[6]C[5,6]O)(CH3){1|C<3>,1|H<1>,1|O<2>,2|C<4>}	H(C[6]C[5,6,6]C[6])	118.6040	0.096	2	118.6040	0.009	2	118.5833	0.006	3	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[5,6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[5,6,6]C[5,6,6]C[6]O[5])(C[6]C[6]C)(H)	C[6](C[6]C[5,6,6]H)(C[6]C[6]O)(CCCH)	H(C[6]C[5,6,6]C[6])	C[6](C[5,6,6]C[5,6,6]C[6]O[5])(C[6]C[6]C)(H){1|C<3>,1|O<1>,2|H<1>,3|C<4>}	C[6](C[6]C[5,6,6]H)(C[6]C[6]O)(CCCH){1|C<3>,1|C<4>,2|O<2>}	H(C[6]C[5,6,6]C[6])	118.5420	0.000	1	118.5420	0.000	1	118.5833	0.006	3	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[5,6]C[5,5,6]C[5]C[6])(C[6]C[6]C)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(CC3)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,5,6]C[5]C[6])(C[6]C[6]C)(H){1|C<4>,1|O<1>,3|H<1>,4|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]O)(CC3){1|C<3>,3|C<4>}	H(C[6]C[5,6]C[6])	117.4880	0.089	2	117.4880	0.008	2	118.9174	1.494	82	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[5,6]C[5,5a]N[5,5a]C[6])(C[6]C[6]C)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(CC3)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,5a]N[5,5a]C[6])(C[6]C[6]C)(H){1|H<1>,1|O<1>,1|S<2>,4|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]O)(CC3){1|C<4>,1|N<3>,2|C<3>}	H(C[6]C[5,6]C[6])	118.1325	0.062	2	118.0383	0.013	4	118.9174	1.494	82	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[5,6]C[5,5a]N[5,5a]C[6])(C[6]C[6]C)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(CC3)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,5a]N[5,5a]C[6])(C[6]C[6]C)(H){1|H<1>,1|O<1>,5|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]O)(CC3){1|C<4>,1|N<3>,2|C<3>}	H(C[6]C[5,6]C[6])	117.9440	0.014	2	118.0383	0.013	4	118.9174	1.494	82	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[5,6]C[5,6,6]C[5]H)(C[6]C[6]C)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(CH3)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6,6]C[5]H)(C[6]C[6]C)(H){2|C<3>,2|N<3>,3|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(CH3){2|C<4>,2|H<1>}	H(C[6]C[5,6]C[6])	119.2120	0.000	1	119.2120	0.000	1	118.9174	1.494	82	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[5,6]C[5,6]2Hf)(C[6]C[6]C)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(CC3)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]2Hf)(C[6]C[6]C)(H){1|H<1>,2|C<3>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(CC3){1|Hf<13>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	119.8519	0.073	10	119.8519	0.005	10	118.9174	1.494	82	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[5,6]C[5,6]2Zr)(C[6]C[6]C)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(CC3)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]2Zr)(C[6]C[6]C)(H){1|H<1>,2|C<3>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(CC3){1|Zr<13>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	119.7803	0.246	13	119.7803	0.060	13	118.9174	1.494	82	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]C)(C[6]C[6]C)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(CH3)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]C)(C[6]C[6]C)(H){1|H<1>,2|C<3>,2|N<2>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(CH3){2|C<3>,2|C<4>}	H(C[6]C[5,6]C[6])	121.6260	0.000	1	121.6260	0.000	1	118.9174	1.494	82	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]C)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(CH3)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]C)(H){2|O<1>,4|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]O)(CH3){1|C<3>,1|C<4>,3|H<1>}	H(C[6]C[5,6]C[6])	117.5800	0.000	1	117.5800	0.000	1	118.9174	1.494	82	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]O)(C[6]C[6]C)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(CCHH)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]O)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|O<1>,1|O<2>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]O)(CCHH){1|C<3>,1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[5,6]C[6])	118.8460	0.000	1	118.8460	0.000	1	118.9174	1.494	82	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]C)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(CH3)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Ru)(C[6]C[6]C)(H){1|C<4>,1|C<5>,1|H<1>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(CH3){1|Ru<7>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	119.8690	0.000	1	119.8690	0.000	1	118.9174	1.494	82	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]C)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(CC3)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]C)(H){1|C<3>,1|C<5>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(CC3){1|Zr<13>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	119.7265	0.252	2	119.6998	0.043	12	118.9174	1.494	82	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]C)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(CC3)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Zr)(C[6]C[6]C)(H){1|Si<5>,1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(CC3){1|Zr<13>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	119.6945	0.212	10	119.6998	0.043	12	118.9174	1.494	82	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[5,6]C[5,6]N[5]H)(C[6]C[6]C)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(CH3)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]N[5]H)(C[6]C[6]C)(H){1|S<4>,2|H<1>,3|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(CH3){1|C<4>,1|N<3>,2|H<1>}	H(C[6]C[5,6]C[6])	118.6680	0.000	1	118.6680	0.000	1	118.9174	1.494	82	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[5,6]C[5,6]N[5]O)(C[6]C[6]C)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(CH3)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]N[5]O)(C[6]C[6]C)(H){1|C<4>,1|H<1>,1|O<2>,2|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(CH3){1|N<2>,1|O<2>,2|C<4>}	H(C[6]C[5,6]C[6])	118.6670	0.000	1	118.6670	0.000	1	118.9174	1.494	82	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[5,6]C[5,6]O[5]C)(C[6]C[6]C)(H)	C[6](C[6]C[5,3x6]O)(C[6]C[5,6]H)(CC3)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]O[5]C)(C[6]C[6]C)(H){1|H<1>,1|O<1>,3|C<4>}	C[6](C[6]C[5,3x6]O)(C[6]C[5,6]H)(CC3){2|O<2>,3|C<4>}	H(C[6]C[5,6]C[6])	118.5190	0.000	1	118.5190	0.000	1	118.9174	1.494	82	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[5,6]C[5,6]O[5]C)(C[6]C[6]C)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(CC3)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]O[5]C)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|N<2>,1|P<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(CC3){1|C<3>,1|O<2>,2|C<4>}	H(C[6]C[5,6]C[6])	119.9760	0.000	1	119.9760	0.000	1	118.9174	1.494	82	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[5,6]C[5,6]O[5]C)(C[6]C[6]C)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(CH3)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]O[5]C)(C[6]C[6]C)(H){1|C<3>,1|C<4>,1|H<1>,1|N<3>,1|O<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]O)(CH3){1|H<1>,1|O<2>,3|C<4>}	H(C[6]C[5,6]C[6])	117.0470	0.000	1	117.0470	0.000	1	118.9174	1.494	82	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[5,6]C[5,6]O[5]H)(C[6]C[6]C)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(CCCH)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]O[5]H)(C[6]C[6]C)(H){1|O<1>,4|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]O)(CCCH){1|C<3>,1|H<1>,1|O<2>,2|C<4>}	H(C[6]C[5,6]C[6])	120.1120	0.000	1	120.1120	0.000	1	118.9174	1.494	82	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[5,6]C[5,6a]N[5,5a]C[6])(C[6]C[6]C)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(CC3)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6a]N[5,5a]C[6])(C[6]C[6]C)(H){1|H<1>,1|O<1>,5|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]O)(CC3){1|C<4>,1|N<3>,2|C<3>}	H(C[6]C[5,6]C[6])	119.2041	1.972	7	119.2041	3.887	7	118.9174	1.494	82	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[5,6]C[5]2C[6])(C[6]C[6]C)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(CC3)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5]2C[6])(C[6]C[6]C)(H){1|C<4>,1|O<1>,1|O<2>,3|C<3>,3|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]O)(CC3){1|C<3>,3|C<4>}	H(C[6]C[5,6]C[6])	117.4435	0.117	2	117.3322	0.045	11	118.9174	1.494	82	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[5,6]C[5]2C[6])(C[6]C[6]C)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(CC3)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5]2C[6])(C[6]C[6]C)(H){1|O<1>,2|C<4>,2|H<1>,3|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]O)(CC3){2|C<3>,2|C<4>}	H(C[6]C[5,6]C[6])	117.2250	0.135	3	117.3322	0.045	11	118.9174	1.494	82	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[5,6]C[5]2C[6])(C[6]C[6]C)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(CC3)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5]2C[6])(C[6]C[6]C)(H){1|O<1>,2|C<4>,3|C<3>,3|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]O)(CC3){1|C<3>,3|C<4>}	H(C[6]C[5,6]C[6])	117.4600	0.249	4	117.3322	0.045	11	118.9174	1.494	82	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[5,6]C[5]2C[6])(C[6]C[6]C)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(CC3)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5]2C[6])(C[6]C[6]C)(H){1|O<1>,2|H<1>,6|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]O)(CC3){1|C<3>,3|C<4>}	H(C[6]C[5,6]C[6])	117.1260	0.071	2	117.3322	0.045	11	118.9174	1.494	82	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[5,6]C[5]C[6]N[5])(C[6]C[6]C)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(CC3)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5]C[6]N[5])(C[6]C[6]C)(H){1|N<2>,1|O<1>,2|H<1>,4|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]O)(CC3){1|C<3>,1|N<3>,2|C<4>}	H(C[6]C[5,6]C[6])	117.6365	0.094	2	117.6365	0.009	2	118.9174	1.494	82	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[5,6]C[5]C[6]N[5])(C[6]C[6]C)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(CH3)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5]C[6]N[5])(C[6]C[6]C)(H){1|C<3>,1|O<1>,2|C<4>,4|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]O)(CH3){1|C<3>,1|N<3>,2|C<4>}	H(C[6]C[5,6]C[6])	117.6930	0.014	2	117.6930	0.000	2	118.9174	1.494	82	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[5,6]C[5]C[6]O[5])(C[6]C[6]C)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(CC3)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5]C[6]O[5])(C[6]C[6]C)(H){1|O<1>,3|C<3>,3|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(CC3){1|C<3>,1|C<4>,1|O<2>,1|S<2>}	H(C[6]C[5,6]C[6])	119.2790	0.000	1	119.2790	0.000	1	118.9174	1.494	82	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[5,6]C[6,6]C[5]O[5])(C[6]C[6]C)(H)	C[6](C[6]C[5,6]H)(C[6]C[6,6]O)(CCHH)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[6,6]C[5]O[5])(C[6]C[6]C)(H){1|C<3>,1|O<1>,1|O<2>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6,6]O)(CCHH){1|C<3>,1|O<2>,2|C<4>}	H(C[6]C[5,6]C[6])	117.4700	0.000	1	117.4700	0.000	1	118.9174	1.494	82	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[5,6]C[6,6]O[5]2)(C[6]C[6]C)(H)	C[6](C[6]C[5,6]H)(C[6]C[6,6]O)(CH3)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[6,6]O[5]2)(C[6]C[6]C)(H){1|H<1>,1|O<1>,4|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6,6]O)(CH3){1|H<1>,2|C<4>,2|O<2>}	H(C[6]C[5,6]C[6])	117.4285	0.342	2	117.4285	0.117	2	118.9174	1.494	82	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[5,6]C[6]N[5]2)(C[6]C[6]C)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(CH3)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[6]N[5]2)(C[6]C[6]C)(H){1|C<4>,1|H<1>,1|O<1>,3|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]O)(CH3){1|C<3>,1|C<4>,1|N<2>,1|N<3>}	H(C[6]C[5,6]C[6])	118.0475	0.030	2	118.0475	0.001	2	118.9174	1.494	82	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[5,6]C[6]O[5]S[5])(C[6]C[6]C)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(CC3)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[6]O[5]S[5])(C[6]C[6]C)(H){1|H<1>,1|O<1>,3|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(CC3){1|C<3>,1|C<4>,1|O<2>,1|S<2>}	H(C[6]C[5,6]C[6])	119.2370	1.882	2	119.2370	3.543	2	118.9174	1.494	82	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:S-4:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]O)(C[6]C[6]S)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]O)(SC[6a]OO)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]O)(C[6]C[6]S)(H){1|C<3>,1|O<1>,2|H<1>,3|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]O)(SC[6a]OO){1|O<2>,2|C<4>,2|H<1>}	H(C[6]C[5,6]C[6])	117.7770	0.000	1	117.7770	0.000	1	117.7770	0.000	1	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6a]-3:C[6]-4:	C[6]-3:	C[6](C[5,6]C[5,6a]C[5,6]C[6a])(C[6]C[6a]C[6])(H)	C[6](C[6]C[5,6]H)(C[6a]C[6a]2)(C[6]N[6]HH)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6a]C[5,6]C[6a])(C[6]C[6a]C[6])(H){1|C<4>,1|N<3>,3|H<1>,6|C<3>}	C[6](C[6]C[5,6]H)(C[6a]C[6a]2)(C[6]N[6]HH){1|H<1>,2|C<4>,5|C<3>}	H(C[6]C[5,6]C[6])	118.5593	0.650	3	118.5593	0.422	3	118.5593	0.422	3	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6,6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6,6]C[6,6a]C[6]O[6])(C[6]C[6,6a]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(CH3)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]C[6]O[6])(C[6]C[6,6a]C)(H){1|C<4>,2|H<1>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(CH3){1|C<4>,1|H<1>,1|O<2>,3|C<3>}	H(C[6]C[6,6]C[6])	118.6780	0.000	1	118.6600	0.015	5	118.6600	0.015	5	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6,6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6,6]C[6,6a]C[6]O[6])(C[6]C[6,6a]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(CH3)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]C[6]O[6])(C[6]C[6,6a]C)(H){1|H<1>,5|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6,6]H)(CH3){1|H<1>,1|O<2>,4|C<3>}	H(C[6]C[6,6]C[6])	118.6555	0.142	4	118.6600	0.015	5	118.6600	0.015	5	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6,6]C[3,6,6]C[6]H)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(CH3)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[3,6,6]C[6]H)(C[6]C[6]C)(H){1|C<4>,1|N<3>,1|O<2>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(CH3){2|C<4>,2|H<1>}	H(C[6]C[6,6]C[6])	120.2190	0.000	1	120.2190	0.000	1	117.8133	1.113	28	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6,6]C[3,6,6]C[6]O)(C[6]C[6]C)(H)	C[6](C[6]C[3,6]O)(C[6]C[6,6]H)(CHHO)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[3,6,6]C[6]O)(C[6]C[6]C)(H){1|C<3>,1|O<1>,1|O<2>,2|C<4>,2|H<1>}	C[6](C[6]C[3,6]O)(C[6]C[6,6]H)(CHHO){1|H<1>,2|C<4>,2|O<2>}	H(C[6]C[6,6]C[6])	117.5390	0.000	1	117.5390	0.000	1	117.8133	1.113	28	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6,6]C[5,6]C[6,6]H)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(CH3)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6]C[6,6]H)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|O<1>,3|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]O)(CH3){1|C<3>,1|C<4>,3|H<1>}	H(C[6]C[6,6]C[6])	117.2000	0.044	2	117.2000	0.002	2	117.8133	1.113	28	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6,6]C[5,6]C[6]2)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(CC3)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6]C[6]2)(C[6]C[6]C)(H){1|C<4>,1|N<3>,1|O<1>,2|C<3>,4|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]O)(CC3){1|C<3>,3|C<4>}	H(C[6]C[6,6]C[6])	117.2160	0.304	2	117.2160	0.092	2	117.8133	1.113	28	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6,6]C[5a,6]C[6,6]C[6])(C[6]C[6]C)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(CC3)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5a,6]C[6,6]C[6])(C[6]C[6]C)(H){1|H<1>,1|O<1>,6|C<3>}	C[6](C[6]C[6,6]H)(C[6]C[6]O)(CC3){2|C<3>,2|C<4>}	H(C[6]C[6,6]C[6])	117.2595	0.261	4	117.2595	0.068	4	117.8133	1.113	28	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6,6]C[6,6]2C)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(CHHO)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2C)(C[6]C[6]C)(H){1|O<1>,2|H<1>,4|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]O)(CHHO){2|H<1>,3|C<4>}	H(C[6]C[6,6]C[6])	117.2410	0.342	2	117.2410	0.117	2	117.8133	1.113	28	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6,6]C[6,6]2H)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(CH3)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2H)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|O<1>,3|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]O)(CH3){1|C<3>,1|C<4>,3|H<1>}	H(C[6]C[6,6]C[6])	117.5470	0.000	1	117.5470	0.000	1	117.8133	1.113	28	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]C)(H)	C[6](C[6]C[5,6]O)(C[6]C[6,6]H)(CH3)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]C)(H){1|O<1>,2|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]O)(C[6]C[6,6]H)(CH3){1|C<3>,1|H<1>,3|C<4>}	H(C[6]C[6,6]C[6])	117.2930	0.000	1	117.2930	0.000	1	117.8133	1.113	28	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]H)(C[6]C[6,6]O)(CCHH)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]C)(H){1|O<1>,2|H<1>,4|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6,6]O)(CCHH){1|H<1>,2|C<3>,2|C<4>}	H(C[6]C[6,6]C[6])	120.7050	0.000	1	120.7050	0.000	1	117.8133	1.113	28	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(CH3)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]C)(H){1|C<3>,3|C<4>,3|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(CH3){2|C<4>,2|H<1>}	H(C[6]C[6,6]C[6])	119.5860	0.000	1	119.5860	0.000	1	117.8133	1.113	28	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]O)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(CH3)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]O)(C[6]C[6]C)(H){1|C<3>,1|O<1>,2|C<4>,2|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]O)(CH3){1|C<3>,1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[6,6]C[6])	116.9500	0.000	1	116.9500	0.000	1	117.8133	1.113	28	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]O[6])(C[6]C[6]C)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]O[6])(C[6]C[6]C)(H){1|N<2>,3|C<4>,4|H<1>}	C[6](C[6]C[6,6]H)(C[6]N[6]H)(CH3){1|O<2>,2|C<4>}	H(C[6]C[6,6]C[6])	120.0840	0.000	1	120.0840	0.000	1	117.8133	1.113	28	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6,6]C[6,6]O[6]H)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]N)(CH3)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]O[6]H)(C[6]C[6]C)(H){1|N<2>,4|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]N)(CH3){1|C<4>,1|O<2>,3|H<1>}	H(C[6]C[6,6]C[6])	117.6610	0.000	1	117.6610	0.000	1	117.8133	1.113	28	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6,6]C[6,6]O[6]H)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(CH3)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]O[6]H)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|O<1>,2|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]O)(CH3){1|C<4>,1|O<2>,3|H<1>}	H(C[6]C[6,6]C[6])	117.2150	0.000	1	117.2150	0.000	1	117.8133	1.113	28	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6,6]C[6,6a]C[6,6]C)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(CH3)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]C[6,6]C)(C[6]C[6]C)(H){1|B<3>,1|H<1>,3|C<3>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(CH3){2|C<3>,2|C<4>}	H(C[6]C[6,6]C[6])	118.8370	0.000	1	118.8370	0.000	1	117.8133	1.113	28	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6,6]C[6]2S[6])(C[6]C[6]C)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(CC3)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6]2S[6])(C[6]C[6]C)(H){1|H<1>,1|O<1>,1|O<2>,4|C<3>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(CC3){1|C<3>,1|C<4>,2|S<2>}	H(C[6]C[6,6]C[6])	117.9770	0.000	1	117.9770	0.000	1	117.8133	1.113	28	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6,6]C[6]3)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(CC3)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6]3)(C[6]C[6]C)(H){1|C<4>,1|O<1>,3|H<1>,4|C<3>}	C[6](C[6]C[6,6]H)(C[6]C[6]O)(CC3){1|C<3>,3|C<4>}	H(C[6]C[6,6]C[6])	117.2050	0.205	2	117.2050	0.042	2	117.8133	1.113	28	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6,6]C[6]3)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]O)(CH3)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6]3)(C[6]C[6]C)(H){1|O<1>,2|C<4>,3|C<3>,3|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]O)(CH3){1|C<3>,3|C<4>}	H(C[6]C[6,6]C[6])	117.5995	0.287	4	117.5995	0.082	4	117.8133	1.113	28	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6,6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6a]2N[6])(C[6]C[6,6]C)(H)	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(CC[6a]2O)	H(C[6]C[6]2)	C[6](C[6]C[6a]2N[6])(C[6]C[6,6]C)(H){1|O<1>,6|C<3>}	C[6](C[6,6]C[6,6]C[6])(C[6]C[6]H)(CC[6a]2O){1|H<1>,1|N<3>,4|C<3>}	H(C[6]C[6]2)	116.5760	0.219	2	116.5760	0.048	2	116.5760	0.048	2	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[6]H)(C[6]C[6,6a]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6]H)(C[6]C[6,6a]C)(H){1|H<1>,1|O<2>,2|C<3>,2|C<4>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CH3){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.0290	0.000	1	119.0290	0.000	1	118.5516	1.124	10	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6a]2O[6])(C[6]C[6,6a]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6a]2O[6])(C[6]C[6,6a]C)(H){6|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CH3){1|H<1>,1|O<2>,4|C<3>}	H(C[6]C[6]2)	118.2083	0.615	3	118.2083	0.379	3	118.5516	1.124	10	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6a]C[6]H)(C[6]C[6,6a]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]H)(C[6]C[6,6a]C)(H){6|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CCHH){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	118.3120	0.311	2	118.3120	0.097	2	118.5516	1.124	10	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6a]C[6]H)(C[6]C[6,6a]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]H)(C[6]C[6,6a]C)(H){1|H<1>,1|O<2>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CH3){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	117.9930	0.180	2	117.9930	0.032	2	118.5516	1.124	10	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6a]N[6]H)(C[6]C[6,6a]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6]H)(C[6]C[6,6a]C)(H){5|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CH3){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	117.9530	0.000	1	117.9530	0.000	1	118.5516	1.124	10	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6a]O[6]H)(C[6]C[6,6a]C)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6a]O[6]H)(C[6]C[6,6a]C)(H){4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(CCHH){1|O<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	121.2990	0.000	1	121.2990	0.000	1	118.5516	1.124	10	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:S-4:	C[6]-3:	C[6](C[6]C[6a]2O[6])(C[6]C[6,6a]S)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(SC[6a]OO)	H(C[6]C[6]2)	C[6](C[6]C[6a]2O[6])(C[6]C[6,6a]S)(H){6|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(SC[6a]OO){1|H<1>,1|O<2>,4|C<3>}	H(C[6]C[6]2)	119.3940	0.000	1	119.3940	0.000	1	119.3940	0.000	1	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6,6a]-3:C[6]-3:Si-4:	C[6]-3:	C[6](C[6]C[6a]C[6]C)(C[6]C[6,6a]Si)(H)	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(SiC3)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]C)(C[6]C[6,6a]Si)(H){2|C<4>,4|C<3>}	C[6](C[6,6a]C[6,6a]C[6a])(C[6]C[6]H)(SiC3){1|H<1>,2|C<4>,3|C<3>}	H(C[6]C[6]2)	117.9805	0.347	2	117.9805	0.121	2	117.9805	0.121	2	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:B-4:	C[6]-3:	C[6](C[6]C[6,6]C[6a]H)(C[6]C[6]B)(H)	C[6](C[6]C[6,6]P)(C[6]C[6]H)(BC[6a]2C)	H(C[6]C[6]2)	C[6](C[6]C[6,6]C[6a]H)(C[6]C[6]B)(H){1|C<4>,1|H<1>,1|P<4>,3|C<3>}	C[6](C[6]C[6,6]P)(C[6]C[6]H)(BC[6a]2C){1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	118.4080	0.000	1	118.4080	0.000	1	118.5060	3.120	6	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:B-4:	C[6]-3:	C[6](C[6]C[6,6]C[6a]H)(C[6]C[6]B)(H)	C[6](C[6]C[6,6]P[5])(C[6]C[6]H)(BC[6a]2O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]C[6a]H)(C[6]C[6]B)(H){1|C<4>,1|H<1>,1|P<4>,3|C<3>}	C[6](C[6]C[6,6]P[5])(C[6]C[6]H)(BC[6a]2O){1|H<1>,2|C<4>,4|C<3>}	H(C[6]C[6]2)	115.6620	0.000	1	115.6620	0.000	1	118.5060	3.120	6	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:B-4:	C[6]-3:	C[6](C[6]C[6]FeB)(C[6]C[6]B)(H)	C[6](C[6]C[6]H)2(BN[5]CO)	H(C[6]C[6]2)	C[6](C[6]C[6]FeB)(C[6]C[6]B)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(BN[5]CO){1|Fe<5>,1|B<4>,1|C<3>,1|H<1>}	H(C[6]C[6]2)	117.6080	0.000	1	117.6080	0.000	1	118.5060	3.120	6	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:B-4:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]B)(H)	C[6](C[6]C[6]H)2(BC[6a]3)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]B)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(BC[6a]3){1|C<3>,3|H<1>}	H(C[6]C[6]2)	118.7690	0.000	1	118.7690	0.000	1	118.5060	3.120	6	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:B-4:	C[6]-3:	C[6](C[6]C[6]ScH)(C[6]C[6]B)(H)	C[6](C[6]C[6]H)2(BC[6a]3)	H(C[6]C[6]2)	C[6](C[6]C[6]ScH)(C[6]C[6]B)(H){1|C<3>,1|H<1>,1|H<2>}	C[6](C[6]C[6]H)2(BC[6a]3){1|Sc<13>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.9570	0.000	1	119.9570	0.000	1	118.5060	3.120	6	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:B-4:	C[6]-3:	C[6](C[6]C[6]TiH)(C[6]C[6]B)(H)	C[6](C[6]C[6]H)2(BC[6a]3)	H(C[6]C[6]2)	C[6](C[6]C[6]TiH)(C[6]C[6]B)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(BC[6a]3){1|Ti<12>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	120.6320	0.000	1	120.6320	0.000	1	118.5060	3.120	6	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[3,6]CC)(C[6]C[6]C)(H)	C[6](C[6]C[3,6]O)(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[3,6]CC)(C[6]C[6]C)(H){1|H<1>,1|O<1>,2|C<4>}	C[6](C[6]C[3,6]O)(C[6]C[6]H)(CC3){5|C<4>}	H(C[6]C[6]2)	117.5840	0.000	1	117.5840	0.000	1	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[3,6]CH)(C[6]C[6]C)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[3,6]CH)(C[6]C[6]C)(H){1|C<3>,3|C<4>}	C[6](C[6]C[6]C)(C[6]C[6]H)(CH3){2|C<4>,3|H<1>}	H(C[6]C[6]2)	117.0480	0.000	1	117.0480	0.000	1	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[3,6]CH)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[3,6]CH)(C[6]C[6]C)(H){1|N<2>,3|C<4>}	C[6](C[6]C[6]H)(C[6]C[6]N)(CH3){2|C<4>,3|H<1>}	H(C[6]C[6]2)	117.2680	0.126	3	117.2680	0.016	3	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[3,6]CH)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[3,6]CH)(C[6]C[6]C)(H){1|O<1>,3|C<4>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CH3){2|C<4>,3|H<1>}	H(C[6]C[6]2)	116.9040	0.277	2	116.9040	0.077	2	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[3,6]CO)(C[6]C[6]C)(H)	C[6](C[6]C[3,6]O)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[3,6]CO)(C[6]C[6]C)(H){1|H<1>,1|O<1>,2|C<4>}	C[6](C[6]C[3,6]O)(C[6]C[6]H)(CH3){1|C<3>,1|O<2>,3|C<4>}	H(C[6]C[6]2)	116.9780	0.000	1	116.9780	0.000	1	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[3,6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[3,6]HH)(C[6]C[6]C)(H){1|O<1>,3|C<4>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CH3){2|C<4>,3|H<1>}	H(C[6]C[6]2)	117.5705	0.162	2	117.5705	0.026	2	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]C[6a]H)(C[6]C[6]C)(H)	C[6](C[6]C[5,6]C)(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C[6a]H)(C[6]C[6]C)(H){1|C<4>,1|H<1>,4|C<3>}	C[6](C[6]C[5,6]C)(C[6]C[6]H)(CCHH){1|C<4>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	118.7180	0.000	1	118.7180	0.000	1	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[5,6]O)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5,6]HH)(C[6]C[6]C)(H){1|H<1>,1|O<1>,2|C<4>}	C[6](C[6]C[5,6]O)(C[6]C[6]H)(CH3){2|C<4>,3|H<1>}	H(C[6]C[6]2)	119.0760	0.000	1	119.0760	0.000	1	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]HO)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5,6]HO)(C[6]C[6]C)(H){1|C<3>,1|C<4>,1|O<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CH3){1|O<2>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	117.5870	0.000	1	117.5870	0.000	1	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]ZrC)(C[6]C[6]C)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[5,6]ZrC)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(CC3){1|Zr<12>,1|C<3>,2|C<4>}	H(C[6]C[6]2)	118.5980	0.000	1	118.6090	0.065	3	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]ZrC)(C[6]C[6]C)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[5,6]ZrC)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]H)(CC3){1|Zr<9>,1|C<3>,2|C<4>}	H(C[6]C[6]2)	118.6145	0.361	2	118.6090	0.065	3	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6]HH)(C[6]C[6]C)(H){1|H<1>,1|O<1>,2|C<4>}	C[6](C[6]C[6,6]O)(C[6]C[6]H)(CH3){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	117.5340	0.000	1	117.7660	0.108	2	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6]HH)(C[6]C[6]C)(H){1|O<1>,1|O<2>,2|C<4>}	C[6](C[6]C[6,6]O)(C[6]C[6]H)(CH3){2|C<4>,3|H<1>}	H(C[6]C[6]2)	117.9980	0.000	1	117.7660	0.108	2	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6]HO)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]O)(C[6]C[6]H)(CCCH)	H(C[6]C[6]2)	C[6](C[6]C[6,6]HO)(C[6]C[6]C)(H){1|O<1>,3|C<4>}	C[6](C[6]C[6,6]O)(C[6]C[6]H)(CCCH){1|O<2>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	116.9770	0.185	3	116.9770	0.034	3	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6]HO)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6]HO)(C[6]C[6]C)(H){1|O<1>,1|O<2>,2|C<4>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CH3){1|C<4>,1|O<2>,3|H<1>}	H(C[6]C[6]2)	116.8635	0.074	2	116.8635	0.006	2	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6]ThN)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6,6]ThN)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|O<3>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(CC3){1|Th<17>,1|N<3>,2|C<4>}	H(C[6]C[6]2)	119.2785	0.528	2	119.2785	0.279	2	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]2O)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]2O)(C[6]C[6]C)(H){1|H<1>,1|O<1>,1|O<2>,3|C<3>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CC3){1|C<3>,1|O<2>,2|C<4>}	H(C[6]C[6]2)	117.8900	0.024	2	117.8900	0.001	2	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]CC)(C[6]C[6]C)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(CC[6a]CH)	H(C[6]C[6]2)	C[6](C[6]C[6]CC)(C[6]C[6]C)(H){1|C<3>,1|C<4>,2|H<1>}	C[6](C[6]C[6]C)(C[6]C[6]H)(CC[6a]CH){1|C<4>,1|H<1>,1|S<4>,2|C<3>}	H(C[6]C[6]2)	117.7100	0.000	1	117.7100	0.000	1	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]CC)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]CC)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]C[6]N)(CC3){1|C<3>,3|C<4>}	H(C[6]C[6]2)	117.3060	0.123	2	117.3060	0.015	2	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]CC)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]CC)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CC3){1|C<3>,3|C<4>}	H(C[6]C[6]2)	116.9470	0.122	2	116.9470	0.015	2	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]CC)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CC[6]HO)	H(C[6]C[6]2)	C[6](C[6]C[6]CC)(C[6]C[6]C)(H){1|H<1>,1|O<1>,2|C<4>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CC[6]HO){1|H<1>,4|C<4>}	H(C[6]C[6]2)	117.0795	0.168	2	117.0795	0.028	2	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]CC)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(CCCH)	H(C[6]C[6]2)	C[6](C[6]C[6]CC)(C[6]C[6]C)(H){1|N<2>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(CCCH){1|Ni<4>,1|C<3>,2|C<4>}	H(C[6]C[6]2)	116.6660	0.000	1	116.6660	0.000	1	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]CC)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]CC)(C[6]C[6]C)(H){1|N<2>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(CCHH){1|Ni<4>,1|C<3>,2|C<4>}	H(C[6]C[6]2)	117.3870	0.003	2	117.6897	0.262	11	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]CC)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]CC)(C[6]C[6]C)(H){1|N<3>,2|N<2>}	C[6](C[6]C[6]H)(C[6]N[6]N)(CCHH){1|Ni<4>,1|C<3>,2|C<4>}	H(C[6]C[6]2)	117.7570	0.547	9	117.6897	0.262	11	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]CC)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]N)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]CC)(C[6]C[6]C)(H){1|N<2>,2|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]N)(CH3){1|Ni<4>,1|C<3>,2|C<4>}	H(C[6]C[6]2)	117.4800	0.000	1	117.4800	0.000	1	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]CC)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]CC)(C[6]C[6]C)(H){2|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,3|C<4>}	H(C[6]C[6]2)	119.7970	0.000	1	119.7970	0.000	1	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]CH)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]CH)(C[6]C[6]C)(H){1|C<3>,1|C<4>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CH3){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	117.2080	0.113	2	117.2080	0.013	2	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]CH)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]C)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]CH)(C[6]C[6]C)(H){1|C<3>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]N[6]C)(CH3){1|Rh<8>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	117.8350	0.000	1	117.8350	0.000	1	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]CO)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CC[6a]HO)	H(C[6]C[6]2)	C[6](C[6]C[6]CO)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CC[6a]HO){1|C<3>,1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.9940	0.000	1	120.9130	1.106	5	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]CO)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CC[6a]HO)	H(C[6]C[6]2)	C[6](C[6]C[6]CO)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CC[6a]HO){1|C<3>,1|O<2>,2|C<4>}	H(C[6]C[6]2)	121.1428	1.060	4	120.9130	1.106	5	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]CS)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]CS)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CC3){1|C<3>,1|S<4>,2|C<4>}	H(C[6]C[6]2)	117.8355	0.097	2	117.8355	0.009	2	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]CY)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]CY)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(CC3){1|Y<14>,1|C<5>,2|C<4>}	H(C[6]C[6]2)	118.6890	0.000	1	118.6890	0.000	1	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]CuC)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CCCH)	H(C[6]C[6]2)	C[6](C[6]C[6]CuC)(C[6]C[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(CCCH){1|Cu<5>,3|C<4>}	H(C[6]C[6]2)	118.7315	0.083	2	118.7315	0.007	2	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]CuC)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]CuC)(C[6]C[6]C)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|Cu<6>,3|C<4>}	H(C[6]C[6]2)	118.7480	0.000	1	118.7480	0.000	1	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]DyO)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]DyO)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(CH3){1|Dy<15>,1|O<3>,2|C<4>}	H(C[6]C[6]2)	120.1420	0.000	1	120.1420	0.000	1	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]FeC)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]FeC)(C[6]C[6]C)(H){1|Si<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|Fe<10>,3|C<4>}	H(C[6]C[6]2)	119.0680	0.000	1	119.0680	0.000	1	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]GdO)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]GdO)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|O<3>}	C[6](C[6]C[6]H)2(CH3){1|Gd<17>,1|O<3>,2|C<4>}	H(C[6]C[6]2)	120.0095	0.084	2	120.0095	0.007	2	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6]2)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){1|H<1>,3|C<3>}	C[6](C[6]C[6]2)(C[6]C[6]H)(CH3){2|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.4635	0.450	2	119.4635	0.203	2	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(CCCH)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){1|H<1>,1|N<2>,2|C<4>}	C[6](C[6]C[6]H)(C[6]C[6]N)(CCCH){1|C<4>,4|H<1>}	H(C[6]C[6]2)	111.0210	0.000	1	111.0210	0.000	1	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){1|C<3>,1|C<4>,1|H<1>,1|N<2>}	C[6](C[6]C[6]H)(C[6]C[6]N)(CH3){1|C<4>,4|H<1>}	H(C[6]C[6]2)	117.1055	0.185	2	117.0833	0.019	3	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){1|C<4>,1|N<2>,2|H<1>}	C[6](C[6]C[6]H)(C[6]C[6]N)(CH3){2|C<4>,3|H<1>}	H(C[6]C[6]2)	117.0390	0.000	1	117.0833	0.019	3	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){1|C<4>,1|O<1>,2|H<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CCHH){1|C<4>,4|H<1>}	H(C[6]C[6]2)	117.5370	0.000	1	117.5370	0.000	1	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CC[5a]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){1|C<4>,1|O<1>,2|H<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CC[5a]HH){1|C<3>,1|C<4>,3|H<1>}	H(C[6]C[6]2)	123.4960	0.000	1	123.4960	0.000	1	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CC[6a]2H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){1|C<4>,1|O<1>,2|H<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CC[6a]2H){1|C<4>,4|H<1>}	H(C[6]C[6]2)	117.1670	0.000	1	117.1670	0.000	1	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CC[6a]HO)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){1|C<4>,1|O<1>,2|H<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CC[6a]HO){1|C<4>,4|H<1>}	H(C[6]C[6]2)	117.4380	0.000	1	117.4380	0.000	1	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){1|C<3>,1|C<4>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CH3){1|C<3>,1|C<4>,3|H<1>}	H(C[6]C[6]2)	117.2040	0.000	2	117.4528	0.189	12	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){1|C<3>,1|C<4>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CH3){1|C<4>,4|H<1>}	H(C[6]C[6]2)	117.2390	0.949	2	117.4528	0.189	12	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){1|C<3>,1|C<4>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CH3){2|C<4>,3|H<1>}	H(C[6]C[6]2)	117.7362	0.316	4	117.4528	0.189	12	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){1|H<1>,1|O<1>,2|C<4>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CH3){1|C<4>,4|H<1>}	H(C[6]C[6]2)	117.4008	0.332	4	117.4528	0.189	12	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]O[6]O)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|O<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]O[6]O)(CCHH){1|C<4>,2|H<1>}	H(C[6]C[6]2)	118.6880	0.175	2	118.6880	0.031	2	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]O[6]O)(CC[6a]HN)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|O<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]O[6]O)(CC[6a]HN){1|C<4>,2|H<1>}	H(C[6]C[6]2)	116.5690	0.000	1	116.5690	0.000	1	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]O[6]O)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){1|C<4>,1|H<1>,1|O<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]O[6]O)(CH3){1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.9660	0.000	1	119.9660	0.000	1	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CCHN)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(CCHN){1|C<3>,3|H<1>}	H(C[6]C[6]2)	119.8020	0.000	1	119.8020	0.000	1	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,3|H<1>}	H(C[6]C[6]2)	118.4150	0.000	1	118.4150	0.000	1	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]HW)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]HW)(C[6]C[6]C)(H){1|Si<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|W<10>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.1280	0.000	1	119.1280	0.000	1	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]HoC)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]HoC)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(CC3){1|Ho<14>,1|C<5>,2|C<4>}	H(C[6]C[6]2)	118.6780	0.000	1	118.6735	0.000	2	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]HoC)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]HoC)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(CC3){1|Ho<15>,1|C<5>,2|C<4>}	H(C[6]C[6]2)	118.6690	0.000	1	118.6735	0.000	2	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]IrC)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]IrC)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(CH3){1|Ir<7>,1|C<3>,2|C<4>}	H(C[6]C[6]2)	119.0280	0.000	1	119.0280	0.000	1	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]IrH)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]IrH)(C[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(CH3){1|Ir<7>,1|C<3>,1|H<1>,1|H<2>}	H(C[6]C[6]2)	120.0110	0.000	1	120.0110	0.000	1	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]LaC)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]LaC)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(CH3){1|La<22>,1|C<5>,2|C<4>}	H(C[6]C[6]2)	119.4120	0.000	1	119.4120	0.000	1	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]LuC)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]LuC)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(CC3){1|Lu<14>,1|C<5>,2|C<4>}	H(C[6]C[6]2)	118.6630	0.000	1	118.6630	0.000	1	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]MoC)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]MoC)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(CH3){1|Mo<9>,1|C<3>,2|C<4>}	H(C[6]C[6]2)	119.1435	0.214	2	119.1435	0.046	2	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]MoH)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]MoH)(C[6]C[6]C)(H){1|Si<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|Mo<10>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.3710	0.000	1	119.3710	0.000	1	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]NU)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]NU)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(CC3){1|N<3>,1|U<9>,2|C<4>}	H(C[6]C[6]2)	119.6960	0.000	1	119.9120	0.095	4	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]NU)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]NU)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(CC3){1|U<16>,1|N<3>,2|C<4>}	H(C[6]C[6]2)	120.0810	0.000	1	119.9120	0.095	4	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]NU)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]NU)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(CC3){1|U<12>,1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	119.9355	0.457	2	119.9120	0.095	4	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]NU)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]NU)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|H<2>}	C[6](C[6]C[6]H)2(CH3){1|U<17>,1|N<3>,2|C<4>}	H(C[6]C[6]2)	119.5390	0.000	1	119.2857	0.073	10	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]NU)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]NU)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(CH3){1|U<17>,1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	119.3017	0.251	8	119.2857	0.073	10	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]NU)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]NU)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(CH3){1|U<17>,1|N<3>,2|C<4>}	H(C[6]C[6]2)	118.9040	0.000	1	119.2857	0.073	10	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]NV)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]NV)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|N<4>}	C[6](C[6]C[6]H)2(CH3){1|C<4>,1|H<1>,1|N<3>,1|V<9>}	H(C[6]C[6]2)	118.9718	0.054	4	119.2771	0.097	12	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]NV)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]NV)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|C<4>,1|N<3>,1|V<7>}	H(C[6]C[6]2)	119.4297	0.267	8	119.2771	0.097	12	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]NW)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]NW)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(CC3){1|W<14>,1|N<3>,2|C<4>}	H(C[6]C[6]2)	119.8735	0.135	4	119.8735	0.018	4	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]NW)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]NW)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(CH3){1|C<3>,1|C<4>,1|N<3>,1|W<7>}	H(C[6]C[6]2)	119.4010	0.000	1	119.4010	0.000	1	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[6]Ru)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6]Ru)(C[6]C[6]C)(H){1|Ru<7>,1|H<1>,1|N<4>,2|C<3>}	C[6](C[6]C[6]H)2(CH3){1|Ru<9>,1|C<4>,1|H<1>,1|N<4>}	H(C[6]C[6]2)	119.7850	0.393	2	119.7850	0.155	2	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]NiC)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]NiC)(C[6]C[6]C)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|Ni<5>,3|C<4>}	H(C[6]C[6]2)	118.4170	0.000	1	118.4625	0.004	2	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]NiC)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]NiC)(C[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(CH3){1|Ni<4>,3|C<4>}	H(C[6]C[6]2)	118.5080	0.000	1	118.4625	0.004	2	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]NiH)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]C[6]N)(CCCH)	H(C[6]C[6]2)	C[6](C[6]C[6]NiH)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(C[6]C[6]N)(CCCH){1|Ni<4>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	118.8510	0.000	1	118.8510	0.000	1	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]NiH)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]NiH)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(CH3){1|Ni<4>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.5550	0.000	1	119.3055	0.125	2	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]NiH)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]NiH)(C[6]C[6]C)(H){1|Ni<3>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|Ni<4>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.0560	0.000	1	119.3055	0.125	2	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]OO)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]OO)(C[6]C[6]C)(H){1|C<3>,1|C<4>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CCHH){1|Br<1>,1|C<3>,2|O<2>}	H(C[6]C[6]2)	120.7480	0.000	1	120.7480	0.000	1	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]OY)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]OY)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|O<3>}	C[6](C[6]C[6]H)2(CH3){1|Y<15>,1|O<3>,2|C<4>}	H(C[6]C[6]2)	119.6730	0.000	1	119.6730	0.000	1	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]PY)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]PY)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(CH3){1|Y<11>,1|C<4>,1|H<1>,1|P<4>}	H(C[6]C[6]2)	119.3310	0.000	1	119.3310	0.000	1	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]PdC)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]PdC)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CC3){1|Pd<4>,1|C<3>,2|C<4>}	H(C[6]C[6]2)	118.2875	0.221	2	118.6647	0.312	4	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]PdC)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]PdC)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)(C[6]C[6]O)(CC3){1|Pd<4>,1|C<3>,2|C<4>}	H(C[6]C[6]2)	119.0420	0.564	2	118.6647	0.312	4	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]PdC)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CCCH)	H(C[6]C[6]2)	C[6](C[6]C[6]PdC)(C[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)2(CCCH){1|Pd<5>,3|C<4>}	H(C[6]C[6]2)	118.9550	0.000	1	118.9550	0.000	1	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]PdC)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]PdC)(C[6]C[6]C)(H){1|B<3>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|Pd<5>,3|C<4>}	H(C[6]C[6]2)	118.9660	0.000	1	119.4224	0.103	5	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]PdC)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]PdC)(C[6]C[6]C)(H){1|B<4>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|Pd<6>,3|C<4>}	H(C[6]C[6]2)	119.7185	0.011	2	119.4224	0.103	5	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]PdC)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]PdC)(C[6]C[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|Pd<5>,3|C<4>}	H(C[6]C[6]2)	119.2540	0.000	1	119.4224	0.103	5	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]PdC)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]PdC)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(CH3){1|Pd<6>,3|C<4>}	H(C[6]C[6]2)	119.4550	0.000	1	119.4224	0.103	5	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]PdH)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]PdH)(C[6]C[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|Pd<6>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.3420	0.000	1	119.3420	0.000	1	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]RuC)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]RuC)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(CH3){1|Ru<6>,1|C<3>,2|C<4>}	H(C[6]C[6]2)	118.9655	0.095	2	118.9947	0.007	3	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]RuC)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]RuC)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(CH3){1|Ru<6>,3|C<4>}	H(C[6]C[6]2)	119.0530	0.000	1	118.9947	0.007	3	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]RuO)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]RuO)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(CC3){1|Ru<10>,1|O<2>,2|C<4>}	H(C[6]C[6]2)	119.9540	0.098	2	119.9540	0.010	2	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]TaN)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]TaN)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(CC3){1|Ta<13>,1|N<3>,2|C<4>}	H(C[6]C[6]2)	120.1750	0.000	1	120.1750	0.000	1	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]TaN)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]TaN)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(CH3){1|Ta<11>,1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	119.9117	0.181	4	119.8241	0.030	7	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]TaN)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]TaN)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(CH3){1|Ta<12>,1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	119.7073	0.074	3	119.8241	0.030	7	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]ThH)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]ThH)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(CH3){1|Th<14>,1|C<4>,1|H<1>,1|H<2>}	H(C[6]C[6]2)	119.2450	0.000	1	119.2450	0.000	1	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]TiH)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]TiH)(C[6]C[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|Ti<11>,1|C<4>,1|H<1>,1|H<2>}	H(C[6]C[6]2)	118.8380	0.000	1	118.8380	0.000	1	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]TiN)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]TiN)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(CC3){1|Ti<10>,1|N<3>,2|C<4>}	H(C[6]C[6]2)	119.1195	0.117	2	119.1195	0.014	2	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]TiO)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]TiO)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(CC3){1|Ti<13>,1|O<3>,2|C<4>}	H(C[6]C[6]2)	120.3060	0.114	4	120.2998	0.010	5	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]TiO)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]TiO)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]H)2(CC3){1|Ti<9>,1|O<3>,2|C<4>}	H(C[6]C[6]2)	120.2750	0.000	1	120.2998	0.010	5	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]YbN)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]YbN)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|O<3>}	C[6](C[6]C[6]H)2(CC3){1|Yb<14>,1|N<3>,2|C<4>}	H(C[6]C[6]2)	119.3700	0.127	2	119.3700	0.016	2	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]ZrC)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]ZrC)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)2(CH3){1|Zr<10>,1|C<5>,2|C<4>}	H(C[6]C[6]2)	119.9500	0.000	1	119.9500	0.000	1	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]ZrH)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]ZrH)(C[6]C[6]C)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|Zr<14>,1|C<3>,2|H<1>}	H(C[6]C[6]2)	119.6600	0.000	2	119.6600	0.000	2	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]ZrN)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]ZrN)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|H<2>}	C[6](C[6]C[6]H)2(CH3){1|Zr<14>,1|N<3>,2|C<4>}	H(C[6]C[6]2)	120.0760	0.000	1	119.5017	0.258	3	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]ZrN)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]ZrN)(C[6]C[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)2(CH3){1|Zr<13>,1|C<3>,1|C<4>,1|N<3>}	H(C[6]C[6]2)	119.2145	0.146	2	119.5017	0.258	3	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6a]C[6]C)(C[6]C[6]C)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]C)(C[6]C[6]C)(H){1|C<4>,1|O<1>,3|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(CH3){1|Br<1>,1|C<4>,2|C<3>}	H(C[6]C[6]2)	117.8430	0.000	1	117.8430	0.000	1	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6a]C[6]Co)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]Co)(C[6]C[6]C)(H){1|H<1>,1|O<2>,3|C<3>}	C[6](C[6]C[6]H)2(CC3){1|Co<5>,1|C<4>,2|C<3>}	H(C[6]C[6]2)	118.5920	0.000	1	118.5920	0.000	1	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]CY)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]CY)(C[6]C[6]C)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|Y<16>,1|C<4>,1|C<5>,1|N<3>}	H(C[6]C[6]2)	119.5035	0.296	2	119.5035	0.088	2	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]HH)(C[6]C[6]C)(H){1|S<4>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(CH3){1|C<3>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	118.0715	0.025	2	118.0715	0.001	2	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]IrN)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]IrN)(C[6]C[6]C)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|Ir<7>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	121.0410	0.045	2	121.0410	0.002	2	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]NY)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]NY)(C[6]C[6]C)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|Y<15>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	119.6570	0.000	1	119.6570	0.000	1	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]RhRu)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]RhRu)(C[6]C[6]C)(H){1|Ru<8>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|Rh<8>,1|Ru<9>,1|H<1>,1|N<4>}	H(C[6]C[6]2)	118.5910	0.000	1	118.5910	0.000	1	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]RuN)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]RuN)(C[6]C[6]C)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|Ru<10>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	120.1020	0.016	2	120.1020	0.000	2	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]ZrN)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)2(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]ZrN)(C[6]C[6]C)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(CH3){1|Zr<12>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	119.8142	0.119	6	119.8142	0.014	6	118.7791	1.698	204	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:N-4:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]N)(H)	C[6](C[6]C[6]H)2(NH3)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]N)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(NH3){1|C<3>,3|H<1>}	H(C[6]C[6]2)	120.5100	0.000	1	120.5100	0.000	1	120.5100	0.000	1	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:P-4:	C[6]-3:	C[6](C[6]C[6]BH)(C[6]C[6]P)(H)	C[6](C[6]C[6]C)(C[6]C[6]H)(PPdCC)	H(C[6]C[6]2)	C[6](C[6]C[6]BH)(C[6]C[6]P)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]C)(C[6]C[6]H)(PPdCC){1|B<4>,1|C<3>,2|H<1>}	H(C[6]C[6]2)	117.7580	0.000	1	117.7580	0.000	1	117.7580	0.000	1	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:Si-4:	C[6]-3:	C[6](C[6]C[6]CH)(C[6]C[6]Si)(H)	C[6](C[6]C[6]H)(C[6]C[6]O)(SiC3)	H(C[6]C[6]2)	C[6](C[6]C[6]CH)(C[6]C[6]Si)(H){1|C<3>,1|C<4>,1|H<1>,1|O<1>}	C[6](C[6]C[6]H)(C[6]C[6]O)(SiC3){2|H<1>,3|C<4>}	H(C[6]C[6]2)	118.4330	0.000	1	118.4330	0.000	1	118.4330	0.000	1	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]CC)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]CC)(C[6]N[6]C)(H){1|C<2>,1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3){1|O<1>,3|C<4>}	H(C[6]C[6]2)	118.9320	0.000	1	118.9320	0.000	1	118.9794	1.000	15	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]N[6]C)(H){1|C<3>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]H)(N[6]C[6]C)(CH3){1|C<3>,1|C<4>,3|H<1>}	H(C[6]C[6]2)	117.1370	0.928	2	117.1370	0.861	2	118.9794	1.000	15	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]N[6]C)(H){1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[6]H)(N[6]C[6]H)(CH3){1|C<4>,1|O<1>,2|H<1>}	H(C[6]C[6]2)	120.0090	0.000	1	120.0090	0.000	1	118.9794	1.000	15	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]S)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]N[6]C)(H){1|C<3>,1|S<4>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]S)(CH3){1|C<4>,1|O<1>,2|H<1>}	H(C[6]C[6]2)	119.6510	0.000	1	119.6510	0.000	1	118.9794	1.000	15	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]MoH)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(CF3)	H(C[6]C[6]2)	C[6](C[6]C[6]MoH)(C[6]N[6]C)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]C)(CF3){1|Mo<7>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	118.7960	0.000	1	119.3610	0.073	8	118.9794	1.000	15	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]MoH)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(CF3)	H(C[6]C[6]2)	C[6](C[6]C[6]MoH)(C[6]N[6]C)(H){1|H<1>,2|C<4>}	C[6](C[6]C[6]H)(N[6]C[6]C)(CF3){1|Mo<7>,1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.6640	0.000	1	119.3610	0.073	8	118.9794	1.000	15	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]MoH)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(CF3)	H(C[6]C[6]2)	C[6](C[6]C[6]MoH)(C[6]N[6]C)(H){1|H<1>,2|C<4>}	C[6](C[6]C[6]H)(N[6]C[6]C)(CF3){1|Mo<7>,1|C<4>,3|H<1>}	H(C[6]C[6]2)	119.3200	0.075	3	119.3610	0.073	8	118.9794	1.000	15	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]MoH)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(CF3)	H(C[6]C[6]2)	C[6](C[6]C[6]MoH)(C[6]N[6]C)(H){1|H<1>,2|C<4>}	C[6](C[6]C[6]H)(N[6]C[6]C)(CF3){1|Mo<7>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.4893	0.125	3	119.3610	0.073	8	118.9794	1.000	15	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6a]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]C)(CF3)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]H)(C[6]N[6]C)(H){1|C<4>,1|H<1>,4|C<3>}	C[6](C[6]C[6]H)(N[6]C[6]C)(CF3){1|C<3>,1|C<4>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	119.6190	0.000	1	119.6190	0.000	1	118.9794	1.000	15	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6a]C[6]H)(C[6]N[6]C)(H)	C[6](C[6]C[6]H)(N[6]C[6]S)(CF3)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]H)(C[6]N[6]C)(H){1|C<4>,1|S<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6]H)(N[6]C[6]S)(CF3){1|C<3>,1|C<4>,1|O<2>,2|H<1>}	H(C[6]C[6]2)	117.3180	0.000	1	117.3180	0.000	1	118.9794	1.000	15	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	N[5,6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6a]C[6]H)(C[6]N[5,6]C)(H)	C[6](N[5,6]C[5,6]S[5])(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]H)(C[6]N[5,6]C)(H){1|C<4>,1|S<4>,3|C<3>}	C[6](N[5,6]C[5,6]S[5])(C[6]C[6]H)(CCHH){1|H<1>,2|O<1>,4|C<3>}	H(C[6]C[6]2)	117.7000	0.000	1	117.7000	0.000	1	117.7000	0.000	1	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]N[6]C)(H)	C[6](N[6]C[6]Li)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]N[6]C)(H){1|Li<3>,1|C<4>,2|H<1>}	C[6](N[6]C[6]Li)(C[6]C[6]H)(CH3){2|H<1>,3|C<4>}	H(C[6]C[6]2)	119.3550	0.000	2	119.3550	0.000	2	118.4594	3.272	24	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6a]C[6]H)(C[6]N[6]C)(H)	C[6](N[6]C[6a]N[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]H)(C[6]N[6]C)(H){1|N<2>,4|C<3>}	C[6](N[6]C[6a]N[6])(C[6]C[6]H)(CH3){1|H<1>,4|C<3>}	H(C[6]C[6]2)	118.8190	0.000	1	118.8190	0.000	1	118.4594	3.272	24	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]CC)(C[6]N[6]C)(H)	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]CC)(C[6]N[6]C)(H){1|H<1>,2|C<3>}	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(CH3){1|N<3>,1|S<1>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	118.5111	1.718	18	118.5111	2.952	18	118.4594	3.272	24	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]CH)(C[6]N[6]C)(H)	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]N[6]CH)(C[6]N[6]C)(H){1|Ge<2>,2|C<3>}	C[6](N[6]C[6a]Ge[6])(C[6]C[6]H)(CC3){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	114.3800	0.000	1	114.3800	0.000	1	118.4594	3.272	24	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]HH)(C[6]N[6]C)(H)	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]HH)(C[6]N[6]C)(H){3|C<3>}	C[6](N[6]C[6a]C[6])(C[6]C[6]H)(CH3){1|N<3>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	117.2070	0.000	1	117.2070	0.000	1	118.4594	3.272	24	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	N[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]RuO)(C[6]N[6]C)(H)	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]RuO)(C[6]N[6]C)(H){1|Ru<7>,1|C<4>}	C[6](N[6]C[6]Ru)(C[6]C[6]H)(CH3){1|Ru<7>,1|N<3>,1|O<2>,1|S<2>}	H(C[6]C[6]2)	120.7100	0.000	1	120.7100	0.000	1	118.4594	3.272	24	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	C[6]-4:C[6]-3:H-1:	P[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]P[6]C)(H)	C[6](P[6]C[6a]C[6])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]P[6]C)(H){1|C<3>,1|C<4>,2|H<1>}	C[6](P[6]C[6a]C[6])(C[6]C[6]H)(CH3){1|C<4>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	116.4100	0.061	2	116.4100	0.004	2	116.4100	0.004	2	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	N[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](N[6]C[6]CC)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3)	H(C[6]C[6]N[6])	C[6](N[6]C[6]CC)(C[6]C[6]C)(H){1|C<3>,1|C<4>,2|H<1>}	C[6](C[6]C[6]H)(C[6]N[6]H)(CH3){4|C<4>}	H(C[6]C[6]N[6])	119.5190	0.000	1	119.5190	0.000	1	119.5190	0.000	1	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	S[6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](S[6]N[6]OO)(C[6]C[6]C)(H)	C[6](C[6]C[6]H)(C[6]S[6]H)(CH3)	H(C[6]C[6]S[6])	C[6](S[6]N[6]OO)(C[6]C[6]C)(H){1|H<1>,2|C<3>}	C[6](C[6]C[6]H)(C[6]S[6]H)(CH3){1|C<4>,1|N<3>,2|O<1>}	H(C[6]C[6]S[6])	119.5340	0.000	1	119.5340	0.000	1	119.5340	0.000	1	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	S[6]-4:C[6]-3:H-1:	C[6]-3:N[6]-3:C-4:	C[6]-3:	C[6](S[6]C[6]OO)(C[6]N[6]C)(H)	C[6](C[6]S[6]H)(N[6]C[6]H)(CH3)	H(C[6]C[6]S[6])	C[6](S[6]C[6]OO)(C[6]N[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]S[6]H)(N[6]C[6]H)(CH3){2|C<3>,2|O<1>}	H(C[6]C[6]S[6])	117.8810	0.000	1	117.8810	0.000	1	117.8810	0.000	1	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:3:4:	3:	Si[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](Si[5,6]C[5]2C[6])(C[6]C[6]C)(H)	C[6](C[6]Si[5,6]H)(C[6]C[6]C)(CH3)	H(C[6]Si[5,6]C[6])	C[6](Si[5,6]C[5]2C[6])(C[6]C[6]C)(H){4|Si<4>,1|H<1>,2|C<3>,2|C<4>}	C[6](C[6]Si[5,6]H)(C[6]C[6]C)(CH3){2|C<3>,2|C<4>}	H(C[6]Si[5,6]C[6])	118.4330	0.000	1	118.4330	0.000	1	118.4330	0.000	1	118.6156	1.875	431	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[3,5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[3,5,6]C[3,5]C[5,6]C[3])(C[6]C[6]H)(H)	C[6](C[6]C[3,5,6]H)(C[6]N[6]HH)(H)	H(C[6]C[3,5,6]C[6])	C[6](C[3,5,6]C[3,5]C[5,6]C[3])(C[6]C[6]H)(H){1|N<3>,3|C<3>,5|H<1>}	C[6](C[6]C[3,5,6]H)(C[6]N[6]HH)(H){1|C<3>,3|C<4>}	H(C[6]C[3,5,6]C[6])	123.9880	0.000	1	123.9880	0.000	1	122.4745	4.581	2	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[3,5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[3,5,6]C[5,6,6]C[3,5]C[3])(C[6]C[6]H)(H)	C[6](C[6]C[3,5,6]H)(C[6]N[6,6]HH)(H)	H(C[6]C[3,5,6]C[6])	C[6](C[3,5,6]C[5,6,6]C[3,5]C[3])(C[6]C[6]H)(H){1|N<3>,3|C<4>,5|H<1>}	C[6](C[6]C[3,5,6]H)(C[6]N[6,6]HH)(H){4|C<4>}	H(C[6]C[3,5,6]C[6])	120.9610	0.000	1	120.9610	0.000	1	122.4745	4.581	2	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[3,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[3,6]C[3,5,6]C[3,5]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[3,6]H)(C[6]C[6]HH)(H)	H(C[6]C[3,6]C[6])	C[6](C[3,6]C[3,5,6]C[3,5]C[6a])(C[6]C[6]H)(H){2|C<3>,3|C<4>,3|H<1>}	C[6](C[6]C[3,6]H)(C[6]C[6]HH)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[3,6]C[6])	117.8200	0.112	2	117.9660	0.070	3	118.6683	2.019	4	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[3,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[3,6]C[3,5,6]C[3,5]C[6a])(C[6]C[6]H)(H)	C[6](C[6]C[3,6]H)(C[6]C[6]HH)(H)	H(C[6]C[3,6]C[6])	C[6](C[3,6]C[3,5,6]C[3,5]C[6a])(C[6]C[6]H)(H){2|C<4>,3|C<3>,3|H<1>}	C[6](C[6]C[3,6]H)(C[6]C[6]HH)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[3,6]C[6])	118.2580	0.000	1	117.9660	0.070	3	118.6683	2.019	4	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[3,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[3,6]C[3,6]N[3]H)(C[6]C[6]H)(H)	C[6](C[6]C[3,6]H)(C[6]C[6]HH)(H)	H(C[6]C[3,6]C[6])	C[6](C[3,6]C[3,6]N[3]H)(C[6]C[6]H)(H){1|C<4>,1|N<3>,3|H<1>}	C[6](C[6]C[3,6]H)(C[6]C[6]HH)(H){1|C<4>,1|N<3>,3|H<1>}	H(C[6]C[3,6]C[6])	120.7750	0.000	1	120.7750	0.000	1	118.6683	2.019	4	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[3x6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[3x6]C[3x6]2H)(C[6]C[6]H)(H)	C[6](C[6]C[3x6]H)(C[6]C[6]HH)(H)	H(C[6]C[3x6]C[6])	C[6](C[3x6]C[3x6]2H)(C[6]C[6]H)(H){2|C<4>,3|C<3>,3|H<1>}	C[6](C[6]C[3x6]H)(C[6]C[6]HH)(H){2|C<4>,3|H<1>}	H(C[6]C[3x6]C[6])	121.0420	0.000	1	121.0420	0.000	1	119.7580	3.297	2	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[3x6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[3x6]C[3x6]C[6]O[6])(C[6]C[6]H)(H)	C[6](C[6]C[3x6]H)(C[6]C[6]HH)(H)	H(C[6]C[3x6]C[6])	C[6](C[3x6]C[3x6]C[6]O[6])(C[6]C[6]H)(H){4|H<1>,5|C<4>}	C[6](C[6]C[3x6]H)(C[6]C[6]HH)(H){1|H<1>,1|O<2>,3|C<4>}	H(C[6]C[3x6]C[6])	118.4740	0.000	1	118.4740	0.000	1	119.7580	3.297	2	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[4,5,6,6]-4:C[6]-3:H-1:	C[6]-3:C[3x6]-4:H-1:	C[6]-3:	C[6](C[4,5,6,6]C[4,5,5,6]C[4,5,6,6]C[5,6])(C[6]C[3x6]H)(H)	C[6](C[6]C[4,5,6,6]H)(C[3x6]C[3x6]2H)(H)	H(C[6]C[4,5,6,6]C[6])	C[6](C[4,5,6,6]C[4,5,5,6]C[4,5,6,6]C[5,6])(C[6]C[3x6]H)(H){1|O<1>,1|O<2>,2|H<1>,5|C<4>}	C[6](C[6]C[4,5,6,6]H)(C[3x6]C[3x6]2H)(H){2|C<3>,2|H<1>,4|C<4>}	H(C[6]C[4,5,6,6]C[6])	118.4600	0.000	1	118.4600	0.000	1	118.8455	0.297	2	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[4,5,6,6]-4:C[6]-3:H-1:	C[6]-3:C[3x6]-4:H-1:	C[6]-3:	C[6](C[4,5,6,6]C[4,5,6,6]2C[5,6])(C[6]C[3x6]H)(H)	C[6](C[6]C[4,5,6,6]H)(C[3x6]C[3x6]2H)(H)	H(C[6]C[4,5,6,6]C[6])	C[6](C[4,5,6,6]C[4,5,6,6]2C[5,6])(C[6]C[3x6]H)(H){1|O<1>,1|O<2>,2|H<1>,5|C<4>}	C[6](C[6]C[4,5,6,6]H)(C[3x6]C[3x6]2H)(H){2|C<3>,2|H<1>,4|C<4>}	H(C[6]C[4,5,6,6]C[6])	119.2310	0.000	1	119.2310	0.000	1	118.8455	0.297	2	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[4,5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[4,5,6]C[4,5]C[5,6]N[4])(C[6]C[6]H)(H)	C[6](C[6]C[4,5,6]H)(C[6]C[6]HO)(H)	H(C[6]C[4,5,6]C[6])	C[6](C[4,5,6]C[4,5]C[5,6]N[4])(C[6]C[6]H)(H){1|C<3>,2|O<2>,3|C<4>,3|H<1>}	C[6](C[6]C[4,5,6]H)(C[6]C[6]HO)(H){1|N<3>,2|C<4>,2|H<1>}	H(C[6]C[4,5,6]C[6])	118.2160	0.000	1	118.2160	0.000	1	118.2160	0.000	1	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[4,6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[4,6,6]C[4,3x6]C[4]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[4,6,6]H)(C[6]N[6,6]HH)(H)	H(C[6]C[4,6,6]C[6])	C[6](C[4,6,6]C[4,3x6]C[4]C[6])(C[6]C[6]H)(H){1|C<3>,1|N<3>,4|C<4>,4|H<1>}	C[6](C[6]C[4,6,6]H)(C[6]N[6,6]HH)(H){4|C<4>}	H(C[6]C[4,6,6]C[6])	118.2420	0.000	1	118.2420	0.000	1	118.2420	0.000	1	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[4,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[4,6]C[4,5,6]C[4,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[4,6]H)(C[6]C[6]HH)(H)	H(C[6]C[4,6]C[6])	C[6](C[4,6]C[4,5,6]C[4,6]H)(C[6]C[6]H)(H){3|H<1>,4|C<4>}	C[6](C[6]C[4,6]H)(C[6]C[6]HH)(H){2|C<4>,3|H<1>}	H(C[6]C[4,6]C[6])	120.9510	0.000	1	120.9510	0.000	1	120.2757	0.615	3	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[4,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[4,6]C[4,6]C[4]H)(C[6]C[6]H)(H)	C[6](C[6]C[4,6]H)(C[6]C[6]HH)(H)	H(C[6]C[4,6]C[6])	C[6](C[4,6]C[4,6]C[4]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,4|H<1>}	C[6](C[6]C[4,6]H)(C[6]C[6]HH)(H){1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[4,6]C[6])	120.4600	0.000	1	119.9380	0.545	2	120.2757	0.615	3	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[4,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[4,6]C[4,6]C[4]H)(C[6]C[6]H)(H)	C[6](C[6]C[4,6]H)(C[6]C[6]HH)(H)	H(C[6]C[4,6]C[6])	C[6](C[4,6]C[4,6]C[4]H)(C[6]C[6]H)(H){1|C<4>,1|O<1>,1|O<2>,3|H<1>}	C[6](C[6]C[4,6]H)(C[6]C[6]HH)(H){1|Br<1>,1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[4,6]C[6])	119.4160	0.000	1	119.9380	0.545	2	120.2757	0.615	3	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[4x6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[4x6]C[3x6]2C[6,6])(C[6]C[6]H)(H)	C[6](C[6]C[4x6]H)(C[6]C[6]HO)(H)	H(C[6]C[4x6]C[6])	C[6](C[4x6]C[3x6]2C[6,6])(C[6]C[6]H)(H){2|O<2>,4|C<4>,5|H<1>}	C[6](C[6]C[4x6]H)(C[6]C[6]HO)(H){5|C<4>}	H(C[6]C[4x6]C[6])	120.7610	0.000	1	120.7610	0.000	1	120.7610	0.000	1	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[5,3x6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[5,3x6]C[3x6]C[5,6]2)(C[6]C[6]H)(H)	C[6](C[6]C[5,3x6]H)(C[6]C[6]HO)(H)	H(C[6]C[5,3x6]C[6])	C[6](C[5,3x6]C[3x6]C[5,6]2)(C[6]C[6]H)(H){1|O<2>,4|C<4>,6|H<1>}	C[6](C[6]C[5,3x6]H)(C[6]C[6]HO)(H){1|C<3>,1|H<1>,3|C<4>}	H(C[6]C[5,3x6]C[6])	118.0370	0.000	1	118.0370	0.000	1	117.9465	0.016	2	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[5,3x6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[5,3x6]C[5,3x6]C[3x6]N[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,3x6]H)(C[6]C[6]HH)(H)	H(C[6]C[5,3x6]C[6])	C[6](C[5,3x6]C[5,3x6]C[3x6]N[5])(C[6]C[6]H)(H){1|C<3>,4|C<4>,5|H<1>}	C[6](C[6]C[5,3x6]H)(C[6]C[6]HH)(H){1|N<3>,2|C<4>,2|H<1>}	H(C[6]C[5,3x6]C[6])	117.8560	0.000	1	117.8560	0.000	1	117.9465	0.016	2	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[5,5,6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[5,5,6,6]C[5,6,6]C[5,5]C[5,6])(C[6]C[6]H)(H)	C[6](C[6]C[5,5,6,6]H)(C[6]C[6]HH)(H)	H(C[6]C[5,5,6,6]C[6])	C[6](C[5,5,6,6]C[5,6,6]C[5,5]C[5,6])(C[6]C[6]H)(H){1|O<2>,2|C<3>,3|C<4>,5|H<1>}	C[6](C[6]C[5,5,6,6]H)(C[6]C[6]HH)(H){2|H<1>,3|C<4>}	H(C[6]C[5,5,6,6]C[6])	120.2090	0.000	1	120.2090	0.000	1	120.2090	0.000	1	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[5,5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[5,5,6]C[3x5,6]C[5]2)(C[6]C[6]H)(H)	C[6](C[6]C[5,5,6]H)(C[6]N[5,6]HH)(H)	H(C[6]C[5,5,6]C[6])	C[6](C[5,5,6]C[3x5,6]C[5]2)(C[6]C[6]H)(H){1|C<3>,1|N<3>,1|O<2>,3|C<4>,5|H<1>}	C[6](C[6]C[5,5,6]H)(C[6]N[5,6]HH)(H){4|C<4>}	H(C[6]C[5,5,6]C[6])	118.2290	0.226	2	118.2290	0.051	2	119.7860	1.315	13	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[5,5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[5,5,6]C[5,5,6]C[5,5]O[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,5,6]H)(C[6]C[5,6]CH)(H)	H(C[6]C[5,5,6]C[6])	C[6](C[5,5,6]C[5,5,6]C[5,5]O[5])(C[6]C[6]H)(H){1|C<3>,1|O<2>,2|H<1>,5|C<4>}	C[6](C[6]C[5,5,6]H)(C[6]C[5,6]CH)(H){1|H<1>,1|O<2>,3|C<4>}	H(C[6]C[5,5,6]C[6])	120.0270	0.302	4	120.0270	0.091	4	119.7860	1.315	13	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[5,5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[5,5,6]C[5,5,6]C[5,6]O[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,5,6]H)(C[6]C[5,6]HO)(H)	H(C[6]C[5,5,6]C[6])	C[6](C[5,5,6]C[5,5,6]C[5,6]O[5])(C[6]C[6]H)(H){1|C<3>,1|O<2>,3|H<1>,4|C<4>}	C[6](C[6]C[5,5,6]H)(C[6]C[5,6]HO)(H){1|C<3>,1|O<2>,3|C<4>}	H(C[6]C[5,5,6]C[6])	120.9843	0.289	3	120.9843	0.083	3	119.7860	1.315	13	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[5,5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[5,5,6]C[5,5,6]C[5,6a]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,5,6]H)(C[6]C[6]HH)(H)	H(C[6]C[5,5,6]C[6])	C[6](C[5,5,6]C[5,5,6]C[5,6a]C[5])(C[6]C[6]H)(H){1|N<3>,1|O<2>,2|C<3>,2|C<4>,4|H<1>}	C[6](C[6]C[5,5,6]H)(C[6]C[6]HH)(H){1|C<3>,1|H<1>,1|N<2>,2|C<4>}	H(C[6]C[5,5,6]C[6])	118.2770	0.307	2	118.2770	0.094	2	119.7860	1.315	13	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[5,5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[5,5,6]C[5,5]C[5,6]O[5,6])(C[6]C[6]H)(H)	C[6](C[6]C[5,5,6]H)(C[6]C[5,6]HO)(H)	H(C[6]C[5,5,6]C[6])	C[6](C[5,5,6]C[5,5]C[5,6]O[5,6])(C[6]C[6]H)(H){1|C<3>,1|O<2>,3|H<1>,4|C<4>}	C[6](C[6]C[5,5,6]H)(C[6]C[5,6]HO)(H){1|C<3>,1|H<1>,1|O<2>,2|C<4>}	H(C[6]C[5,5,6]C[6])	120.4940	0.000	1	120.4940	0.000	1	119.7860	1.315	13	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[5,5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[5,5,6]C[5,5]C[5,6]O[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,5,6]H)(C[6]C[6]HH)(H)	H(C[6]C[5,5,6]C[6])	C[6](C[5,5,6]C[5,5]C[5,6]O[5])(C[6]C[6]H)(H){1|C<3>,1|N<3>,3|C<4>,4|H<1>}	C[6](C[6]C[5,5,6]H)(C[6]C[6]HH)(H){1|O<2>,2|C<4>,2|H<1>}	H(C[6]C[5,5,6]C[6])	120.6510	0.000	1	120.6510	0.000	1	119.7860	1.315	13	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[5,6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:Br-1:	C[6]-3:	C[6](C[5,6,6]C[5,5,6]C[5,6,6]H)(C[6]C[6]Br)(H)	C[6](C[6]C[5,6,6]H)(C[6]C[6]BrH)(Br)	H(C[6]C[5,6,6]C[6])	C[6](C[5,6,6]C[5,5,6]C[5,6,6]H)(C[6]C[6]Br)(H){1|Br<1>,1|C<3>,3|C<4>,3|H<1>}	C[6](C[6]C[5,6,6]H)(C[6]C[6]BrH)(Br){2|C<4>,3|H<1>}	H(C[6]C[5,6,6]C[6])	118.8410	0.273	2	118.8410	0.074	2	118.8410	0.074	2	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[5,6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[5,6,6]C[5,4x6]C[5,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6,6]H)(C[6]C[6]HH)(H)	H(C[6]C[5,6,6]C[6])	C[6](C[5,6,6]C[5,4x6]C[5,6]C[6])(C[6]C[6]H)(H){1|C<3>,2|O<2>,3|C<4>,5|H<1>}	C[6](C[6]C[5,6,6]H)(C[6]C[6]HH)(H){5|C<4>}	H(C[6]C[5,6,6]C[6])	120.1110	0.663	2	120.1110	0.440	2	119.6288	1.361	17	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[5,6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[5,6,6]C[5,5,6]C[5,6,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6,6]H)(C[6]C[6]CH)(H)	H(C[6]C[5,6,6]C[6])	C[6](C[5,6,6]C[5,5,6]C[5,6,6]H)(C[6]C[6]H)(H){1|C<3>,1|O<2>,3|C<4>,3|H<1>}	C[6](C[6]C[5,6,6]H)(C[6]C[6]CH)(H){1|O<2>,2|C<4>,2|H<1>}	H(C[6]C[5,6,6]C[6])	118.1690	0.000	1	118.1690	0.000	1	119.6288	1.361	17	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[5,6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[5,6,6]C[5,6,6]C[5]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6,6]H)(C[6]C[6]HH)(H)	H(C[6]C[5,6,6]C[6])	C[6](C[5,6,6]C[5,6,6]C[5]C[6])(C[6]C[6]H)(H){1|C<3>,1|O<2>,4|C<4>,5|H<1>}	C[6](C[6]C[5,6,6]H)(C[6]C[6]HH)(H){2|H<1>,3|C<4>}	H(C[6]C[5,6,6]C[6])	119.7730	0.000	1	119.9083	0.031	3	119.6288	1.361	17	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[5,6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[5,6,6]C[5,6,6]C[5]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6,6]H)(C[6]C[6]HH)(H)	H(C[6]C[5,6,6]C[6])	C[6](C[5,6,6]C[5,6,6]C[5]C[6])(C[6]C[6]H)(H){1|C<3>,1|O<2>,4|H<1>,5|C<4>}	C[6](C[6]C[5,6,6]H)(C[6]C[6]HH)(H){2|H<1>,3|C<4>}	H(C[6]C[5,6,6]C[6])	119.9760	0.188	2	119.9083	0.031	3	119.6288	1.361	17	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[5,6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[5,6,6]C[5,6,6]C[6,6a]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6,6]H)(C[6]C[6]HO)(H)	H(C[6]C[5,6,6]C[6])	C[6](C[5,6,6]C[5,6,6]C[6,6a]C[5])(C[6]C[6]H)(H){1|N<3>,1|O<2>,2|C<4>,2|H<1>,3|C<3>}	C[6](C[6]C[5,6,6]H)(C[6]C[6]HO)(H){1|C<4>,2|C<3>,2|H<1>}	H(C[6]C[5,6,6]C[6])	119.6210	0.000	1	120.6750	1.755	3	119.6288	1.361	17	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[5,6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[5,6,6]C[5,6,6]C[6,6a]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6,6]H)(C[6]C[6]HO)(H)	H(C[6]C[5,6,6]C[6])	C[6](C[5,6,6]C[5,6,6]C[6,6a]C[5])(C[6]C[6]H)(H){1|N<4>,2|C<3>,2|C<4>,2|O<2>,3|H<1>}	C[6](C[6]C[5,6,6]H)(C[6]C[6]HO)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[5,6,6]C[6])	121.2020	1.358	2	120.6750	1.755	3	119.6288	1.361	17	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[5,6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[5,6,6]C[5,6,6]C[6]O[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6,6]H)(C[6]C[6]HH)(H)	H(C[6]C[5,6,6]C[6])	C[6](C[5,6,6]C[5,6,6]C[6]O[5])(C[6]C[6]H)(H){1|C<3>,1|O<2>,3|H<1>,4|C<4>}	C[6](C[6]C[5,6,6]H)(C[6]C[6]HH)(H){1|H<1>,1|O<2>,3|C<4>}	H(C[6]C[5,6,6]C[6])	118.7570	0.000	1	118.7570	0.000	1	119.6288	1.361	17	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[5,6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[5,6,6]C[5,6]2C[6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6,6]H)(C[6]C[6]HH)(H)	H(C[6]C[5,6,6]C[6])	C[6](C[5,6,6]C[5,6]2C[6])(C[6]C[6]H)(H){1|Cl<1>,2|C<4>,3|C<3>,3|H<1>}	C[6](C[6]C[5,6,6]H)(C[6]C[6]HH)(H){1|C<4>,2|C<3>,2|H<1>}	H(C[6]C[5,6,6]C[6])	121.0340	0.000	1	119.6720	3.710	2	119.6288	1.361	17	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[5,6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[5,6,6]C[5,6]2C[6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6,6]H)(C[6]C[6]HH)(H)	H(C[6]C[5,6,6]C[6])	C[6](C[5,6,6]C[5,6]2C[6])(C[6]C[6]H)(H){2|C<3>,3|C<4>,5|H<1>}	C[6](C[6]C[5,6,6]H)(C[6]C[6]HH)(H){2|C<4>,3|C<3>}	H(C[6]C[5,6,6]C[6])	118.3100	0.000	1	119.6720	3.710	2	119.6288	1.361	17	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[5,6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[5,6,6]C[6,6a]C[5,6]2)(C[6]C[6]H)(H)	C[6](C[6]C[5,6,6]H)(C[6]C[6]HH)(H)	H(C[6]C[5,6,6]C[6])	C[6](C[5,6,6]C[6,6a]C[5,6]2)(C[6]C[6]H)(H){2|C<4>,3|H<1>,4|C<3>}	C[6](C[6]C[5,6,6]H)(C[6]C[6]HH)(H){1|C<4>,2|C<3>,2|H<1>}	H(C[6]C[5,6,6]C[6])	120.2350	0.000	1	120.2350	0.000	1	119.6288	1.361	17	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[5,6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[5,6,6]C[6,6a]C[5,6]2)(C[6]C[6]H)(H)	C[6](C[6]C[5,6,6]H)(C[6]C[6]HO)(H)	H(C[6]C[5,6,6]C[6])	C[6](C[5,6,6]C[6,6a]C[5,6]2)(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|C<4>,2|H<1>,3|O<2>}	C[6](C[6]C[5,6,6]H)(C[6]C[6]HO)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[5,6,6]C[6])	117.9555	0.042	2	118.7797	2.039	3	119.6288	1.361	17	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[5,6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[5,6,6]C[6,6a]C[5,6]2)(C[6]C[6]H)(H)	C[6](C[6]C[5,6,6]H)(C[6]C[6]HO)(H)	H(C[6]C[5,6,6]C[6])	C[6](C[5,6,6]C[6,6a]C[5,6]2)(C[6]C[6]H)(H){1|N<4>,2|C<3>,2|C<4>,2|H<1>,3|O<2>}	C[6](C[6]C[5,6,6]H)(C[6]C[6]HO)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[5,6,6]C[6])	120.4280	0.000	1	118.7797	2.039	3	119.6288	1.361	17	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[5,6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[5,6,6]N[5,6]O[6,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6,6]H)(C[6]C[3x6]HO)(H)	H(C[6]C[5,6,6]C[6])	C[6](C[5,6,6]N[5,6]O[6,6]C[5])(C[6]C[6]H)(H){1|O<2>,2|C<3>,2|C<4>,3|H<1>}	C[6](C[6]C[5,6,6]H)(C[6]C[3x6]HO)(H){1|C<3>,1|N<3>,1|O<2>,2|C<4>}	H(C[6]C[5,6,6]C[6])	118.8740	0.000	1	118.8740	0.000	1	119.6288	1.361	17	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:Br-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]Br)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]CH)(Br)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]Br)(H){1|O<2>,3|C<4>,4|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]CH)(Br){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[5,6]C[6])	118.9150	0.000	1	118.8815	0.002	2	118.7965	0.012	4	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:Br-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]Br)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]CH)(Br)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]Br)(H){1|O<2>,3|H<1>,4|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]CH)(Br){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[5,6]C[6])	118.8480	0.000	1	118.8815	0.002	2	118.7965	0.012	4	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:Br-1:	C[6]-3:	C[6](C[5,6]C[5,6]O[5]H)(C[6]C[6]Br)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]HO)(Br)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]O[5]H)(C[6]C[6]Br)(H){1|C<4>,1|H<1>,2|C<3>,2|O<2>}	C[6](C[6]C[5,6]H)(C[6]C[6]HO)(Br){1|C<4>,1|H<1>,1|O<2>,2|F<1>}	H(C[6]C[5,6]C[6])	118.7115	0.064	2	118.7115	0.004	2	118.7965	0.012	4	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[5,6]C[4,5]C[5]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]N[6]CH)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[4,5]C[5]C[6])(C[6]C[6]H)(H){1|C<3>,1|N<3>,1|O<1>,1|O<2>,3|C<4>,3|H<1>}	C[6](C[6]C[5,6]H)(C[6]N[6]CH)(H){1|C<3>,3|C<4>}	H(C[6]C[5,6]C[6])	120.3660	0.000	1	120.3660	0.000	1	119.0622	2.538	95	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[5,6]C[5,3x6]C[5]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,3x6]C[5]C[6])(C[6]C[6]H)(H){1|C<3>,2|O<2>,3|C<4>,5|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H){5|C<4>}	H(C[6]C[5,6]C[6])	117.4200	0.242	2	117.4200	0.058	2	119.0622	2.538	95	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[5,6]C[5,5]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,5]C[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|O<2>,2|C<4>,4|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H){2|C<4>,3|H<1>}	H(C[6]C[5,6]C[6])	117.7908	0.153	4	117.7908	0.023	4	119.0622	2.538	95	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[5,6]C[5,6,6]C[5]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6,6]C[5]H)(C[6]C[6]H)(H){1|C<4>,1|N<3>,2|C<3>,4|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H){2|C<4>,3|H<1>}	H(C[6]C[5,6]C[6])	117.6090	0.000	1	117.7275	0.028	2	119.0622	2.538	95	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[5,6]C[5,6,6]C[5]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6,6]C[5]H)(C[6]C[6]H)(H){1|C<4>,1|N<3>,3|C<3>,3|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H){2|C<4>,3|H<1>}	H(C[6]C[5,6]C[6])	117.8460	0.000	1	117.7275	0.028	2	119.0622	2.538	95	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[5,6]C[5,6,6]C[5]O)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6,6]C[5]O)(C[6]C[6]H)(H){4|C<4>,4|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H){1|O<2>,2|C<4>,2|H<1>}	H(C[6]C[5,6]C[6])	120.4380	0.000	1	120.4380	0.000	1	119.0622	2.538	95	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]2H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]CH)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]2H)(C[6]C[6]H)(H){1|C<3>,3|H<1>,4|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]CH)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[5,6]C[6])	118.9400	0.000	1	118.9400	0.000	1	119.0622	2.538	95	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]2H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]2H)(C[6]C[6]H)(H){1|C<3>,1|O<2>,3|C<4>,3|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H){2|C<4>,3|H<1>}	H(C[6]C[5,6]C[6])	118.0920	0.000	1	118.0920	0.000	1	119.0622	2.538	95	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]2O)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]HO)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]2O)(C[6]C[6]H)(H){1|C<3>,1|N<3>,1|O<2>,2|C<4>,3|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]HO)(H){1|O<2>,2|C<4>,2|H<1>}	H(C[6]C[5,6]C[6])	117.6070	0.000	1	117.6070	0.000	1	119.0622	2.538	95	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]C)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]CC)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]C)(C[6]C[6]H)(H){2|C<3>,3|C<4>,3|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]CC)(H){1|H<1>,4|C<4>}	H(C[6]C[5,6]C[6])	118.0690	0.000	1	118.0690	0.000	1	119.0622	2.538	95	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]C)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]CH)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]C)(C[6]C[6]H)(H){2|C<3>,2|C<4>,4|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]CH)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[5,6]C[6])	117.6290	0.000	1	117.6290	0.000	1	119.0622	2.538	95	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]C)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]C)(C[6]C[6]H)(H){1|O<2>,1|S<3>,2|C<4>,4|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H){2|H<1>,3|C<4>}	H(C[6]C[5,6]C[6])	117.5400	0.307	3	117.5400	0.094	3	119.0622	2.538	95	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]C)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]HO)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]C)(C[6]C[6]H)(H){1|C<4>,1|O<2>,2|C<3>,4|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]HO)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[5,6]C[6])	117.6110	0.000	1	117.6110	0.000	1	119.0622	2.538	95	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]Fe)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]CH)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]Fe)(C[6]C[6]H)(H){2|H<1>,4|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]CH)(H){1|Fe<8>,2|C<4>,2|H<1>}	H(C[6]C[5,6]C[6])	121.5817	3.075	3	121.5817	9.457	3	119.0622	2.538	95	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]2H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H){1|C<3>,1|O<2>,2|C<4>,4|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]2H)(H){2|C<3>,3|C<4>,3|H<1>}	H(C[6]C[5,6]C[6])	119.9470	0.017	2	119.9470	0.000	2	119.0622	2.538	95	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]CH)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,5|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]CH)(H){1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	119.1280	0.000	1	119.0425	1.183	6	119.0622	2.538	95	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]CH)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H){1|C<3>,1|N<3>,2|C<4>,4|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]CH)(H){1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	117.9970	0.064	2	119.0425	1.183	6	119.0622	2.538	95	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]CH)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H){1|C<3>,1|N<3>,3|C<4>,3|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]CH)(H){2|C<4>,3|H<1>}	H(C[6]C[5,6]C[6])	120.5160	0.000	1	119.0425	1.183	6	119.0622	2.538	95	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]CH)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H){1|N<3>,3|C<4>,4|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]CH)(H){2|C<4>,3|H<1>}	H(C[6]C[5,6]C[6])	118.4710	0.000	1	119.0425	1.183	6	119.0622	2.538	95	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]CH)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H){1|O<2>,3|C<4>,4|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]CH)(H){1|O<2>,2|C<4>,2|H<1>}	H(C[6]C[5,6]C[6])	120.1460	0.000	1	119.0425	1.183	6	119.0622	2.538	95	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H){1|C<2>,1|N<3>,2|C<4>,4|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[5,6]C[6])	117.8140	0.000	1	119.3794	2.001	14	119.0622	2.538	95	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H){1|C<2>,1|N<3>,2|C<4>,4|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H){2|C<4>,3|H<1>}	H(C[6]C[5,6]C[6])	120.0080	0.000	1	119.3794	2.001	14	119.0622	2.538	95	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>,4|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H){1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	118.8010	0.000	1	119.3794	2.001	14	119.0622	2.538	95	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H){1|C<3>,1|N<3>,2|C<4>,4|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H){2|C<4>,3|H<1>}	H(C[6]C[5,6]C[6])	119.0355	1.232	2	119.3794	2.001	14	119.0622	2.538	95	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|O<2>,3|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H){2|C<4>,3|H<1>}	H(C[6]C[5,6]C[6])	118.6870	0.000	1	119.3794	2.001	14	119.0622	2.538	95	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H){1|C<3>,3|C<4>,3|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H){1|C<3>,1|C<4>,3|H<1>}	H(C[6]C[5,6]C[6])	121.4490	0.000	1	119.3794	2.001	14	119.0622	2.538	95	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H){1|C<3>,3|C<4>,4|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[5,6]C[6])	119.5005	0.366	2	119.3794	2.001	14	119.0622	2.538	95	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H){1|C<4>,1|N<3>,2|C<3>,4|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H){2|C<4>,3|H<1>}	H(C[6]C[5,6]C[6])	117.4350	0.000	1	119.3794	2.001	14	119.0622	2.538	95	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H){1|C<4>,1|N<3>,2|C<3>,4|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H){2|H<1>,3|C<4>}	H(C[6]C[5,6]C[6])	120.3570	0.000	1	119.3794	2.001	14	119.0622	2.538	95	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H){1|C<4>,2|C<3>,5|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[5,6]C[6])	117.9000	0.000	1	119.3794	2.001	14	119.0622	2.538	95	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|C<4>,3|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H){2|C<4>,3|H<1>}	H(C[6]C[5,6]C[6])	122.4160	0.000	1	119.3794	2.001	14	119.0622	2.538	95	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H){3|C<4>,5|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[5,6]C[6])	119.3720	0.000	1	119.3794	2.001	14	119.0622	2.538	95	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]S)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]S)(C[6]C[6]H)(H){1|C<3>,1|N<4>,2|C<4>,4|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H){1|S<4>,2|C<4>,2|H<1>}	H(C[6]C[5,6]C[6])	118.2290	0.000	1	118.5747	0.064	4	119.0622	2.538	95	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]S)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]S)(C[6]C[6]H)(H){1|O<2>,3|C<4>,4|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H){1|H<1>,1|O<2>,1|S<4>,2|C<4>}	H(C[6]C[5,6]C[6])	118.7600	0.065	2	118.5747	0.064	4	119.0622	2.538	95	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]S)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]S)(C[6]C[6]H)(H){4|C<4>,4|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H){1|H<1>,1|O<2>,1|S<4>,2|C<4>}	H(C[6]C[5,6]C[6])	118.5500	0.000	1	118.5747	0.064	4	119.0622	2.538	95	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]S)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]HO)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]S)(C[6]C[6]H)(H){1|C<3>,1|N<3>,1|O<2>,2|C<4>,3|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]HO)(H){1|S<2>,2|C<4>,2|H<1>}	H(C[6]C[5,6]C[6])	117.1740	0.000	1	117.1740	0.000	1	119.0622	2.538	95	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[6a]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[6a]C[5])(C[6]C[6]H)(H){1|N<3>,2|C<4>,3|C<3>,3|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H){1|C<4>,2|C<3>,2|H<1>}	H(C[6]C[5,6]C[6])	120.6540	0.000	1	120.6540	0.000	1	119.0622	2.538	95	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[6a]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]HO)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[6a]C[5])(C[6]C[6]H)(H){1|N<3>,2|C<3>,2|C<4>,2|O<2>,3|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]HO)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[5,6]C[6])	120.0942	1.088	5	120.0942	1.184	5	119.0622	2.538	95	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]N[5,5]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]N[5,5]H)(C[6]C[6]H)(H){1|C<4>,1|S<4>,2|C<3>,3|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H){1|C<4>,1|N<3>,3|H<1>}	H(C[6]C[5,6]C[6])	118.6360	0.000	1	118.6360	0.000	1	119.0622	2.538	95	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]N[5]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]N[5]H)(C[6]C[6]H)(H){1|C<3>,2|H<1>,4|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H){1|C<4>,1|N<3>,3|H<1>}	H(C[6]C[5,6]C[6])	118.3115	0.115	2	118.3115	0.013	2	119.0622	2.538	95	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]O[5]C)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]CH)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]O[5]C)(C[6]C[6]H)(H){2|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]CH)(H){1|O<2>,2|C<4>,2|H<1>}	H(C[6]C[5,6]C[6])	117.8125	0.377	2	117.8125	0.142	2	119.0622	2.538	95	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]O[5]C)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]HO)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]O[5]C)(C[6]C[6]H)(H){1|O<2>,2|H<1>,3|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]HO)(H){1|O<2>,2|C<4>,2|H<1>}	H(C[6]C[5,6]C[6])	118.0000	0.000	1	118.0000	0.000	1	119.0622	2.538	95	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]O[5]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]HO)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]O[5]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,2|C<3>,2|O<2>}	C[6](C[6]C[5,6]H)(C[6]C[6]HO)(H){1|C<4>,1|H<1>,1|O<2>,2|F<1>}	H(C[6]C[5,6]C[6])	118.2650	0.000	1	119.3670	2.429	2	119.0622	2.538	95	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]O[5]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]HO)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]O[5]H)(C[6]C[6]H)(H){2|C<4>,2|H<1>,2|O<2>}	C[6](C[6]C[5,6]H)(C[6]C[6]HO)(H){1|C<4>,1|N<3>,1|O<2>,2|H<1>}	H(C[6]C[5,6]C[6])	120.4690	0.000	1	119.3670	2.429	2	119.0622	2.538	95	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]O[5]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]O[6]HH)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]O[5]H)(C[6]C[6]H)(H){1|O<2>,2|C<4>,3|H<1>}	C[6](C[6]C[5,6]H)(C[6]O[6]HH)(H){1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[5,6]C[6])	119.8440	0.000	1	119.8440	0.000	1	119.0622	2.538	95	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[5,6]C[5,6a]C[5,6]C)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]HO)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6a]C[5,6]C)(C[6]C[6]H)(H){1|C<4>,2|C<3>,2|H<1>,2|O<2>}	C[6](C[6]C[5,6]H)(C[6]C[6]HO)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[5,6]C[6])	124.3900	0.000	1	124.3900	0.000	1	119.0622	2.538	95	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[5,6]C[5,6a]C[5]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]HO)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6a]C[5]C[6])(C[6]C[6]H)(H){1|C<4>,1|N<3>,1|O<1>,1|O<2>,2|C<3>,3|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]HO)(H){1|C<4>,1|H<1>,1|O<2>,2|C<3>}	H(C[6]C[5,6]C[6])	124.0480	0.000	1	124.0480	0.000	1	119.0622	2.538	95	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[5,6]C[5]2C[6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]CO)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5]2C[6])(C[6]C[6]H)(H){1|C<4>,2|O<2>,3|C<3>,3|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]CO)(H){1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[5,6]C[6])	121.3377	0.174	4	121.3377	0.030	4	119.0622	2.538	95	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[5,6]C[5]2C[6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5]2C[6])(C[6]C[6]H)(H){1|C<3>,1|N<3>,2|C<4>,6|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[5,6]C[6])	118.0720	0.110	3	118.0774	0.091	8	119.0622	2.538	95	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[5,6]C[5]2C[6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5]2C[6])(C[6]C[6]H)(H){1|C<3>,3|C<4>,6|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[5,6]C[6])	117.9560	0.725	2	118.0774	0.091	8	119.0622	2.538	95	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[5,6]C[5]2C[6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5]2C[6])(C[6]C[6]H)(H){1|O<1>,2|C<4>,2|O<2>,5|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[5,6]C[6])	118.1637	0.128	3	118.0774	0.091	8	119.0622	2.538	95	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[5,6]C[5]2C[6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]N[6]CH)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5]2C[6])(C[6]C[6]H)(H){1|C<3>,1|N<3>,1|O<1>,1|O<2>,2|C<4>,3|H<1>}	C[6](C[6]C[5,6]H)(C[6]N[6]CH)(H){2|C<3>,2|C<4>}	H(C[6]C[5,6]C[6])	120.3210	0.000	1	120.3210	0.000	1	119.0622	2.538	95	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[5,6]C[5x3,6x5,20x6]C[5]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]2H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5x3,6x5,20x6]C[5]C[6])(C[6]C[6]H)(H){1|C<6>,2|C<3>,2|C<4>,2|H<1>,4|B<6>}	C[6](C[6]C[5,6]H)(C[6]C[6]2H)(H){1|C<6>,2|H<1>,4|C<3>}	H(C[6]C[5,6]C[6])	117.6495	0.081	4	117.6495	0.007	4	119.0622	2.538	95	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[5,6]C[6]N[5]2)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]CO)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[6]N[5]2)(C[6]C[6]H)(H){1|H<1>,1|O<2>,2|C<4>,3|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]CO)(H){1|C<3>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[5,6]C[6])	118.5853	0.241	7	118.5853	0.058	7	119.0622	2.538	95	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]C[5]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]N[6]HH)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]C[5]C[6])(C[6]C[6]H)(H){1|C<4>,1|O<1>,2|C<3>,2|N<3>,3|H<1>}	C[6](C[6]C[5,6]H)(C[6]N[6]HH)(H){1|C<3>,1|N<3>,2|C<4>}	H(C[6]C[5,6]C[6])	122.2750	0.000	1	122.2750	0.000	1	119.0622	2.538	95	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]C[5]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]C[5]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<2>,4|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(H){1|N<3>,2|C<4>,2|H<1>}	H(C[6]C[5,6]C[6])	119.0280	0.440	2	119.0280	0.193	2	119.0622	2.538	95	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]C[5]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]N[6]CH)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]C[5]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>,1|O<2>,3|H<1>}	C[6](C[6]C[5,6]H)(C[6]N[6]CH)(H){1|C<4>,1|N<3>,2|H<1>}	H(C[6]C[5,6]C[6])	119.4970	0.000	1	119.0305	0.435	2	119.0622	2.538	95	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[5,6]N[5,6]C[5]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]H)(C[6]N[6]CH)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]C[5]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<2>,2|H<1>,2|N<3>}	C[6](C[6]C[5,6]H)(C[6]N[6]CH)(H){1|C<3>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[5,6]C[6])	118.5640	0.000	1	119.0305	0.435	2	119.0622	2.538	95	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:Cl-1:	C[6]-3:	C[6](C[6,6]C[6]3)(C[6]C[6]Cl)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(Cl)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6]3)(C[6]C[6]Cl)(H){1|O<2>,3|C<4>,7|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(Cl){2|H<1>,3|C<4>}	H(C[6]C[6,6]C[6])	118.8270	0.000	1	118.8270	0.000	1	118.8270	0.000	1	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6]C[3x6]C[6]O)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[3x6]C[6]O)(C[6]C[6]H)(H){4|C<4>,4|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H){1|O<2>,2|C<4>,2|H<1>}	H(C[6]C[6,6]C[6])	119.0450	0.000	1	119.0450	0.000	1	118.8748	2.767	83	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6]C[5,6,6]O[6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]HO)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6,6]O[6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>,1|O<2>,2|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]HO)(H){1|Br<1>,1|C<4>,1|O<2>,2|H<1>}	H(C[6]C[6,6]C[6])	118.0730	0.000	1	118.0730	0.000	1	118.8748	2.767	83	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6]C[5,6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6]C[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|O<2>,2|C<4>,4|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H){2|C<4>,3|H<1>}	H(C[6]C[6,6]C[6])	118.0403	0.225	3	117.9428	0.072	4	118.8748	2.767	83	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6]C[5,6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6]C[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|O<2>,3|C<4>,3|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H){2|C<4>,3|H<1>}	H(C[6]C[6,6]C[6])	117.6500	0.000	1	117.9428	0.072	4	118.8748	2.767	83	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]2C)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2C)(C[6]C[6]H)(H){4|C<4>,4|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H){5|C<4>}	H(C[6]C[6,6]C[6])	117.8700	0.000	1	117.8700	0.000	1	118.8748	2.767	83	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]2C)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]HO)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2C)(C[6]C[6]H)(H){2|H<1>,2|O<2>,4|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]HO)(H){2|H<1>,3|C<4>}	H(C[6]C[6,6]C[6])	117.8060	0.000	1	117.8060	0.000	1	118.8748	2.767	83	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]2H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2H)(C[6]C[6]H)(H){2|C<3>,2|C<4>,4|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6,6]C[6])	118.7645	0.585	2	118.7645	0.342	2	118.8748	2.767	83	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]2)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]2)(C[6]C[6]H)(H){1|C<3>,1|O<2>,3|C<4>,5|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H){1|C<3>,4|C<4>}	H(C[6]C[6,6]C[6])	117.7280	0.000	1	117.7280	0.000	1	118.8748	2.767	83	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(H){1|C<3>,2|C<4>,5|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H){1|C<3>,3|C<4>}	H(C[6]C[6,6]C[6])	117.9200	0.000	1	117.9200	0.000	1	118.8748	2.767	83	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]CH)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H){1|C<2>,1|O<2>,2|C<4>,4|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]CH)(H){2|C<4>,3|H<1>}	H(C[6]C[6,6]C[6])	117.0910	0.000	1	118.8461	2.927	17	118.8748	2.767	83	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]CH)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H){1|C<3>,3|C<4>,4|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]CH)(H){1|C<3>,1|H<1>,3|C<4>}	H(C[6]C[6,6]C[6])	117.9255	0.346	2	118.8461	2.927	17	118.8748	2.767	83	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]CH)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H){1|C<3>,3|C<4>,4|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]CH)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6,6]C[6])	118.0583	0.176	4	118.8461	2.927	17	118.8748	2.767	83	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]CH)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H){1|C<3>,3|C<4>,4|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]CH)(H){2|H<1>,3|C<4>}	H(C[6]C[6,6]C[6])	118.6860	0.000	1	118.8461	2.927	17	118.8748	2.767	83	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]CH)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H){4|C<4>,4|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]CH)(H){1|C<3>,1|H<1>,3|C<4>}	H(C[6]C[6,6]C[6])	118.1480	0.000	1	118.8461	2.927	17	118.8748	2.767	83	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]CH)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H){4|C<4>,4|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]CH)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6,6]C[6])	119.7968	2.125	8	118.8461	2.927	17	118.8748	2.767	83	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]CO)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H){1|O<2>,7|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]CO)(H){2|H<1>,3|C<4>}	H(C[6]C[6,6]C[6])	118.1380	0.000	1	118.4933	0.088	6	118.8748	2.767	83	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]CO)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H){2|H<1>,2|O<2>,4|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]CO)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6,6]C[6])	118.5644	0.270	5	118.4933	0.088	6	118.8748	2.767	83	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H){1|B<3>,2|C<4>,5|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H){2|H<1>,3|C<4>}	H(C[6]C[6,6]C[6])	118.0840	0.000	1	118.9309	3.100	17	118.8748	2.767	83	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H){1|C<3>,2|C<4>,4|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H){1|C<3>,1|H<1>,3|C<4>}	H(C[6]C[6,6]C[6])	117.8680	0.000	1	118.9309	3.100	17	118.8748	2.767	83	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H){1|C<3>,2|C<4>,5|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H){1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6,6]C[6])	121.2210	0.000	1	118.9309	3.100	17	118.8748	2.767	83	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H){1|C<3>,2|C<4>,5|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H){1|C<3>,1|H<1>,3|C<4>}	H(C[6]C[6,6]C[6])	119.7350	0.000	1	118.9309	3.100	17	118.8748	2.767	83	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H){1|C<3>,2|C<4>,5|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6,6]C[6])	118.0595	1.191	4	118.9309	3.100	17	118.8748	2.767	83	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H){1|C<3>,2|C<4>,5|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H){2|C<4>,3|H<1>}	H(C[6]C[6,6]C[6])	124.3610	0.000	1	118.9309	3.100	17	118.8748	2.767	83	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H){1|C<3>,3|C<4>,4|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H){2|C<4>,3|H<1>}	H(C[6]C[6,6]C[6])	118.8660	0.000	1	118.9309	3.100	17	118.8748	2.767	83	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H){2|C<3>,2|C<4>,4|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6,6]C[6])	120.2600	0.000	1	118.9309	3.100	17	118.8748	2.767	83	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H){3|C<4>,5|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H){2|C<4>,3|H<1>}	H(C[6]C[6,6]C[6])	118.1105	0.145	2	118.9309	3.100	17	118.8748	2.767	83	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H){4|C<4>,4|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H){2|C<4>,3|H<1>}	H(C[6]C[6,6]C[6])	118.2430	0.136	4	118.9309	3.100	17	118.8748	2.767	83	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]HO)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H){1|C<4>,2|C<3>,2|O<2>,3|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]HO)(H){1|O<2>,2|C<4>,2|H<1>}	H(C[6]C[6,6]C[6])	118.8580	0.000	1	118.8580	0.000	1	118.8748	2.767	83	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]O[6]HH)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H){1|C<4>,1|O<2>,1|S<4>,2|C<3>,3|H<1>}	C[6](C[6]C[6,6]H)(C[6]O[6]HH)(H){1|H<1>,2|C<4>}	H(C[6]C[6,6]C[6])	119.1770	0.000	1	119.1770	0.000	1	118.8748	2.767	83	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]O)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]HO)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]O)(C[6]C[6]H)(H){1|C<3>,1|C<4>,2|O<2>,4|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]HO)(H){1|O<2>,2|C<4>,2|H<1>}	H(C[6]C[6,6]C[6])	126.8610	0.000	1	126.8610	0.000	1	118.8748	2.767	83	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]N[6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]N[6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>,1|S<4>,3|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H){1|C<4>,1|N<3>,3|H<1>}	H(C[6]C[6,6]C[6])	118.1913	0.162	3	118.3960	0.185	4	118.8748	2.767	83	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]N[6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]N[6]H)(C[6]C[6]H)(H){1|C<3>,3|C<4>,3|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H){1|C<4>,1|N<3>,1|O<2>,2|H<1>}	H(C[6]C[6,6]C[6])	119.0100	0.000	1	118.3960	0.185	4	118.8748	2.767	83	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]O[6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]CH)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]O[6]H)(C[6]C[6]H)(H){1|H<1>,2|C<3>,3|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]CH)(H){1|C<4>,1|O<1>,1|O<2>,2|H<1>}	H(C[6]C[6,6]C[6])	117.9930	0.000	1	117.9930	0.000	1	118.8748	2.767	83	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]O[6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]O[6]CH)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]O[6]H)(C[6]C[6]H)(H){1|C<2>,1|O<2>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6]H)(C[6]O[6]CH)(H){1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[6,6]C[6])	119.2850	0.000	1	119.5536	0.099	5	118.8748	2.767	83	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]O[6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]O[6]CH)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]O[6]H)(C[6]C[6]H)(H){1|C<4>,1|O<2>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6]H)(C[6]O[6]CH)(H){1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[6,6]C[6])	119.4310	0.000	1	119.5536	0.099	5	118.8748	2.767	83	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]O[6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]O[6]CH)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]O[6]H)(C[6]C[6]H)(H){1|O<2>,2|H<1>,3|C<3>}	C[6](C[6]C[6,6]H)(C[6]O[6]CH)(H){1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[6,6]C[6])	119.4760	0.000	1	119.5536	0.099	5	118.8748	2.767	83	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]O[6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]O[6]CH)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]O[6]H)(C[6]C[6]H)(H){1|O<2>,2|H<1>,3|C<4>}	C[6](C[6]C[6,6]H)(C[6]O[6]CH)(H){1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[6,6]C[6])	120.0980	0.000	1	119.5536	0.099	5	118.8748	2.767	83	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]O[6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]O[6]CH)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]O[6]H)(C[6]C[6]H)(H){1|Si<4>,1|O<2>,2|C<4>,2|H<1>}	C[6](C[6]C[6,6]H)(C[6]O[6]CH)(H){1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[6,6]C[6])	119.4780	0.000	1	119.5536	0.099	5	118.8748	2.767	83	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]O[6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]O[6]HH)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]O[6]H)(C[6]C[6]H)(H){1|O<2>,2|C<4>,3|H<1>}	C[6](C[6]C[6,6]H)(C[6]O[6]HH)(H){1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[6,6]C[6])	120.0380	0.000	1	120.0380	0.000	1	118.8748	2.767	83	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6]C[6,6a]C[6,6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]HO)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]C[6,6]C)(C[6]C[6]H)(H){1|C<4>,1|N<3>,1|O<2>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]HO)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6,6]C[6])	117.9700	0.000	1	117.9700	0.000	1	118.8748	2.767	83	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6]C[6,6a]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]C[6,6]H)(C[6]C[6]H)(H){1|C<4>,3|C<3>,3|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H){1|C<3>,1|C<4>,3|H<1>}	H(C[6]C[6,6]C[6])	118.0930	0.000	1	118.7148	1.184	9	118.8748	2.767	83	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6]C[6,6a]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]C[6,6]H)(C[6]C[6]H)(H){1|C<4>,3|C<3>,3|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6,6]C[6])	119.6610	0.095	2	118.7148	1.184	9	118.8748	2.767	83	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6]C[6,6a]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]C[6,6]H)(C[6]C[6]H)(H){1|C<4>,3|C<3>,3|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H){1|C<4>,2|C<3>,2|H<1>}	H(C[6]C[6,6]C[6])	118.9958	1.157	4	118.7148	1.184	9	118.8748	2.767	83	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6]C[6,6a]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]C[6,6]H)(C[6]C[6]H)(H){2|C<3>,2|C<4>,3|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H){1|C<3>,1|C<4>,3|H<1>}	H(C[6]C[6,6]C[6])	117.5175	0.301	2	118.7148	1.184	9	118.8748	2.767	83	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6]C[6]3)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]CO)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6]3)(C[6]C[6]H)(H){1|C<3>,1|O<2>,2|H<1>,6|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]CO)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6,6]C[6])	117.5160	0.481	2	117.5160	0.231	2	118.8748	2.767	83	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6]C[6]O[6]2)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]CH)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6]O[6]2)(C[6]C[6]H)(H){3|H<1>,4|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]CH)(H){1|H<1>,2|C<4>,2|O<2>}	H(C[6]C[6,6]C[6])	118.8673	0.231	3	118.8673	0.054	3	118.8748	2.767	83	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6]C[6]O[6]2)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6]O[6]2)(C[6]C[6]H)(H){1|O<2>,3|C<4>,3|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H){1|H<1>,2|C<4>,2|O<2>}	H(C[6]C[6,6]C[6])	118.5820	0.000	1	118.5820	0.000	1	118.8748	2.767	83	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:H-1:	C[6]-3:	C[6](C[6,6]N[6,6]C[6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6]H)(C[6]C[6]H)(H){2|C<3>,2|C<4>,3|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(H){1|C<4>,1|H<1>,1|N<3>,1|O<1>}	H(C[6]C[6,6]C[6])	124.8020	0.000	1	124.8020	0.000	1	118.8748	2.767	83	119.1073	2.451	234	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:2:	3:	C[3x6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:O-2:	C[6]-3:	C[6](C[3x6]C[3x6]C[6,6]H)(C[6]C[6]O)(H)	C[6](C[6]C[3x6]H)(C[6]C[6]HO)(OC)	H(C[6]C[3x6]C[6])	C[6](C[3x6]C[3x6]C[6,6]H)(C[6]C[6]O)(H){1|C<3>,1|N<3>,1|O<2>,2|H<1>,3|C<4>}	C[6](C[6]C[3x6]H)(C[6]C[6]HO)(OC){2|C<4>,3|H<1>}	H(C[6]C[3x6]C[6])	118.4300	0.000	1	118.4300	0.000	1	118.4300	0.000	1	118.3146	0.515	5	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:2:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:O-2:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]C)(C[6]C[6]O)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(OC)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]C)(C[6]C[6]O)(H){1|N<3>,2|C<3>,2|C<4>,3|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(OC){2|H<1>,3|C<4>}	H(C[6]C[5,6]C[6])	117.2590	0.000	1	117.2590	0.000	1	117.2590	0.000	1	118.3146	0.515	5	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:2:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:O-2:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(OC)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]O)(H){2|C<3>,2|C<4>,3|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(OC){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6,6]C[6])	118.1090	0.000	1	118.1090	0.000	1	118.1090	0.000	1	118.3146	0.515	5	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:2:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C-4:O[6]-2:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]O[6]C)(H)	C[6](C[6]C[6]H)(CC[6a]CH)(O[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]O[6]C)(H){1|C<3>,2|H<1>}	C[6](C[6]C[6]H)(CC[6a]CH)(O[6]C[6]){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.2280	0.000	1	118.8875	0.232	2	118.8875	0.232	2	118.3146	0.515	5	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:2:	3:	C[6]-4:C[6]-3:H-1:	C[6]-3:C-4:O[6]-2:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]O[6]C)(H)	C[6](C[6]C[6]H)(CC[6a]CH)(O[6]C[6])	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]O[6]C)(H){1|C<4>,2|H<1>}	C[6](C[6]C[6]H)(CC[6a]CH)(O[6]C[6]){1|C<4>,4|H<1>}	H(C[6]C[6]2)	118.5470	0.000	1	118.8875	0.232	2	118.8875	0.232	2	118.3146	0.515	5	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:3:	3:	C[3,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:C-3:	C[6]-3:	C[6](C[3,6]C[3,6]O[3]H)(C[6]C[6]C)(H)	C[6](C[6]C[3,6]H)(C[6]C[6]HO)(COO)	H(C[6]C[3,6]C[6])	C[6](C[3,6]C[3,6]O[3]H)(C[6]C[6]C)(H){1|C<4>,1|O<2>,2|H<1>}	C[6](C[6]C[3,6]H)(C[6]C[6]HO)(COO){1|C<4>,2|H<1>,2|O<2>}	H(C[6]C[3,6]C[6])	119.4840	0.000	1	119.4840	0.000	1	119.4840	0.000	1	118.0092	1.763	25	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:3:	3:	C[4,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:C-3:	C[6]-3:	C[6](C[4,6]C[4,6]C[4]H)(C[6]C[6]C)(H)	C[6](C[6]C[4,6]H)(C[6]C[6]HH)(COO)	H(C[6]C[4,6]C[6])	C[6](C[4,6]C[4,6]C[4]H)(C[6]C[6]C)(H){1|C<4>,2|C<3>,3|H<1>}	C[6](C[6]C[4,6]H)(C[6]C[6]HH)(COO){1|C<3>,1|C<4>,3|H<1>}	H(C[6]C[4,6]C[6])	120.4120	0.000	1	120.4120	0.000	1	120.4120	0.000	1	118.0092	1.763	25	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:3:	3:	C[5,5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:N-3:	C[6]-3:	C[6](C[5,5,6]C[5,6]N[5,5]C[5])(C[6]C[6]N)(H)	C[6](C[6]C[5,5,6]H)(C[6]C[6]CH)(NOO)	H(C[6]C[5,5,6]C[6])	C[6](C[5,5,6]C[5,6]N[5,5]C[5])(C[6]C[6]N)(H){2|C<4>,2|H<1>,4|C<3>}	C[6](C[6]C[5,5,6]H)(C[6]C[6]CH)(NOO){1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[5,5,6]C[6])	120.8050	0.000	1	120.8050	0.000	1	120.8050	0.000	1	118.0092	1.763	25	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:3:	3:	C[5,6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:C-3:	C[6]-3:	C[6](C[5,6,6]C[5a,6]C[5,6]N[5,6])(C[6]C[6]C)(H)	C[6](C[6]C[5,6,6]H)(C[6]C[5,6]HH)(CCO)	H(C[6]C[5,6,6]C[6])	C[6](C[5,6,6]C[5a,6]C[5,6]N[5,6])(C[6]C[6]C)(H){1|C<3>,1|N<3>,3|C<4>,4|H<1>}	C[6](C[6]C[5,6,6]H)(C[6]C[5,6]HH)(CCO){1|C<3>,1|H<1>,1|N<3>,2|C<4>}	H(C[6]C[5,6,6]C[6])	118.9700	0.000	1	118.9700	0.000	1	118.9700	0.000	1	118.0092	1.763	25	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:3:	3:	C[5,6]-4:C[6]-3:H-1:	C[5a]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[5,6]N[5,6]C[5]H)(C[6]C[5a]C[6])(H)	C[6](C[5a]C[5a]S[5a])(C[6]C[5,6]HH)(C[6]C[5,6]H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]C[5]H)(C[6]C[5a]C[6])(H){1|C<3>,1|S<2>,2|C<4>,6|H<1>}	C[6](C[5a]C[5a]S[5a])(C[6]C[5,6]HH)(C[6]C[5,6]H){1|N<4>,2|C<3>,2|C<4>,3|H<1>}	H(C[6]C[5,6]C[6])	120.0610	0.000	1	120.0610	0.000	1	120.0610	0.000	1	118.0092	1.763	25	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:3:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:C-3:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]C)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(COO)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]C)(H){1|N<3>,2|C<4>,5|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(COO){1|O<2>,2|C<4>,2|H<1>}	H(C[6]C[5,6]C[6])	118.2260	0.000	1	118.2260	0.000	1	117.8013	0.171	3	118.0092	1.763	25	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:3:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:C-3:	C[6]-3:	C[6](C[5,6]C[5,6]O[5]H)(C[6]C[6]C)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]HO)(COO)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]O[5]H)(C[6]C[6]C)(H){2|C<4>,2|H<1>,2|O<2>}	C[6](C[6]C[5,6]H)(C[6]C[6]HO)(COO){1|C<4>,2|H<1>,2|O<2>}	H(C[6]C[5,6]C[6])	117.5890	0.269	2	117.5890	0.072	2	117.8013	0.171	3	118.0092	1.763	25	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:3:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:C-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(CCO)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]C)(H){1|C<3>,3|C<4>,3|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(CCO){1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6,6]C[6])	116.7840	0.000	1	116.7840	0.000	1	117.7824	0.323	7	118.0092	1.763	25	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:3:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:C-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(CHO)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]C)(H){1|O<2>,2|C<4>,5|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(CHO){2|C<4>,3|H<1>}	H(C[6]C[6,6]C[6])	118.2340	0.000	1	118.2340	0.000	1	117.7824	0.323	7	118.0092	1.763	25	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:3:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:C-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(COO)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]C)(H){1|C<3>,3|C<4>,4|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(COO){2|C<4>,3|H<1>}	H(C[6]C[6,6]C[6])	117.8918	0.412	5	117.8918	0.170	5	117.7824	0.323	7	118.0092	1.763	25	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:3:	3:	C[6]-4:C[6]-3:H-1:	C[6a]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6]H)(C[6]C[6a]C[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]CC)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]H)(C[6]C[6a]C[6])(H){1|C<4>,1|H<1>,2|C<2>,5|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]CC)(C[6]C[6]H){1|C<4>,4|C<3>,4|H<1>}	H(C[6]C[6]2)	116.4720	0.000	1	116.4720	0.000	1	117.2616	1.451	10	118.0092	1.763	25	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:3:	3:	C[6]-4:C[6]-3:H-1:	C[6a]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6]H)(C[6]C[6a]C[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]CH)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]H)(C[6]C[6a]C[6])(H){1|H<1>,2|C<4>,6|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]CH)(C[6]C[6]H){1|C<4>,3|C<3>,5|H<1>}	H(C[6]C[6]2)	117.0570	0.000	1	117.0570	0.000	1	117.2616	1.451	10	118.0092	1.763	25	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:3:	3:	C[6]-4:C[6]-3:H-1:	C[6a]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6]H)(C[6]C[6a]C[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]HO)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]H)(C[6]C[6a]C[6])(H){1|C<4>,1|H<1>,1|O<2>,6|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]HO)(C[6]C[6]H){1|C<4>,3|C<3>,5|H<1>}	H(C[6]C[6]2)	116.4165	0.237	2	116.4165	0.056	2	117.2616	1.451	10	118.0092	1.763	25	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:3:	3:	C[6]-4:C[6]-3:H-1:	C[6a]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6]O)(C[6]C[6a]C[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]CH)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]O)(C[6]C[6a]C[6])(H){1|H<1>,2|C<2>,2|C<4>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]CH)(C[6]C[6]H){1|C<4>,1|O<2>,2|C<2>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.0200	0.000	1	120.0200	0.000	1	117.2616	1.451	10	118.0092	1.763	25	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:3:	3:	C[6]-4:C[6]-3:H-1:	C[6a]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6]O)(C[6]C[6a]C[6])(H)	C[6](C[6a]C[6a]2)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]O)(C[6]C[6a]C[6])(H){1|C<4>,3|H<1>,5|C<3>}	C[6](C[6a]C[6a]2)(C[6]C[6]HH)(C[6]C[6]H){1|O<2>,2|C<4>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	117.1825	0.644	2	117.1825	0.415	2	117.2616	1.451	10	118.0092	1.763	25	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:3:	3:	C[6]-4:C[6]-3:H-1:	C[6a]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]C[6]Pt)(C[6]C[6a]C[6])(H)	C[6](C[6a]C[6,6a]C[6a])(C[6]C[6a]C[6]Pt)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]Pt)(C[6]C[6a]C[6])(H){1|Pt<6>,7|C<3>}	C[6](C[6a]C[6,6a]C[6a])(C[6]C[6a]C[6]Pt)(C[6]C[6]H){1|Pt<6>,1|N<3>,2|H<1>,6|C<3>}	H(C[6]C[6]2)	116.6045	0.224	2	116.6045	0.050	2	117.2616	1.451	10	118.0092	1.763	25	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:3:	3:	C[6]-4:C[6]-3:H-1:	C[6a]-3:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6a]O[6]H)(C[6]C[6a]C[6])(H)	C[6](C[6a]C[6a]2)(C[6]N[6]CH)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6a]O[6]H)(C[6]C[6a]C[6])(H){1|C<4>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6a]C[6a]2)(C[6]N[6]CH)(C[6]C[6]H){1|O<2>,3|H<1>,4|C<3>}	H(C[6]C[6]2)	118.6600	0.000	1	118.6600	0.000	1	117.2616	1.451	10	118.0092	1.763	25	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:4:	3:	C[4,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:C-4:	C[6]-3:	C[6](C[4,6]C[4,5,5]C[4,6]H)(C[6]C[6]C)(H)	C[6](C[6]C[4,6]H)(C[6]C[6]HH)(CHHO)	H(C[6]C[4,6]C[6])	C[6](C[4,6]C[4,5,5]C[4,6]H)(C[6]C[6]C)(H){1|C<3>,3|C<4>,3|H<1>}	C[6](C[6]C[4,6]H)(C[6]C[6]HH)(CHHO){1|O<2>,2|C<4>,2|H<1>}	H(C[6]C[4,6]C[6])	118.6220	0.000	1	118.6220	0.000	1	119.7110	2.552	3	117.9572	0.875	64	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:4:	3:	C[4,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:C-4:	C[6]-3:	C[6](C[4,6]C[4,6]C[4]H)(C[6]C[6]C)(H)	C[6](C[6]C[4,6]H)(C[6]C[6]HO)(CH3)	H(C[6]C[4,6]C[6])	C[6](C[4,6]C[4,6]C[4]H)(C[6]C[6]C)(H){1|O<1>,1|O<2>,2|C<4>,2|H<1>}	C[6](C[6]C[4,6]H)(C[6]C[6]HO)(CH3){1|C<3>,1|C<4>,1|O<2>,2|H<1>}	H(C[6]C[4,6]C[6])	120.2555	1.824	2	120.2555	3.326	2	119.7110	2.552	3	117.9572	0.875	64	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:4:	3:	C[5,5,6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:C-4:	C[6]-3:	C[6](C[5,5,6,6]C[5,6,6]O[5,5]O[5,6])(C[6]C[6]C)(H)	C[6](C[6]C[5,5,6,6]H)(C[6]C[6]HH)(CH3)	H(C[6]C[5,5,6,6]C[6])	C[6](C[5,5,6,6]C[5,6,6]O[5,5]O[5,6])(C[6]C[6]C)(H){2|H<1>,5|C<4>}	C[6](C[6]C[5,5,6,6]H)(C[6]C[6]HH)(CH3){1|C<4>,2|H<1>,2|O<2>}	H(C[6]C[5,5,6,6]C[6])	118.6690	0.000	1	118.6690	0.000	1	118.8730	0.083	2	117.9572	0.875	64	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:4:	3:	C[5,5,6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:C-4:	C[6]-3:	C[6](C[5,5,6,6]C[5,6,6]O[5,5]O[5,6])(C[6]C[6]C)(H)	C[6](C[6]C[5,5,6,6]H)(C[6]C[6]HH)(CHHO)	H(C[6]C[5,5,6,6]C[6])	C[6](C[5,5,6,6]C[5,6,6]O[5,5]O[5,6])(C[6]C[6]C)(H){2|H<1>,5|C<4>}	C[6](C[6]C[5,5,6,6]H)(C[6]C[6]HH)(CHHO){1|C<4>,2|H<1>,2|O<2>}	H(C[6]C[5,5,6,6]C[6])	119.0770	0.000	1	119.0770	0.000	1	118.8730	0.083	2	117.9572	0.875	64	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:4:	3:	C[5,5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:C-4:	C[6]-3:	C[6](C[5,5,6]C[5,5,6]C[5]2)(C[6]C[6]C)(H)	C[6](C[6]C[5,5,6]H)(C[6]C[5,6]HH)(CH3)	H(C[6]C[5,5,6]C[6])	C[6](C[5,5,6]C[5,5,6]C[5]2)(C[6]C[6]C)(H){1|C<4>,2|C<3>,2|O<2>,6|H<1>}	C[6](C[6]C[5,5,6]H)(C[6]C[5,6]HH)(CH3){2|O<2>,3|C<4>}	H(C[6]C[5,5,6]C[6])	120.2580	0.000	1	120.2580	0.000	1	120.2580	0.000	1	117.9572	0.875	64	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:4:	3:	C[5,6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:C-4:	C[6]-3:	C[6](C[5,6,6]C[5,5,6]O[5,6]C[6])(C[6]C[6]C)(H)	C[6](C[6]C[5,6,6]H)(C[6]C[5,6]HH)(CH3)	H(C[6]C[5,6,6]C[6])	C[6](C[5,6,6]C[5,5,6]O[5,6]C[6])(C[6]C[6]C)(H){2|C<3>,3|C<4>,3|H<1>}	C[6](C[6]C[5,6,6]H)(C[6]C[5,6]HH)(CH3){1|C<3>,1|H<1>,1|O<2>,2|C<4>}	H(C[6]C[5,6,6]C[6])	119.1540	0.000	1	119.1540	0.000	1	117.9444	0.399	7	117.9572	0.875	64	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:4:	3:	C[5,6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:C-4:	C[6]-3:	C[6](C[5,6,6]C[5,5,6]O[5,6]C[6])(C[6]C[6]C)(H)	C[6](C[6]C[5,6,6]H)(C[6]C[6]HH)(CH3)	H(C[6]C[5,6,6]C[6])	C[6](C[5,6,6]C[5,5,6]O[5,6]C[6])(C[6]C[6]C)(H){2|C<3>,3|C<4>,3|H<1>}	C[6](C[6]C[5,6,6]H)(C[6]C[6]HH)(CH3){1|C<3>,1|C<4>,1|O<2>,2|H<1>}	H(C[6]C[5,6,6]C[6])	117.6160	0.240	3	117.6160	0.058	3	117.9444	0.399	7	117.9572	0.875	64	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:4:	3:	C[5,6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:C-4:	C[6]-3:	C[6](C[5,6,6]C[5,6,6]C[6]O[5])(C[6]C[6]C)(H)	C[6](C[6]C[5,6,6]H)(C[6]C[6]HH)(CCCH)	H(C[6]C[5,6,6]C[6])	C[6](C[5,6,6]C[5,6,6]C[6]O[5])(C[6]C[6]C)(H){1|C<3>,2|O<2>,3|C<4>,3|H<1>}	C[6](C[6]C[5,6,6]H)(C[6]C[6]HH)(CCCH){1|O<2>,2|C<4>,2|H<1>}	H(C[6]C[5,6,6]C[6])	118.3270	0.000	1	118.1260	0.081	2	117.9444	0.399	7	117.9572	0.875	64	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:4:	3:	C[5,6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:C-4:	C[6]-3:	C[6](C[5,6,6]C[5,6,6]C[6]O[5])(C[6]C[6]C)(H)	C[6](C[6]C[5,6,6]H)(C[6]C[6]HH)(CCCH)	H(C[6]C[5,6,6]C[6])	C[6](C[5,6,6]C[5,6,6]C[6]O[5])(C[6]C[6]C)(H){1|C<3>,3|C<4>,5|H<1>}	C[6](C[6]C[5,6,6]H)(C[6]C[6]HH)(CCCH){1|O<2>,2|C<4>,2|H<1>}	H(C[6]C[5,6,6]C[6])	117.9250	0.000	1	118.1260	0.081	2	117.9444	0.399	7	117.9572	0.875	64	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:4:	3:	C[5,6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:C-4:	C[6]-3:	C[6](C[5,6,6]C[5,6]C[6,6]O[5])(C[6]C[6]C)(H)	C[6](C[6]C[5,6,6]H)(C[6]C[6]HH)(CCCH)	H(C[6]C[5,6,6]C[6])	C[6](C[5,6,6]C[5,6]C[6,6]O[5])(C[6]C[6]C)(H){2|C<3>,3|C<4>,4|H<1>}	C[6](C[6]C[5,6,6]H)(C[6]C[6]HH)(CCCH){1|O<2>,2|C<4>,2|H<1>}	H(C[6]C[5,6,6]C[6])	117.3570	0.000	1	117.3570	0.000	1	117.9444	0.399	7	117.9572	0.875	64	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:4:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:C-4:	C[6]-3:	C[6](C[5,6]C[3x5]C[5,6]H)(C[6]C[6]C)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(CH3)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[3x5]C[5,6]H)(C[6]C[6]C)(H){1|N<3>,1|O<2>,3|C<4>,3|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(CH3){1|H<1>,4|C<4>}	H(C[6]C[5,6]C[6])	117.5405	0.312	2	117.9346	0.349	5	118.0072	0.670	12	117.9572	0.875	64	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:4:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:C-4:	C[6]-3:	C[6](C[5,6]C[3x5]C[5,6]H)(C[6]C[6]C)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(CH3)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[3x5]C[5,6]H)(C[6]C[6]C)(H){2|N<3>,3|C<4>,3|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(CH3){1|H<1>,4|C<4>}	H(C[6]C[5,6]C[6])	118.1973	0.625	3	117.9346	0.349	5	118.0072	0.670	12	117.9572	0.875	64	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:4:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:C-4:	C[6]-3:	C[6](C[5,6]C[5,5]C[5,6]H)(C[6]C[6]C)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(CH3)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,5]C[5,6]H)(C[6]C[6]C)(H){1|N<3>,1|O<2>,3|C<4>,3|H<1>}	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(CH3){1|H<1>,4|C<4>}	H(C[6]C[5,6]C[6])	118.5880	0.000	1	118.5880	0.000	1	118.0072	0.670	12	117.9572	0.875	64	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:4:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:C-4:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]C)(C[6]C[6]C)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]CH)(CH3)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]C)(C[6]C[6]C)(H){1|H<1>,1|O<1>,4|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]CH)(CH3){2|C<3>,2|C<4>}	H(C[6]C[5,6]C[6])	119.0330	0.000	1	119.0330	0.000	1	118.0072	0.670	12	117.9572	0.875	64	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:4:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:C-4:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]C)(C[6]C[6]C)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(CCCO)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]C)(C[6]C[6]C)(H){1|O<2>,3|H<1>,4|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(CCCO){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[5,6]C[6])	116.7680	0.000	1	116.7680	0.000	1	118.0072	0.670	12	117.9572	0.875	64	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:4:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:C-4:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]C)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]CH)(CH3)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]C)(H){1|O<2>,3|H<1>,4|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]CH)(CH3){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[5,6]C[6])	119.1110	0.000	1	119.1110	0.000	1	118.0072	0.670	12	117.9572	0.875	64	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:4:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:C-4:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]C)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]HO)(CH3)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]C)(H){1|H<1>,1|O<2>,2|C<4>,3|C<3>}	C[6](C[6]C[5,6]H)(C[6]C[6]HO)(CH3){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[5,6]C[6])	116.9010	0.000	1	116.9010	0.000	1	118.0072	0.670	12	117.9572	0.875	64	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:4:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:C-4:	C[6]-3:	C[6](C[5,6]C[5,6]O[5]H)(C[6]C[6]C)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(CH3)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]O[5]H)(C[6]C[6]C)(H){2|H<1>,4|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]HH)(CH3){1|C<4>,1|O<2>,3|H<1>}	H(C[6]C[5,6]C[6])	118.5440	0.000	1	118.5440	0.000	1	118.0072	0.670	12	117.9572	0.875	64	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:4:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:C-4:	C[6]-3:	C[6](C[5,6]C[6]O[5]2)(C[6]C[6]C)(H)	C[6](C[6]C[5,6]H)(C[6]C[6]CO)(CH3)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[6]O[5]2)(C[6]C[6]C)(H){1|C<2>,1|O<2>,2|H<1>,3|C<4>}	C[6](C[6]C[5,6]H)(C[6]C[6]CO)(CH3){2|O<2>,3|C<4>}	H(C[6]C[5,6]C[6])	117.4680	0.000	1	117.4680	0.000	1	118.0072	0.670	12	117.9572	0.875	64	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:4:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:C-4:	C[6]-3:	C[6](C[6,6]C[5,6,6]C[6]C)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]CH)(CH3)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6,6]C[6]C)(C[6]C[6]C)(H){1|C<3>,1|O<2>,3|C<4>,3|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]CH)(CH3){2|H<1>,3|C<4>}	H(C[6]C[6,6]C[6])	117.0530	0.000	1	117.0530	0.000	1	117.7032	0.564	39	117.9572	0.875	64	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:4:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:C-4:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]CH)(CH3)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]C)(H){1|C<3>,1|O<2>,3|C<4>,3|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]CH)(CH3){1|C<3>,1|H<1>,3|C<4>}	H(C[6]C[6,6]C[6])	117.2050	0.000	1	117.1970	0.199	3	117.7032	0.564	39	117.9572	0.875	64	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:4:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:C-4:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]CH)(CH3)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]C)(H){1|H<1>,1|O<1>,1|O<2>,3|C<3>}	C[6](C[6]C[6,6]H)(C[6]C[6]CH)(CH3){2|C<3>,2|C<4>}	H(C[6]C[6,6]C[6])	117.6390	0.000	1	117.1970	0.199	3	117.7032	0.564	39	117.9572	0.875	64	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:4:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:C-4:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]CH)(CH3)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]C)(H){4|C<4>,4|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]CH)(CH3){1|C<3>,1|H<1>,3|C<4>}	H(C[6]C[6,6]C[6])	116.7470	0.000	1	117.1970	0.199	3	117.7032	0.564	39	117.9572	0.875	64	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:4:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:C-4:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(CH3)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]C)(H){3|C<4>,5|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(CH3){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6,6]C[6])	117.1250	0.099	2	117.1250	0.010	2	117.7032	0.564	39	117.9572	0.875	64	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:4:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:C-4:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]CH)(CH3)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]C)(H){1|C<3>,3|C<4>,4|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]CH)(CH3){2|C<4>,3|H<1>}	H(C[6]C[6,6]C[6])	116.7680	0.007	2	116.7680	0.000	2	117.7032	0.564	39	117.9572	0.875	64	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:4:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:C-4:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(CC[6]HH)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]C)(H){4|C<4>,4|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(CC[6]HH){2|C<4>,3|H<1>}	H(C[6]C[6,6]C[6])	117.4030	0.000	1	117.4030	0.000	1	117.7032	0.564	39	117.9572	0.875	64	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:4:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:C-4:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(CH3)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]C)(H){1|C<2>,1|C<3>,2|C<4>,4|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(CH3){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6,6]C[6])	117.6970	0.000	1	117.6253	0.080	7	117.7032	0.564	39	117.9572	0.875	64	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:4:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:C-4:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(CH3)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]C)(H){1|C<3>,1|C<4>,1|S<4>,4|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(CH3){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6,6]C[6])	117.4070	0.000	1	117.6253	0.080	7	117.7032	0.564	39	117.9572	0.875	64	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:4:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:C-4:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(CH3)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]C)(H){1|C<3>,1|O<2>,1|S<2>,2|C<4>,2|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(CH3){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6,6]C[6])	117.1510	0.000	1	117.6253	0.080	7	117.7032	0.564	39	117.9572	0.875	64	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:4:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:C-4:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(CH3)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]C)(H){1|O<2>,3|H<1>,4|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(CH3){2|C<4>,3|H<1>}	H(C[6]C[6,6]C[6])	118.0480	0.000	1	117.6253	0.080	7	117.7032	0.564	39	117.9572	0.875	64	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:4:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:C-4:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(CH3)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]C)(H){3|C<4>,5|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(CH3){2|C<4>,3|H<1>}	H(C[6]C[6,6]C[6])	117.6530	0.040	2	117.6253	0.080	7	117.7032	0.564	39	117.9572	0.875	64	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:4:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:C-4:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(CH3)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]C)(H){4|C<4>,4|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(CH3){2|C<4>,3|H<1>}	H(C[6]C[6,6]C[6])	117.7680	0.000	1	117.6253	0.080	7	117.7032	0.564	39	117.9572	0.875	64	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:4:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:C-4:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]HO)(CH3)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]C)(H){1|C<3>,2|H<1>,2|O<2>,3|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]HO)(CH3){1|O<2>,2|C<4>,2|H<1>}	H(C[6]C[6,6]C[6])	117.5680	0.000	1	117.5670	0.000	2	117.7032	0.564	39	117.9572	0.875	64	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:4:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:C-4:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]HO)(CH3)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]C)(H){1|O<2>,3|H<1>,4|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]HO)(CH3){2|C<4>,3|H<1>}	H(C[6]C[6,6]C[6])	117.5660	0.000	1	117.5670	0.000	2	117.7032	0.564	39	117.9572	0.875	64	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:4:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:C-4:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]O)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(CCCH)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]O)(C[6]C[6]C)(H){1|O<1>,3|C<4>,3|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(CCCH){1|C<3>,1|C<4>,1|O<2>,2|H<1>}	H(C[6]C[6,6]C[6])	117.4775	0.199	2	117.4775	0.039	2	117.7032	0.564	39	117.9572	0.875	64	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:4:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:C-4:	C[6]-3:	C[6](C[6,6]C[6,6]N[6]H)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(CH3)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]N[6]H)(C[6]C[6]C)(H){1|S<4>,3|C<4>,3|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(CH3){1|C<4>,1|N<3>,3|H<1>}	H(C[6]C[6,6]C[6])	117.6850	0.000	1	117.6850	0.000	1	117.7032	0.564	39	117.9572	0.875	64	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:4:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:C-4:	C[6]-3:	C[6](C[6,6]C[6,6]O[6]H)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(CH3)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]O[6]H)(C[6]C[6]C)(H){2|H<1>,4|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(CH3){1|C<4>,1|O<2>,3|H<1>}	H(C[6]C[6,6]C[6])	117.7513	0.324	6	117.7513	0.105	6	117.7032	0.564	39	117.9572	0.875	64	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:4:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:C-4:	C[6]-3:	C[6](C[6,6]C[6,6]O[6]H)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(CHHO)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]O[6]H)(C[6]C[6]C)(H){2|H<1>,4|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(CHHO){1|C<4>,1|O<2>,3|H<1>}	H(C[6]C[6,6]C[6])	117.7110	0.000	1	117.7110	0.000	1	117.7032	0.564	39	117.9572	0.875	64	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:4:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:C-4:	C[6]-3:	C[6](C[6,6]C[6,6]O[6]H)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]HO)(CH3)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]O[6]H)(C[6]C[6]C)(H){1|H<1>,1|O<2>,4|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]HO)(CH3){1|C<4>,2|H<1>,2|O<2>}	H(C[6]C[6,6]C[6])	117.9430	0.000	1	117.8910	0.061	3	117.7032	0.564	39	117.9572	0.875	64	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:4:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:C-4:	C[6]-3:	C[6](C[6,6]C[6,6]O[6]H)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]HO)(CH3)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]O[6]H)(C[6]C[6]C)(H){1|O<2>,2|H<1>,3|C<4>}	C[6](C[6]C[6,6]H)(C[6]C[6]HO)(CH3){1|C<4>,1|O<2>,3|H<1>}	H(C[6]C[6,6]C[6])	117.8650	0.344	2	117.8910	0.061	3	117.7032	0.564	39	117.9572	0.875	64	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:4:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:C-4:	C[6]-3:	C[6](C[6,6]C[6,6]O[6]H)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]HO)(CHHO)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]O[6]H)(C[6]C[6]C)(H){1|C<3>,1|O<2>,2|C<4>,2|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]HO)(CHHO){1|C<4>,2|H<1>,2|O<2>}	H(C[6]C[6,6]C[6])	120.5750	0.000	1	120.5750	0.000	1	117.7032	0.564	39	117.9572	0.875	64	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:4:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:C-4:	C[6]-3:	C[6](C[6,6]C[6,6a]C[6,6]H)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(CH3)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]C[6,6]H)(C[6]C[6]C)(H){2|C<3>,2|C<4>,3|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(CH3){1|C<3>,1|C<4>,3|H<1>}	H(C[6]C[6,6]C[6])	117.8930	1.655	3	117.8930	2.739	3	117.7032	0.564	39	117.9572	0.875	64	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:4:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:C-4:	C[6]-3:	C[6](C[6,6]C[6,6a]C[6,6]H)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]H)(C[6]N[6]HH)(CH3)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]C[6,6]H)(C[6]C[6]C)(H){1|C<4>,1|N<3>,2|C<3>,3|H<1>}	C[6](C[6]C[6,6]H)(C[6]N[6]HH)(CH3){1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6,6]C[6])	118.5177	0.089	3	118.5177	0.008	3	117.7032	0.564	39	117.9572	0.875	64	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	3:4:4:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:C[6]-4:C-4:	C[6]-3:	C[6](C[6,6]C[6]2O[6])(C[6]C[6]C)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(CH3)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6]2O[6])(C[6]C[6]C)(H){1|C<3>,3|C<4>,5|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]HH)(CH3){1|O<2>,2|C<4>,2|H<1>}	H(C[6]C[6,6]C[6])	117.7410	0.000	1	117.7410	0.000	1	117.7032	0.564	39	117.9572	0.875	64	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	B[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](B[6]C[6]N[5]2)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]B[6]H)(H)	H(C[6]B[6]C[6])	C[6](B[6]C[6]N[5]2)(C[6]C[6]H)(H){1|Si<4>,2|H<1>,5|C<3>}	C[6](C[6]C[6]HH)(C[6]B[6]H)(H){1|C<3>,1|H<1>,2|N<3>}	H(C[6]B[6]C[6])	119.1990	1.496	2	119.1990	2.239	2	119.4960	1.384	3	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	B[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](B[6]C[6]N[6]Cl)(C[6]C[6]H)(H)	C[6](C[6]C[6]CH)(C[6]B[6]H)(H)	H(C[6]B[6]C[6])	C[6](B[6]C[6]N[6]Cl)(C[6]C[6]H)(H){1|Si<4>,1|C<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]CH)(C[6]B[6]H)(H){1|Cl<1>,1|C<3>,1|H<1>,1|N<3>}	H(C[6]B[6]C[6])	120.0900	0.000	1	120.0900	0.000	1	119.4960	1.384	3	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[3,5,6]-4:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[3,5,6]C[3,5,6]C[3]C[5])(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6]2H)(C[6]C[3,5,6]H)(H)	H(C[6]C[3,5,6]C[6])	C[6](C[3,5,6]C[3,5,6]C[3]C[5])(C[6]C[6,6]H)(H){4|H<1>,5|C<4>}	C[6](C[6,6]C[6,6]2H)(C[6]C[3,5,6]H)(H){1|C<3>,7|C<4>}	H(C[6]C[3,5,6]C[6])	119.3720	0.000	1	119.3720	0.000	1	118.8007	0.084	6	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[3,5,6]-4:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[3,5,6]C[3,5]C[5,6]C[3])(C[6]C[6,6]H)(H)	C[6](C[6,6]C[5,6]C[6,6]H)(C[6]C[3,5,6]H)(H)	H(C[6]C[3,5,6]C[6])	C[6](C[3,5,6]C[3,5]C[5,6]C[3])(C[6]C[6,6]H)(H){4|H<1>,5|C<4>}	C[6](C[6,6]C[5,6]C[6,6]H)(C[6]C[3,5,6]H)(H){1|H<1>,1|O<2>,6|C<4>}	H(C[6]C[3,5,6]C[6])	118.7480	0.034	2	118.6864	0.007	5	118.8007	0.084	6	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[3,5,6]-4:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[3,5,6]C[3,5]C[5,6]C[3])(C[6]C[6,6]H)(H)	C[6](C[6,6]C[5,6]C[6,6]H)(C[6]C[3,5,6]H)(H)	H(C[6]C[3,5,6]C[6])	C[6](C[3,5,6]C[3,5]C[5,6]C[3])(C[6]C[6,6]H)(H){4|H<1>,5|C<4>}	C[6](C[6,6]C[5,6]C[6,6]H)(C[6]C[3,5,6]H)(H){2|H<1>,6|C<4>}	H(C[6]C[3,5,6]C[6])	118.6453	0.079	3	118.6864	0.007	5	118.8007	0.084	6	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[3,6]-4:C[6]-3:H-1:	C[3,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[3,6]C[3,5,6]C[3,5]H)(C[6]C[3,6]H)(H)	C[6](C[3,6]C[3,5,6]C[3,5]H)(C[6]C[3,6]H)(H)	H(C[6]C[3,6]C[6])	C[6](C[3,6]C[3,5,6]C[3,5]H)(C[6]C[3,6]H)(H){1|Si<4>,1|C<3>,2|C<4>,2|H<1>}	C[6](C[3,6]C[3,5,6]C[3,5]H)(C[6]C[3,6]H)(H){1|Si<4>,1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[3,6]C[6])	118.9700	0.151	2	118.9700	0.023	2	118.9700	0.023	2	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[3,6]-4:C[6]-3:H-1:	C[4,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[3,6]C[3,4,6]O[3,4]C)(C[6]C[4,6]H)(H)	C[6](C[4,6]C[4,4,6]H[4]H)(C[6]C[3,6]H)(H)	H(C[6]C[3,6]C[6])	C[6](C[3,6]C[3,4,6]O[3,4]C)(C[6]C[4,6]H)(H){1|C<4>,1|C<5>,1|H<2>,3|H<1>}	C[6](C[4,6]C[4,4,6]H[4]H)(C[6]C[3,6]H)(H){1|C<3>,1|C<4>,1|C<5>,1|H<1>,1|O<4>}	H(C[6]C[3,6]C[6])	118.7420	0.000	1	118.7420	0.000	1	118.7420	0.000	1	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[3,6]-4:C[6]-3:H-1:	C[5,6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[3,6]C[3,6]O[3]H)(C[6]C[5,6,6]H)(H)	C[6](C[5,6,6]C[5,6,6]C[6]O[5])(C[6]C[3,6]H)(H)	H(C[6]C[3,6]C[6])	C[6](C[3,6]C[3,6]O[3]H)(C[6]C[5,6,6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|O<2>}	C[6](C[5,6,6]C[5,6,6]C[6]O[5])(C[6]C[3,6]H)(H){2|C<3>,2|C<4>,2|H<1>,2|O<2>}	H(C[6]C[3,6]C[6])	119.0285	0.036	2	119.0285	0.001	2	119.0285	0.001	2	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[3,6]-4:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[3,6]C[3,6,6]C[3,6]H)(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,6]O[5]H)(C[6]C[3,6]H)(H)	H(C[6]C[3,6]C[6])	C[6](C[3,6]C[3,6,6]C[3,6]H)(C[6]C[5,6]H)(H){1|C<3>,1|H<1>,1|O<2>,3|C<4>}	C[6](C[5,6]C[5,6]O[5]H)(C[6]C[3,6]H)(H){1|O<2>,2|H<1>,3|C<4>}	H(C[6]C[3,6]C[6])	119.8390	0.000	1	119.9707	0.040	3	119.9707	0.040	3	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[3,6]-4:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[3,6]C[3,6,6]C[3,6]H)(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,6]O[5]H)(C[6]C[3,6]H)(H)	H(C[6]C[3,6]C[6])	C[6](C[3,6]C[3,6,6]C[3,6]H)(C[6]C[5,6]H)(H){1|C<3>,1|O<2>,2|C<4>,2|H<1>}	C[6](C[5,6]C[5,6]O[5]H)(C[6]C[3,6]H)(H){1|O<2>,2|H<1>,3|C<4>}	H(C[6]C[3,6]C[6])	120.0365	0.231	2	119.9707	0.040	3	119.9707	0.040	3	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[3,6]-4:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[3,6]C[3,6,6]C[3,6]H)(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[3,6]H)(H)	H(C[6]C[3,6]C[6])	C[6](C[3,6]C[3,6,6]C[3,6]H)(C[6]C[6,6]H)(H){1|C<4>,2|H<1>,3|C<3>}	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[3,6]H)(H){1|O<2>,2|C<3>,2|C<4>,2|H<1>}	H(C[6]C[3,6]C[6])	120.7933	1.400	12	120.8931	1.859	14	120.5081	1.750	24	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[3,6]-4:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[3,6]C[3,6,6]C[3,6]H)(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[3,6]H)(H)	H(C[6]C[3,6]C[6])	C[6](C[3,6]C[3,6,6]C[3,6]H)(C[6]C[6,6]H)(H){2|H<1>,4|C<3>}	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[3,6]H)(H){1|C<3>,1|O<1>,2|C<4>,2|H<1>}	H(C[6]C[3,6]C[6])	121.4920	1.331	2	120.8931	1.859	14	120.5081	1.750	24	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[3,6]-4:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[3,6]C[3,6,6]C[3,6]H)(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6]C[6a]C[6])(C[6]C[3,6]H)(H)	H(C[6]C[3,6]C[6])	C[6](C[3,6]C[3,6,6]C[3,6]H)(C[6]C[6,6]H)(H){1|C<4>,2|H<1>,3|C<3>}	C[6](C[6,6]C[6,6]C[6a]C[6])(C[6]C[3,6]H)(H){1|O<2>,2|C<4>,2|H<1>,4|C<3>}	H(C[6]C[3,6]C[6])	119.9691	1.111	10	119.9691	1.234	10	120.5081	1.750	24	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[3,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[3,6]C[3,5,6]C[3,5]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]CH)(C[6]C[3,6]H)(H)	H(C[6]C[3,6]C[6])	C[6](C[3,6]C[3,5,6]C[3,5]H)(C[6]C[6]H)(H){1|O<2>,2|H<1>,3|C<4>}	C[6](C[6]C[5,6]CH)(C[6]C[3,6]H)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[3,6]C[6])	119.2460	0.000	1	119.2460	0.000	1	119.2460	0.000	1	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6]-3:H-1:	C[4,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[3x6]C[3x6]2H)(C[6]C[4,6]H)(H)	C[6](C[4,6]C[4,6]C[4]H)(C[6]C[3x6]H)(H)	H(C[6]C[3x6]C[6])	C[6](C[3x6]C[3x6]2H)(C[6]C[4,6]H)(H){1|C<3>,3|H<1>,4|C<4>}	C[6](C[4,6]C[4,6]C[4]H)(C[6]C[3x6]H)(H){3|H<1>,4|C<4>}	H(C[6]C[3x6]C[6])	117.0960	0.000	1	117.0960	0.000	1	117.0960	0.000	1	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[3x6]C[5,3x6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]HO)(C[6]C[3x6]H)(H)	H(C[6]C[3x6]C[6])	C[6](C[3x6]C[5,3x6]C[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|N<3>,1|O<2>,2|H<1>,3|C<4>}	C[6](C[6]C[5,6]HO)(C[6]C[3x6]H)(H){1|O<2>,2|C<4>,2|H<1>}	H(C[6]C[3x6]C[6])	119.6261	0.781	9	120.2922	2.144	17	120.2922	2.144	17	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[3x6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[3x6]C[5,3x6]C[6,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]HO)(C[6]C[3x6]H)(H)	H(C[6]C[3x6]C[6])	C[6](C[3x6]C[5,3x6]C[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|N<4>,1|O<2>,2|H<1>,3|C<4>}	C[6](C[6]C[5,6]HO)(C[6]C[3x6]H)(H){1|O<2>,2|C<4>,2|H<1>}	H(C[6]C[3x6]C[6])	121.0416	1.730	8	120.2922	2.144	17	120.2922	2.144	17	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[4,6]-4:C[6]-3:H-1:	C[3,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[4,6]C[4,4,6]H[4]H)(C[6]C[3,6]H)(H)	C[6](C[3,6]C[3,4,6]O[3,4]C)(C[6]C[4,6]H)(H)	H(C[6]C[4,6]C[6])	C[6](C[4,6]C[4,4,6]H[4]H)(C[6]C[3,6]H)(H){1|C<3>,1|C<4>,1|C<5>,1|H<1>,1|O<4>}	C[6](C[3,6]C[3,4,6]O[3,4]C)(C[6]C[4,6]H)(H){1|C<4>,1|C<5>,1|H<2>,3|H<1>}	H(C[6]C[4,6]C[6])	121.6520	0.000	1	121.6520	0.000	1	121.6520	0.000	1	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[4,6]-4:C[6]-3:H-1:	C[3x6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[4,6]C[4,6]C[4]H)(C[6]C[3x6]H)(H)	C[6](C[3x6]C[3x6]2H)(C[6]C[4,6]H)(H)	H(C[6]C[4,6]C[6])	C[6](C[4,6]C[4,6]C[4]H)(C[6]C[3x6]H)(H){3|H<1>,4|C<4>}	C[6](C[3x6]C[3x6]2H)(C[6]C[4,6]H)(H){1|C<3>,3|H<1>,4|C<4>}	H(C[6]C[4,6]C[6])	118.0310	0.000	1	118.0310	0.000	1	118.0310	0.000	1	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[4,6]-4:C[6]-3:H-1:	C[4,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[4,6]C[4,6a]C[4,6]O)(C[6]C[4,6]H)(H)	C[6](C[4,6]C[4,6a]C[4,6]O)(C[6]C[4,6]H)(H)	H(C[6]C[4,6]C[6])	C[6](C[4,6]C[4,6a]C[4,6]O)(C[6]C[4,6]H)(H){1|C<4>,1|H<1>,1|O<2>,3|C<3>}	C[6](C[4,6]C[4,6a]C[4,6]O)(C[6]C[4,6]H)(H){1|C<4>,1|H<1>,1|O<2>,3|C<3>}	H(C[6]C[4,6]C[6])	117.4745	0.028	2	117.4745	0.001	2	117.4745	0.001	2	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[4,6]-4:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[4,6]C[4,5,5,6]C[4]H)(C[6]C[5,6]H)(H)	C[6](C[5,6]O[5,6]C[5]H)(C[6]C[4,6]H)(H)	H(C[6]C[4,6]C[6])	C[6](C[4,6]C[4,5,5,6]C[4]H)(C[6]C[5,6]H)(H){1|C<3>,1|O<2>,2|C<4>,3|H<1>}	C[6](C[5,6]O[5,6]C[5]H)(C[6]C[4,6]H)(H){3|C<4>,3|H<1>}	H(C[6]C[4,6]C[6])	120.1330	0.000	1	120.1330	0.000	1	118.4810	0.921	5	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[4,6]-4:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[4,6]C[4,6]C[4]H)(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[4,6]H)(H)	H(C[6]C[4,6]C[6])	C[6](C[4,6]C[4,6]C[4]H)(C[6]C[5,6]H)(H){1|H<1>,1|O<1>,4|C<4>}	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[4,6]H)(H){1|C<3>,3|C<4>,4|H<1>}	H(C[6]C[4,6]C[6])	118.0180	0.000	1	118.0180	0.000	1	118.4810	0.921	5	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[4,6]-4:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[4,6]C[4,6]C[4]H)(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,6]N[5]H)(C[6]C[4,6]H)(H)	H(C[6]C[4,6]C[6])	C[6](C[4,6]C[4,6]C[4]H)(C[6]C[5,6]H)(H){1|Br<1>,1|N<3>,2|C<4>,3|H<1>}	C[6](C[5,6]C[5,6]N[5]H)(C[6]C[4,6]H)(H){1|C<3>,1|O<2>,1|S<4>,2|C<4>,2|H<1>}	H(C[6]C[4,6]C[6])	117.6800	0.000	1	117.6800	0.000	1	118.4810	0.921	5	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[4,6]-4:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[4,6]C[4,6]C[4]H)(C[6]C[5,6]H)(H)	C[6](C[5,6]C[6]S[5]2)(C[6]C[4,6]H)(H)	H(C[6]C[4,6]C[6])	C[6](C[4,6]C[4,6]C[4]H)(C[6]C[5,6]H)(H){1|C<3>,1|H<1>,2|S<2>,3|C<4>}	C[6](C[5,6]C[6]S[5]2)(C[6]C[4,6]H)(H){1|H<1>,1|O<1>,4|C<4>}	H(C[6]C[4,6]C[6])	118.2870	0.153	2	118.2870	0.023	2	118.4810	0.921	5	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[4,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[4,6]C[4,5,6]C[4]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]CH)(C[6]C[4,6]H)(H)	H(C[6]C[4,6]C[6])	C[6](C[4,6]C[4,5,6]C[4]H)(C[6]C[6]H)(H){1|H<1>,1|O<1>,4|C<4>}	C[6](C[6]C[5,6]CH)(C[6]C[4,6]H)(H){1|C<4>,2|C<3>,2|H<1>}	H(C[6]C[4,6]C[6])	118.9430	0.000	1	118.9430	0.000	1	118.9430	0.000	1	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[5,5,6]-4:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[5,5,6]C[5,5]O[5,6]C[5])(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,5,6]O[5]H)(C[6]C[5,5,6]H)(H)	H(C[6]C[5,5,6]C[6])	C[6](C[5,5,6]C[5,5]O[5,6]C[5])(C[6]C[5,6]H)(H){2|O<2>,3|C<4>,4|H<1>}	C[6](C[5,6]C[5,5,6]O[5]H)(C[6]C[5,5,6]H)(H){1|H<1>,1|O<2>,4|C<4>}	H(C[6]C[5,5,6]C[6])	120.6970	0.000	1	120.6970	0.000	1	120.6970	0.000	1	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[5,5,6]-4:C[6]-3:H-1:	C[6,6]-4:C[6]-3:Br-1:	C[6]-3:	C[6](C[5,5,6]C[5,5]C[5,6]C[5])(C[6]C[6,6]Br)(H)	C[6](C[6,6]C[5,6,6]O[6]H)(C[6]C[5,5,6]H)(Br)	H(C[6]C[5,5,6]C[6])	C[6](C[5,5,6]C[5,5]C[5,6]C[5])(C[6]C[6,6]Br)(H){1|O<1>,1|O<2>,4|C<4>,4|H<1>}	C[6](C[6,6]C[5,6,6]O[6]H)(C[6]C[5,5,6]H)(Br){1|C<3>,1|H<1>,4|C<4>}	H(C[6]C[5,5,6]C[6])	119.9180	0.000	1	119.9180	0.000	1	119.9180	0.000	1	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[5,5,6]-4:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[5,5,6]C[5,5]C[5,6]C[5])(C[6]C[6,6]H)(H)	C[6](C[6,6]C[5,6,6]O[6]H)(C[6]C[5,5,6]H)(H)	H(C[6]C[5,5,6]C[6])	C[6](C[5,5,6]C[5,5]C[5,6]C[5])(C[6]C[6,6]H)(H){1|O<1>,1|O<2>,4|C<4>,4|H<1>}	C[6](C[6,6]C[5,6,6]O[6]H)(C[6]C[5,5,6]H)(H){1|C<3>,1|O<2>,4|C<4>}	H(C[6]C[5,5,6]C[6])	119.9280	0.000	1	119.9280	0.000	1	119.9280	0.000	1	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[5,6,6]-4:C[6]-3:H-1:	C[3,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6,6]C[5,6,6]C[6]O[5])(C[6]C[3,6]H)(H)	C[6](C[3,6]C[3,6]O[3]H)(C[6]C[5,6,6]H)(H)	H(C[6]C[5,6,6]C[6])	C[6](C[5,6,6]C[5,6,6]C[6]O[5])(C[6]C[3,6]H)(H){2|C<3>,2|C<4>,2|H<1>,2|O<2>}	C[6](C[3,6]C[3,6]O[3]H)(C[6]C[5,6,6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[5,6,6]C[6])	117.9065	0.275	2	117.9065	0.076	2	117.9065	0.076	2	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[5,6,6]-4:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6,6]C[5,6,6]P[5,5,6]H)(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,6]P[5]H)(C[6]C[5,6,6]H)(H)	H(C[6]C[5,6,6]C[6])	C[6](C[5,6,6]C[5,6,6]P[5,5,6]H)(C[6]C[5,6]H)(H){1|Mo<6>,1|C<4>,1|O<2>,1|P<4>,2|C<3>,2|H<1>}	C[6](C[5,6]C[5,6]P[5]H)(C[6]C[5,6,6]H)(H){1|Mo<6>,1|C<3>,1|H<1>,1|O<2>,1|P<4>,2|C<4>}	H(C[6]C[5,6,6]C[6])	117.8700	0.000	1	117.8700	0.000	1	117.8700	0.000	1	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[5,6,6]-4:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6,6]C[5,5,6,6]C[5,6]H)(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[5,6,6]H)(H)	H(C[6]C[5,6,6]C[6])	C[6](C[5,6,6]C[5,5,6,6]C[5,6]H)(C[6]C[6,6]H)(H){1|O<2>,3|H<1>,4|C<4>}	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[5,6,6]H)(H){1|O<2>,2|H<1>,5|C<4>}	H(C[6]C[5,6,6]C[6])	119.3310	0.000	1	119.3310	0.000	1	118.9320	1.581	4	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[5,6,6]-4:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6,6]C[5,6,6]C[5]C[6])(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[5,6,6]H)(H)	H(C[6]C[5,6,6]C[6])	C[6](C[5,6,6]C[5,6,6]C[5]C[6])(C[6]C[6,6]H)(H){1|O<2>,4|C<4>,6|H<1>}	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[5,6,6]H)(H){2|H<1>,6|C<4>}	H(C[6]C[5,6,6]C[6])	120.5360	0.000	1	120.5360	0.000	1	118.9320	1.581	4	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[5,6,6]-4:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6,6]C[5,6,6]C[6,6]O[5])(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6]2H)(C[6]C[5,6,6]H)(H)	H(C[6]C[5,6,6]C[6])	C[6](C[5,6,6]C[5,6,6]C[6,6]O[5])(C[6]C[6,6]H)(H){1|C<3>,2|H<1>,6|C<4>}	C[6](C[6,6]C[6,6]2H)(C[6]C[5,6,6]H)(H){1|O<2>,7|C<4>}	H(C[6]C[5,6,6]C[6])	117.9305	0.070	2	117.9305	0.005	2	118.9320	1.581	4	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[5,6,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6,6]C[5,5,6,6]S[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6,6]HO)(C[6]C[5,6,6]H)(H)	H(C[6]C[5,6,6]C[6])	C[6](C[5,6,6]C[5,5,6,6]S[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|O<2>,3|C<4>}	C[6](C[6]C[5,6,6]HO)(C[6]C[5,6,6]H)(H){1|C<4>,1|N<3>,1|S<2>,2|H<1>}	H(C[6]C[5,6,6]C[6])	118.4850	0.214	2	118.4850	0.046	2	118.8227	0.365	3	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[5,6,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6,6]C[5,6]O[5,6]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[5,5,6]HH)(C[6]C[5,6,6]H)(H)	H(C[6]C[5,6,6]C[6])	C[6](C[5,6,6]C[5,6]O[5,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|O<2>,3|C<4>,4|H<1>}	C[6](C[6]C[5,5,6]HH)(C[6]C[5,6,6]H)(H){1|O<2>,4|C<4>}	H(C[6]C[5,6,6]C[6])	119.4980	0.000	1	119.4980	0.000	1	118.8227	0.365	3	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[3,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]O[5]H)(C[6]C[3,6]H)(H)	C[6](C[3,6]C[3,6,6]C[3,6]H)(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]O[5]H)(C[6]C[3,6]H)(H){1|O<2>,2|H<1>,3|C<4>}	C[6](C[3,6]C[3,6,6]C[3,6]H)(C[6]C[5,6]H)(H){1|C<3>,1|H<1>,1|O<2>,3|C<4>}	H(C[6]C[5,6]C[6])	121.9510	0.000	1	120.6597	1.449	3	120.6597	1.449	3	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[3,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]O[5]H)(C[6]C[3,6]H)(H)	C[6](C[3,6]C[3,6,6]C[3,6]H)(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]O[5]H)(C[6]C[3,6]H)(H){1|O<2>,2|H<1>,3|C<4>}	C[6](C[3,6]C[3,6,6]C[3,6]H)(C[6]C[5,6]H)(H){1|C<3>,1|O<2>,2|C<4>,2|H<1>}	H(C[6]C[5,6]C[6])	120.0140	0.629	2	120.6597	1.449	3	120.6597	1.449	3	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[4,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[4,6]H)(H)	C[6](C[4,6]C[4,6]C[4]H)(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[4,6]H)(H){1|C<3>,3|C<4>,4|H<1>}	C[6](C[4,6]C[4,6]C[4]H)(C[6]C[5,6]H)(H){1|H<1>,1|O<1>,4|C<4>}	H(C[6]C[5,6]C[6])	117.9860	0.000	1	117.9860	0.000	1	118.4134	1.454	5	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[4,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]N[5]H)(C[6]C[4,6]H)(H)	C[6](C[4,6]C[4,6]C[4]H)(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]N[5]H)(C[6]C[4,6]H)(H){1|C<3>,1|O<2>,1|S<4>,2|C<4>,2|H<1>}	C[6](C[4,6]C[4,6]C[4]H)(C[6]C[5,6]H)(H){1|Br<1>,1|N<3>,2|C<4>,3|H<1>}	H(C[6]C[5,6]C[6])	117.4900	0.000	1	117.4900	0.000	1	118.4134	1.454	5	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[4,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[6]S[5]2)(C[6]C[4,6]H)(H)	C[6](C[4,6]C[4,6]C[4]H)(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[6]S[5]2)(C[6]C[4,6]H)(H){1|H<1>,1|O<1>,4|C<4>}	C[6](C[4,6]C[4,6]C[4]H)(C[6]C[5,6]H)(H){1|C<3>,1|H<1>,2|S<2>,3|C<4>}	H(C[6]C[5,6]C[6])	118.0420	0.348	2	118.0420	0.121	2	118.4134	1.454	5	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[4,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]O[5,6]C[5]H)(C[6]C[4,6]H)(H)	C[6](C[4,6]C[4,5,5,6]C[4]H)(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]O[5,6]C[5]H)(C[6]C[4,6]H)(H){3|C<4>,3|H<1>}	C[6](C[4,6]C[4,5,5,6]C[4]H)(C[6]C[5,6]H)(H){1|C<3>,1|O<2>,2|C<4>,3|H<1>}	H(C[6]C[5,6]C[6])	120.5070	0.000	1	120.5070	0.000	1	118.4134	1.454	5	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[5,5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,5,6]O[5]H)(C[6]C[5,5,6]H)(H)	C[6](C[5,5,6]C[5,5]O[5,6]C[5])(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,5,6]O[5]H)(C[6]C[5,5,6]H)(H){1|H<1>,1|O<2>,4|C<4>}	C[6](C[5,5,6]C[5,5]O[5,6]C[5])(C[6]C[5,6]H)(H){2|O<2>,3|C<4>,4|H<1>}	H(C[6]C[5,6]C[6])	119.3960	0.000	1	119.3960	0.000	1	119.3960	0.000	1	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[5,6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]P[5]H)(C[6]C[5,6,6]H)(H)	C[6](C[5,6,6]C[5,6,6]P[5,5,6]H)(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]P[5]H)(C[6]C[5,6,6]H)(H){1|Mo<6>,1|C<3>,1|H<1>,1|O<2>,1|P<4>,2|C<4>}	C[6](C[5,6,6]C[5,6,6]P[5,5,6]H)(C[6]C[5,6]H)(H){1|Mo<6>,1|C<4>,1|O<2>,1|P<4>,2|C<3>,2|H<1>}	H(C[6]C[5,6]C[6])	118.5120	0.000	1	118.5120	0.000	1	118.5120	0.000	1	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[5,6]-4:C[6]-3:Br-1:	C[6]-3:	C[6](C[5,6]C[5,6]O[5]H)(C[6]C[5,6]Br)(H)	C[6](C[5,6]C[5,6]O[5]H)(C[6]C[5,6]H)(Br)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]O[5]H)(C[6]C[5,6]Br)(H){2|C<4>,2|H<1>,2|O<2>}	C[6](C[5,6]C[5,6]O[5]H)(C[6]C[5,6]H)(Br){2|C<4>,2|H<1>,2|O<2>}	H(C[6]C[5,6]C[6])	118.5380	0.174	2	118.5380	0.030	2	118.5380	0.030	2	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[3x5,6]C[5,6]C)(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,5,6]O[5]C)(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[3x5,6]C[5,6]C)(C[6]C[5,6]H)(H){1|O<1>,1|O<2>,5|C<4>}	C[6](C[5,6]C[5,5,6]O[5]C)(C[6]C[5,6]H)(H){1|C<3>,5|C<4>}	H(C[6]C[5,6]C[6])	119.0320	0.000	1	119.0320	0.000	1	119.2677	2.952	11	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[3x5,6]C[5]C)(C[6]C[5,6]H)(H)	C[6](C[5,6]C[3x5,6]C[5]C)(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[3x5,6]C[5]C)(C[6]C[5,6]H)(H){1|H<1>,2|C<3>,2|O<2>,3|C<4>}	C[6](C[5,6]C[3x5,6]C[5]C)(C[6]C[5,6]H)(H){1|H<1>,2|C<3>,2|O<2>,3|C<4>}	H(C[6]C[5,6]C[6])	118.9550	0.000	1	118.9550	0.000	1	119.2677	2.952	11	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,5,6]O[5]C)(C[6]C[5,6]H)(H)	C[6](C[5,6]C[3x5,6]C[5,6]C)(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,5,6]O[5]C)(C[6]C[5,6]H)(H){1|C<3>,5|C<4>}	C[6](C[5,6]C[3x5,6]C[5,6]C)(C[6]C[5,6]H)(H){1|O<1>,1|O<2>,5|C<4>}	H(C[6]C[5,6]C[6])	118.1190	0.000	1	118.1190	0.000	1	119.2677	2.952	11	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6,6]N[5]H)(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,6]O[5]H)(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6,6]N[5]H)(C[6]C[5,6]H)(H){1|H<1>,1|N<2>,1|N<3>,1|O<2>,2|C<4>}	C[6](C[5,6]C[5,6]O[5]H)(C[6]C[5,6]H)(H){1|N<2>,1|O<2>,2|C<4>,2|H<1>}	H(C[6]C[5,6]C[6])	122.3360	0.000	1	122.3360	0.000	1	119.2677	2.952	11	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6,6]O[5]H)(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,6]O[5]H)(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6,6]O[5]H)(C[6]C[5,6]H)(H){1|C<3>,1|H<1>,1|N<2>,1|O<2>,2|C<4>}	C[6](C[5,6]C[5,6]O[5]H)(C[6]C[5,6]H)(H){2|C<4>,2|H<1>,2|O<2>}	H(C[6]C[5,6]C[6])	117.6590	0.000	1	117.6590	0.000	1	119.2677	2.952	11	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[5,6]H)(H){2|C<3>,3|C<4>,3|H<1>}	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[5,6]H)(H){4|C<4>,4|H<1>}	H(C[6]C[5,6]C[6])	117.5250	0.000	1	118.8305	3.409	2	119.2677	2.952	11	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[5,6]H)(H){4|C<4>,4|H<1>}	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[5,6]H)(H){2|C<3>,3|C<4>,3|H<1>}	H(C[6]C[5,6]C[6])	120.1360	0.000	1	118.8305	3.409	2	119.2677	2.952	11	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]O[5]H)(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,6,6]N[5]H)(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]O[5]H)(C[6]C[5,6]H)(H){1|N<2>,1|O<2>,2|C<4>,2|H<1>}	C[6](C[5,6]C[5,6,6]N[5]H)(C[6]C[5,6]H)(H){1|H<1>,1|N<2>,1|N<3>,1|O<2>,2|C<4>}	H(C[6]C[5,6]C[6])	117.1230	0.000	1	117.1230	0.000	1	119.2677	2.952	11	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]O[5]H)(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,6,6]O[5]H)(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]O[5]H)(C[6]C[5,6]H)(H){2|C<4>,2|H<1>,2|O<2>}	C[6](C[5,6]C[5,6,6]O[5]H)(C[6]C[5,6]H)(H){1|C<3>,1|H<1>,1|N<2>,1|O<2>,2|C<4>}	H(C[6]C[5,6]C[6])	120.1210	0.000	1	120.1210	0.000	1	119.2677	2.952	11	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[6]O[5]2)(C[6]C[5,6]H)(H)	C[6](C[5,6]C[6]O[5]2)(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[6]O[5]2)(C[6]C[5,6]H)(H){1|C<3>,1|H<1>,2|C<4>,2|O<2>}	C[6](C[5,6]C[6]O[5]2)(C[6]C[5,6]H)(H){1|C<3>,1|H<1>,2|C<4>,2|O<2>}	H(C[6]C[5,6]C[6])	120.4695	2.010	2	120.4695	4.041	2	119.2677	2.952	11	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,5]C[5,6]H)(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,5]C[5,6]H)(C[6]C[6,6]H)(H){1|C<3>,2|H<1>,5|C<4>}	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[5,6]H)(H){4|C<4>,4|H<1>}	H(C[6]C[5,6]C[6])	118.1900	0.496	4	118.1900	0.246	4	118.9351	1.200	14	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6,6]C[5,6a]H)(C[6]C[6,6]H)(H)	C[6](C[6,6]N[6,6]C[6]H)(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6,6]C[5,6a]H)(C[6]C[6,6]H)(H){1|C<4>,2|C<3>,2|H<1>,2|N<3>}	C[6](C[6,6]N[6,6]C[6]H)(C[6]C[5,6]H)(H){1|C<2>,1|C<3>,2|C<4>,3|H<1>}	H(C[6]C[5,6]C[6])	118.7040	0.000	1	118.7040	0.000	1	118.9351	1.200	14	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]2H)(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]2H)(C[6]C[6,6]H)(H){1|C<3>,2|H<1>,5|C<4>}	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[5,6]H)(H){4|C<4>,4|H<1>}	H(C[6]C[5,6]C[6])	118.1120	0.000	1	118.1120	0.000	1	118.9351	1.200	14	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6]2H)(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6,6]H)(H){1|O<2>,2|C<3>,2|C<4>,2|H<1>}	C[6](C[6,6]C[6,6]2H)(C[6]C[5,6]H)(H){2|C<3>,2|H<1>,3|C<4>}	H(C[6]C[5,6]C[6])	119.5870	0.160	2	119.5870	0.026	2	118.9351	1.200	14	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6,6]H)(H){1|C<3>,1|O<2>,2|C<4>,4|H<1>}	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[5,6]H)(H){1|C<3>,3|C<4>,3|H<1>}	H(C[6]C[5,6]C[6])	120.3250	0.000	1	118.7840	1.083	4	118.9351	1.200	14	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6,6]H)(H){1|C<4>,1|O<2>,2|C<3>,4|H<1>}	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[5,6]H)(H){1|C<3>,3|C<4>,3|H<1>}	H(C[6]C[5,6]C[6])	118.0440	0.000	1	118.7840	1.083	4	118.9351	1.200	14	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6,6]H)(H){1|O<2>,2|C<3>,2|H<1>,3|C<4>}	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[5,6]H)(H){4|C<4>,4|H<1>}	H(C[6]C[5,6]C[6])	118.3835	0.076	2	118.7840	1.083	4	118.9351	1.200	14	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6a]C[5,6]C)(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6]O[6]H)(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6a]C[5,6]C)(C[6]C[6,6]H)(H){1|C<4>,2|C<3>,2|H<1>,2|O<2>}	C[6](C[6,6]C[6,6]O[6]H)(C[6]C[5,6]H)(H){1|C<3>,1|H<1>,1|O<2>,3|C<4>}	H(C[6]C[5,6]C[6])	119.5720	0.000	1	119.5720	0.000	1	118.9351	1.200	14	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6a]C[5]C[6])(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6a]C[5]C[6])(C[6]C[6,6]H)(H){1|N<3>,1|O<1>,2|C<3>,2|C<4>,3|H<1>}	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[5,6]H)(H){2|C<3>,3|C<4>,3|H<1>}	H(C[6]C[5,6]C[6])	121.6340	0.000	1	121.6340	0.000	1	118.9351	1.200	14	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:Br-1:	C[6]-3:	C[6](C[5,6]C[5,6a]C[5,6]H)(C[6]C[6]Br)(H)	C[6](C[6]C[5,6]BrH)(C[6]C[5,6]H)(Br)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6a]C[5,6]H)(C[6]C[6]Br)(H){1|Br<1>,1|C<4>,2|C<3>,3|H<1>}	C[6](C[6]C[5,6]BrH)(C[6]C[5,6]H)(Br){1|C<4>,2|C<3>,2|H<1>}	H(C[6]C[5,6]C[6])	120.0400	0.000	1	120.0400	0.000	1	120.0400	0.000	1	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[3,5,5,6]N[5]H)(C[6]C[6]H)(H)	C[6](C[6]C[3,5,6]HH)(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[3,5,5,6]N[5]H)(C[6]C[6]H)(H){2|C<3>,2|H<1>,3|C<4>}	C[6](C[6]C[3,5,6]HH)(C[6]C[5,6]H)(H){1|H<1>,2|C<4>,2|N<3>}	H(C[6]C[5,6]C[6])	120.0690	0.000	1	120.0690	0.000	1	119.5242	4.174	56	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[3,5,6]C[5]C)(C[6]C[6]H)(H)	C[6](C[6]C[3,6]HH)(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[3,5,6]C[5]C)(C[6]C[6]H)(H){1|C<3>,2|C<4>,5|H<1>}	C[6](C[6]C[3,6]HH)(C[6]C[5,6]H)(H){1|H<1>,4|C<4>}	H(C[6]C[5,6]C[6])	119.6230	3.400	2	119.6230	11.558	2	119.5242	4.174	56	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[3,5,6]C[5]H)(C[6]C[6]H)(H)	C[6](C[6]C[3,6]CH)(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[3,5,6]C[5]H)(C[6]C[6]H)(H){1|C<2>,3|H<1>,4|C<4>}	C[6](C[6]C[3,6]CH)(C[6]C[5,6]H)(H){2|H<1>,3|C<4>}	H(C[6]C[5,6]C[6])	116.7815	0.104	2	116.7815	0.011	2	119.5242	4.174	56	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[3x5,6]C[5]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,5,6]HO)(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[3x5,6]C[5]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>,2|C<4>,2|N<3>}	C[6](C[6]C[5,5,6]HO)(C[6]C[5,6]H)(H){1|H<1>,2|C<3>,2|C<4>}	H(C[6]C[5,6]C[6])	121.5740	0.000	1	121.5740	0.000	1	119.5242	4.174	56	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[3x5,6]C[5]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]CH)(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[3x5,6]C[5]H)(C[6]C[6]H)(H){1|C<3>,1|O<2>,3|C<4>,3|H<1>}	C[6](C[6]C[5,6]CH)(C[6]C[5,6]H)(H){1|C<3>,1|H<1>,3|C<4>}	H(C[6]C[5,6]C[6])	122.8120	0.000	1	122.8120	0.000	1	119.5242	4.174	56	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,5,6,6]O[5]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6,6]HO)(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,5,6,6]O[5]H)(C[6]C[6]H)(H){1|O<2>,2|H<1>,3|C<4>}	C[6](C[6]C[5,6,6]HO)(C[6]C[5,6]H)(H){1|O<2>,2|C<4>,2|H<1>}	H(C[6]C[5,6]C[6])	118.4940	0.000	1	118.4940	0.000	1	119.5242	4.174	56	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,5,6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]CH)(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,5,6]C[5,6]H)(C[6]C[6]H)(H){2|H<1>,3|C<3>,3|C<4>}	C[6](C[6]C[5,6]CH)(C[6]C[5,6]H)(H){1|C<3>,1|H<1>,1|O<2>,2|C<4>}	H(C[6]C[5,6]C[6])	122.3890	0.000	1	122.3890	0.000	1	119.5242	4.174	56	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,5,6]C[5]C)(C[6]C[6]H)(H)	C[6](C[6]N[5,6]HH)(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,5,6]C[5]C)(C[6]C[6]H)(H){1|N<3>,2|C<4>,5|H<1>}	C[6](C[6]N[5,6]HH)(C[6]C[5,6]H)(H){1|C<3>,3|C<4>}	H(C[6]C[5,6]C[6])	117.8825	0.128	2	117.8825	0.016	2	119.5242	4.174	56	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,5,6]C[5]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,5,6,6]HO)(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,5,6]C[5]H)(C[6]C[6]H)(H){2|C<4>,3|H<1>,3|O<2>}	C[6](C[6]C[5,5,6,6]HO)(C[6]C[5,6]H)(H){1|H<1>,4|C<4>}	H(C[6]C[5,6]C[6])	122.5950	0.000	1	122.5950	0.000	1	119.5242	4.174	56	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,5,6]C[5]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]HH)(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,5,6]C[5]H)(C[6]C[6]H)(H){1|C<3>,1|N<3>,2|C<2>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]HH)(C[6]C[5,6]H)(H){2|H<1>,3|C<4>}	H(C[6]C[5,6]C[6])	117.9250	0.000	1	119.6235	5.770	2	119.5242	4.174	56	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,5,6]C[5]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]HH)(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,5,6]C[5]H)(C[6]C[6]H)(H){1|C<3>,1|O<2>,2|C<4>,4|H<1>}	C[6](C[6]C[5,6]HH)(C[6]C[5,6]H)(H){1|H<1>,4|C<4>}	H(C[6]C[5,6]C[6])	121.3220	0.000	1	119.6235	5.770	2	119.5242	4.174	56	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,5,6]C[5]N)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]HO)(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,5,6]C[5]N)(C[6]C[6]H)(H){1|C<3>,1|O<2>,2|C<4>,4|H<1>}	C[6](C[6]C[5,6]HO)(C[6]C[5,6]H)(H){1|H<1>,1|N<3>,1|O<2>,2|C<4>}	H(C[6]C[5,6]C[6])	118.0450	0.000	1	118.0450	0.000	1	119.5242	4.174	56	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,5,6]N[5]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]HH)(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,5,6]N[5]H)(C[6]C[6]H)(H){1|C<3>,1|N<3>,1|S<4>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]HH)(C[6]C[5,6]H)(H){1|N<3>,2|C<4>,2|H<1>}	H(C[6]C[5,6]C[6])	118.0364	0.712	5	118.0364	0.507	5	119.5242	4.174	56	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,5,6]O[5]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]HH)(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,5,6]O[5]H)(C[6]C[6]H)(H){2|H<1>,4|C<4>}	C[6](C[6]C[5,6]HH)(C[6]C[5,6]H)(H){1|C<3>,1|H<1>,1|O<2>,2|C<4>}	H(C[6]C[5,6]C[6])	117.7140	0.000	1	117.7140	0.000	1	119.5242	4.174	56	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,5]O[5,6]C)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]HO)(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,5]O[5,6]C)(C[6]C[6]H)(H){1|H<1>,1|O<2>,2|C<3>,2|C<4>}	C[6](C[6]C[5,6]HO)(C[6]C[5,6]H)(H){1|C<2>,1|H<1>,1|O<2>,2|C<4>}	H(C[6]C[5,6]C[6])	120.2375	0.045	2	120.2375	0.002	2	119.5242	4.174	56	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,5]O[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]HO)(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,5]O[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,2|C<4>,2|O<2>}	C[6](C[6]C[5,6]HO)(C[6]C[5,6]H)(H){1|O<2>,2|C<4>,2|H<1>}	H(C[6]C[5,6]C[6])	119.9480	0.000	1	119.9480	0.000	1	119.5242	4.174	56	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6,6]C[5,6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]HH)(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6,6]C[5,6]H)(C[6]C[6]H)(H){1|O<2>,3|C<4>,4|H<1>}	C[6](C[6]C[6,6]HH)(C[6]C[5,6]H)(H){2|H<1>,3|C<4>}	H(C[6]C[5,6]C[6])	119.1430	0.000	1	119.1430	0.000	1	119.5242	4.174	56	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6,6]C[5]C)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]HO)(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6,6]C[5]C)(C[6]C[6]H)(H){1|O<1>,2|C<4>,2|H<1>,2|O<2>}	C[6](C[6]C[6,6]HO)(C[6]C[5,6]H)(H){2|C<3>,3|C<4>}	H(C[6]C[5,6]C[6])	118.6070	0.000	1	118.6070	0.000	1	119.5242	4.174	56	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6,6]C[5]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]SiH)(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6,6]C[5]H)(C[6]C[6]H)(H){1|Si<4>,1|O<2>,2|C<4>,4|H<1>}	C[6](C[6]C[6,6]SiH)(C[6]C[5,6]H)(H){1|C<3>,1|H<1>,3|C<4>}	H(C[6]C[5,6]C[6])	117.3200	0.000	1	117.3200	0.000	1	119.5242	4.174	56	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6,6]C[5]H)(C[6]C[6]H)(H)	C[6](C[6]N[6,6]HH)(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6,6]C[5]H)(C[6]C[6]H)(H){1|N<3>,2|C<4>,5|H<1>}	C[6](C[6]N[6,6]HH)(C[6]C[5,6]H)(H){1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[5,6]C[6])	120.1000	0.098	2	120.1000	0.010	2	119.5242	4.174	56	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6,6]C[5]O)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]HO)(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6,6]C[5]O)(C[6]C[6]H)(H){2|C<4>,2|O<2>,4|H<1>}	C[6](C[6]C[6,6]HO)(C[6]C[5,6]H)(H){1|O<2>,4|C<4>}	H(C[6]C[5,6]C[6])	118.0180	0.000	1	118.0180	0.000	1	119.5242	4.174	56	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6,6]O[5]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]CC)(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6,6]O[5]H)(C[6]C[6]H)(H){1|O<2>,5|C<4>}	C[6](C[6]C[6,6]CC)(C[6]C[5,6]H)(H){1|O<2>,2|C<4>,2|H<1>}	H(C[6]C[5,6]C[6])	118.0970	0.178	2	118.0970	0.032	2	119.5242	4.174	56	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]C)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]HO)(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]C)(C[6]C[6]H)(H){1|C<3>,1|O<2>,3|C<4>,3|H<1>}	C[6](C[6]C[5,6]HO)(C[6]C[5,6]H)(H){5|C<4>}	H(C[6]C[5,6]C[6])	118.8020	0.000	1	118.8020	0.000	1	119.5242	4.174	56	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[5,6]HH)(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]C[6])(C[6]C[6]H)(H){1|C<3>,1|O<1>,2|C<4>,2|O<2>,4|H<1>}	C[6](C[6]C[5,6]HH)(C[6]C[5,6]H)(H){1|H<1>,2|C<3>,2|C<4>}	H(C[6]C[5,6]C[6])	119.1700	0.000	1	119.1700	0.000	1	119.5242	4.174	56	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H)	C[6](C[6]C[3]C[6]H)(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H){1|C<3>,1|O<2>,2|C<4>,4|H<1>}	C[6](C[6]C[3]C[6]H)(C[6]C[5,6]H)(H){1|C<3>,3|H<1>,4|C<4>}	H(C[6]C[5,6]C[6])	121.0270	0.792	2	120.6890	0.656	3	119.5242	4.174	56	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H)	C[6](C[6]C[3]C[6]H)(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H){1|C<3>,1|O<2>,2|C<4>,4|H<1>}	C[6](C[6]C[3]C[6]H)(C[6]C[5,6]H)(H){2|C<3>,2|H<1>,4|C<4>}	H(C[6]C[5,6]C[6])	120.0130	0.000	1	120.6890	0.656	3	119.5242	4.174	56	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]BrH)(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H){1|Br<1>,1|C<4>,1|N<3>,1|O<1>,3|H<1>}	C[6](C[6]C[5,6]BrH)(C[6]C[5,6]H)(H){1|C<3>,1|C<4>,1|N<3>,2|H<1>}	H(C[6]C[5,6]C[6])	118.8580	0.000	1	118.8580	0.000	1	119.5242	4.174	56	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]C[6a]H)(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H){1|C<3>,1|O<1>,2|H<1>,3|C<4>}	C[6](C[6]C[5,6]C[6a]H)(C[6]C[5,6]H)(H){2|C<4>,2|H<1>,3|C<3>}	H(C[6]C[5,6]C[6])	118.7215	0.467	2	118.7215	0.218	2	119.5242	4.174	56	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]HH)(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<2>,4|H<1>}	C[6](C[6]C[5,6]HH)(C[6]C[5,6]H)(H){1|C<3>,1|C<4>,1|O<2>,2|H<1>}	H(C[6]C[5,6]C[6])	124.4510	0.000	1	124.4510	0.000	1	119.5242	4.174	56	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6]H)(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H){1|C<4>,1|N<3>,2|C<3>,4|H<1>}	C[6](C[6]C[6a]C[6]H)(C[6]C[5,6]H)(H){2|C<4>,2|H<1>,3|C<3>}	H(C[6]C[5,6]C[6])	119.8620	0.000	1	119.4780	0.295	2	119.5242	4.174	56	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6]H)(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H){1|C<4>,1|O<2>,2|C<3>,3|H<1>}	C[6](C[6]C[6a]C[6]H)(C[6]C[5,6]H)(H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[5,6]C[6])	119.0940	0.000	1	119.4780	0.295	2	119.5242	4.174	56	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6a]C[6,6a]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]CH)(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6a]C[6,6a]C[5])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,1|O<1>,4|C<3>}	C[6](C[6]C[6,6a]CH)(C[6]C[5,6]H)(H){4|C<3>}	H(C[6]C[5,6]C[6])	118.2350	0.000	1	118.2350	0.000	1	119.5242	4.174	56	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6a]C[6,6a]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]HN)(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6a]C[6,6a]C[5])(C[6]C[6]H)(H){1|H<1>,1|O<1>,2|N<3>,4|C<3>}	C[6](C[6]C[6,6a]HN)(C[6]C[5,6]H)(H){4|C<3>}	H(C[6]C[5,6]C[6])	118.4780	0.000	1	118.4780	0.000	1	119.5242	4.174	56	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5,6a]N[5,6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]BrH)(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6a]N[5,6]C)(C[6]C[6]H)(H){1|Br<1>,1|C<4>,1|H<1>,1|S<4>,2|C<3>}	C[6](C[6]C[6]BrH)(C[6]C[5,6]H)(H){1|C<3>,1|C<4>,1|N<3>,2|H<1>}	H(C[6]C[5,6]C[6])	117.5850	0.000	1	117.5850	0.000	1	119.5242	4.174	56	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[5]2C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]ClC)(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5]2C[6])(C[6]C[6]H)(H){1|Cl<1>,1|C<4>,1|N<3>,3|C<3>,3|H<1>}	C[6](C[6]C[6]ClC)(C[6]C[5,6]H)(H){1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[5,6]C[6])	121.1990	0.251	4	121.1990	0.063	4	119.5242	4.174	56	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[6,6a]C[5,6]C[5])(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]C[6]H)(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[6,6a]C[5,6]C[5])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,1|O<1>,5|C<3>}	C[6](C[6]C[6,6a]C[6]H)(C[6]C[5,6]H)(H){1|C<4>,1|H<1>,5|C<3>}	H(C[6]C[5,6]C[6])	127.6550	0.000	1	127.6550	0.000	1	119.5242	4.174	56	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]C[6]N[5]2)(C[6]C[6]H)(H)	C[6](C[6]C[6]BrH)(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[6]N[5]2)(C[6]C[6]H)(H){2|Br<1>,1|C<4>,2|H<1>,3|C<3>}	C[6](C[6]C[6]BrH)(C[6]C[5,6]H)(H){1|Br<1>,1|C<4>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[5,6]C[6])	117.6930	0.021	2	117.6930	0.000	2	119.5242	4.174	56	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]O[5,6]C[5]C)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]HO)(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]O[5,6]C[5]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<2>,2|C<3>}	C[6](C[6]C[5,6]HO)(C[6]C[5,6]H)(H){1|C<4>,1|H<1>,1|O<2>,2|C<3>}	H(C[6]C[5,6]C[6])	119.2790	0.000	1	119.2790	0.000	1	119.5242	4.174	56	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]O[5,6]C[5]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,5,6]HO)(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]O[5,6]C[5]H)(C[6]C[6]H)(H){1|O<2>,2|C<4>,3|H<1>}	C[6](C[6]C[5,5,6]HO)(C[6]C[5,6]H)(H){1|H<1>,1|O<2>,3|C<4>}	H(C[6]C[5,6]C[6])	119.7890	0.000	1	119.7890	0.000	1	119.5242	4.174	56	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[5,6]O[5,6]C[5]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]HO)(C[6]C[5,6]H)(H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]O[5,6]C[5]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<2>,2|C<3>}	C[6](C[6]C[5,6]HO)(C[6]C[5,6]H)(H){1|O<2>,2|C<3>,2|H<1>}	H(C[6]C[5,6]C[6])	120.8050	0.000	1	120.8050	0.000	1	119.5242	4.174	56	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[3,5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[5,6]C[6,6]H)(C[6]C[3,5,6]H)(H)	C[6](C[3,5,6]C[3,5]C[5,6]C[3])(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6]C[6,6]H)(C[6]C[3,5,6]H)(H){1|H<1>,1|O<2>,6|C<4>}	C[6](C[3,5,6]C[3,5]C[5,6]C[3])(C[6]C[6,6]H)(H){4|H<1>,5|C<4>}	H(C[6]C[6,6]C[6])	118.6845	0.111	2	118.6660	0.005	5	118.7460	0.042	6	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[3,5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[5,6]C[6,6]H)(C[6]C[3,5,6]H)(H)	C[6](C[3,5,6]C[3,5]C[5,6]C[3])(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6]C[6,6]H)(C[6]C[3,5,6]H)(H){2|H<1>,6|C<4>}	C[6](C[3,5,6]C[3,5]C[5,6]C[3])(C[6]C[6,6]H)(H){4|H<1>,5|C<4>}	H(C[6]C[6,6]C[6])	118.6537	0.052	3	118.6660	0.005	5	118.7460	0.042	6	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[3,5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]2H)(C[6]C[3,5,6]H)(H)	C[6](C[3,5,6]C[3,5,6]C[3]C[5])(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2H)(C[6]C[3,5,6]H)(H){1|C<3>,7|C<4>}	C[6](C[3,5,6]C[3,5,6]C[3]C[5])(C[6]C[6,6]H)(H){4|H<1>,5|C<4>}	H(C[6]C[6,6]C[6])	119.1460	0.000	1	119.1460	0.000	1	118.7460	0.042	6	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[3,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[3,6]H)(H)	C[6](C[3,6]C[3,6,6]C[3,6]H)(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[3,6]H)(H){1|C<3>,1|O<1>,2|C<4>,2|H<1>}	C[6](C[3,6]C[3,6,6]C[3,6]H)(C[6]C[6,6]H)(H){2|H<1>,4|C<3>}	H(C[6]C[6,6]C[6])	123.7530	0.173	2	121.5374	1.940	14	120.9735	1.997	24	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[3,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[3,6]H)(H)	C[6](C[3,6]C[3,6,6]C[3,6]H)(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[3,6]H)(H){1|O<2>,2|C<3>,2|C<4>,2|H<1>}	C[6](C[3,6]C[3,6,6]C[3,6]H)(C[6]C[6,6]H)(H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6,6]C[6])	121.1682	1.117	12	121.5374	1.940	14	120.9735	1.997	24	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[3,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6a]C[6])(C[6]C[3,6]H)(H)	C[6](C[3,6]C[3,6,6]C[3,6]H)(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6a]C[6])(C[6]C[3,6]H)(H){1|O<2>,2|C<4>,2|H<1>,4|C<3>}	C[6](C[3,6]C[3,6,6]C[3,6]H)(C[6]C[6,6]H)(H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6,6]C[6])	120.1841	1.056	10	120.1841	1.114	10	120.9735	1.997	24	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[5,5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[5,6,6]O[6]H)(C[6]C[5,5,6]H)(H)	C[6](C[5,5,6]C[5,5]C[5,6]C[5])(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6,6]O[6]H)(C[6]C[5,5,6]H)(H){1|C<3>,1|O<2>,4|C<4>}	C[6](C[5,5,6]C[5,5]C[5,6]C[5])(C[6]C[6,6]H)(H){1|O<1>,1|O<2>,4|C<4>,4|H<1>}	H(C[6]C[6,6]C[6])	118.2340	0.000	1	118.2340	0.000	1	118.2340	0.000	1	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[5,6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]2H)(C[6]C[5,6,6]H)(H)	C[6](C[5,6,6]C[5,6,6]C[6,6]O[5])(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2H)(C[6]C[5,6,6]H)(H){1|O<2>,7|C<4>}	C[6](C[5,6,6]C[5,6,6]C[6,6]O[5])(C[6]C[6,6]H)(H){1|C<3>,2|H<1>,6|C<4>}	H(C[6]C[6,6]C[6])	117.9045	0.265	2	117.9045	0.070	2	118.2935	1.421	4	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[5,6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[5,6,6]H)(H)	C[6](C[5,6,6]C[5,5,6,6]C[5,6]H)(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[5,6,6]H)(H){1|O<2>,2|H<1>,5|C<4>}	C[6](C[5,6,6]C[5,5,6,6]C[5,6]H)(C[6]C[6,6]H)(H){1|O<2>,3|H<1>,4|C<4>}	H(C[6]C[6,6]C[6])	117.3430	0.000	1	117.3430	0.000	1	118.2935	1.421	4	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[5,6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[5,6,6]H)(H)	C[6](C[5,6,6]C[5,6,6]C[5]C[6])(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[5,6,6]H)(H){2|H<1>,6|C<4>}	C[6](C[5,6,6]C[5,6,6]C[5]C[6])(C[6]C[6,6]H)(H){1|O<2>,4|C<4>,6|H<1>}	H(C[6]C[6,6]C[6])	120.0220	0.000	1	120.0220	0.000	1	118.2935	1.421	4	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]2H)(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2H)(C[6]C[5,6]H)(H){2|C<3>,2|H<1>,3|C<4>}	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6,6]H)(H){1|O<2>,2|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6,6]C[6])	117.6280	0.092	2	117.6280	0.008	2	118.1457	0.507	14	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,5]C[5,6]H)(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[5,6]H)(H){4|C<4>,4|H<1>}	C[6](C[5,6]C[5,5]C[5,6]H)(C[6]C[6,6]H)(H){1|C<3>,2|H<1>,5|C<4>}	H(C[6]C[6,6]C[6])	118.0658	0.369	4	118.0658	0.136	4	118.1457	0.507	14	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,6]2H)(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[5,6]H)(H){4|C<4>,4|H<1>}	C[6](C[5,6]C[5,6]2H)(C[6]C[6,6]H)(H){1|C<3>,2|H<1>,5|C<4>}	H(C[6]C[6,6]C[6])	118.2500	0.000	1	118.2500	0.000	1	118.1457	0.507	14	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[5,6]H)(H){1|C<3>,3|C<4>,3|H<1>}	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6,6]H)(H){1|C<3>,1|O<2>,2|C<4>,4|H<1>}	H(C[6]C[6,6]C[6])	117.2390	0.000	1	117.7430	0.296	4	118.1457	0.507	14	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[5,6]H)(H){1|C<3>,3|C<4>,3|H<1>}	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6,6]H)(H){1|C<4>,1|O<2>,2|C<3>,4|H<1>}	H(C[6]C[6,6]C[6])	117.3330	0.000	1	117.7430	0.296	4	118.1457	0.507	14	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[5,6]H)(H){4|C<4>,4|H<1>}	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6,6]H)(H){1|O<2>,2|C<3>,2|H<1>,3|C<4>}	H(C[6]C[6,6]C[6])	118.2000	0.221	2	117.7430	0.296	4	118.1457	0.507	14	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,6a]C[5]C[6])(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[5,6]H)(H){2|C<3>,3|C<4>,3|H<1>}	C[6](C[5,6]C[5,6a]C[5]C[6])(C[6]C[6,6]H)(H){1|N<3>,1|O<1>,2|C<3>,2|C<4>,3|H<1>}	H(C[6]C[6,6]C[6])	118.3640	0.000	1	118.3640	0.000	1	118.1457	0.507	14	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]O[6]H)(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,6a]C[5,6]C)(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]O[6]H)(C[6]C[5,6]H)(H){1|C<3>,1|H<1>,1|O<2>,3|C<4>}	C[6](C[5,6]C[5,6a]C[5,6]C)(C[6]C[6,6]H)(H){1|C<4>,2|C<3>,2|H<1>,2|O<2>}	H(C[6]C[6,6]C[6])	119.9760	0.000	1	119.9760	0.000	1	118.1457	0.507	14	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]N[6,6]C[6]H)(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,6,6]C[5,6a]H)(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6]H)(C[6]C[5,6]H)(H){1|C<2>,1|C<3>,2|C<4>,3|H<1>}	C[6](C[5,6]C[5,6,6]C[5,6a]H)(C[6]C[6,6]H)(H){1|C<4>,2|C<3>,2|H<1>,2|N<3>}	H(C[6]C[6,6]C[6])	118.9590	0.000	1	118.9590	0.000	1	118.1457	0.507	14	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[5,6]-4:C[6]-3:I-1:	C[6]-3:	C[6](C[6,6]C[5,6,6]C[6]H)(C[6]C[5,6]I)(H)	C[6](C[5,6]C[5,6,6]C[5]H)(C[6]C[6,6]H)(I)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6,6]C[6]H)(C[6]C[5,6]I)(H){1|Br<1>,2|C<3>,2|C<4>,2|H<1>}	C[6](C[5,6]C[5,6,6]C[5]H)(C[6]C[6,6]H)(I){1|C<4>,1|O<2>,3|C<3>,3|H<1>}	H(C[6]C[6,6]C[6])	118.3790	1.936	2	118.7360	2.257	3	118.7360	2.257	3	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[5,6]-4:C[6]-3:I-1:	C[6]-3:	C[6](C[6,6]C[5,6,6]C[6]H)(C[6]C[5,6]I)(H)	C[6](C[5,6]C[5,6,6]C[5]H)(C[6]C[6,6]H)(I)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6,6]C[6]H)(C[6]C[5,6]I)(H){1|C<3>,3|C<4>,4|H<1>}	C[6](C[5,6]C[5,6,6]C[5]H)(C[6]C[6,6]H)(I){1|C<3>,1|O<2>,3|C<4>,3|H<1>}	H(C[6]C[6,6]C[6])	119.4500	0.000	1	118.7360	2.257	3	118.7360	2.257	3	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[3x6]C[6]H)(C[6]C[6,6]H)(H)	C[6](C[6,6]C[4x6]C[6,6]H)(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[3x6]C[6]H)(C[6]C[6,6]H)(H){1|C<3>,1|O<2>,2|C<4>,4|H<1>}	C[6](C[6,6]C[4x6]C[6,6]H)(C[6]C[6,6]H)(H){1|Cl<1>,2|H<1>,5|C<4>}	H(C[6]C[6,6]C[6])	119.0260	0.000	1	119.0260	0.000	1	118.2293	0.287	26	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[4x6]C[6,6]H)(C[6]C[6,6]H)(H)	C[6](C[6,6]C[3x6]C[6]H)(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[4x6]C[6,6]H)(C[6]C[6,6]H)(H){1|Cl<1>,2|H<1>,5|C<4>}	C[6](C[6,6]C[3x6]C[6]H)(C[6]C[6,6]H)(H){1|C<3>,1|O<2>,2|C<4>,4|H<1>}	H(C[6]C[6,6]C[6])	117.5700	0.000	1	117.5700	0.000	1	118.2293	0.287	26	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[5,6]C[6,6]H)(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6]C[6,6]H)(C[6]C[6,6]H)(H){1|C<3>,3|H<1>,4|C<4>}	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6,6]H)(H){3|H<1>,5|C<4>}	H(C[6]C[6,6]C[6])	118.1037	0.560	3	118.1955	0.243	4	118.2293	0.287	26	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[5,6]C[6,6]H)(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6]C[6,6]H)(C[6]C[6,6]H)(H){3|H<1>,5|C<4>}	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6,6]H)(H){3|H<1>,5|C<4>}	H(C[6]C[6,6]C[6])	118.4710	0.000	1	118.1955	0.243	4	118.2293	0.287	26	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[5,6]C[6,6]H)(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6]C[6]O)(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6]C[6,6]H)(C[6]C[6,6]H)(H){1|O<2>,2|H<1>,5|C<4>}	C[6](C[6,6]C[6,6]C[6]O)(C[6]C[6,6]H)(H){3|H<1>,5|C<4>}	H(C[6]C[6,6]C[6])	118.4515	0.110	2	118.4515	0.012	2	118.2293	0.287	26	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6,6a]C[6,6]C[6a])(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6,6a]C[6,6]C[6a])(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6,6a]C[6,6]C[6a])(C[6]C[6,6]H)(H){1|C<4>,1|H<1>,1|N<2>,6|C<3>}	C[6](C[6,6]C[6,6,6a]C[6,6]C[6a])(C[6]C[6,6]H)(H){1|C<4>,1|H<1>,1|N<2>,6|C<3>}	H(C[6]C[6,6]C[6])	118.7170	0.499	2	118.7170	0.249	2	118.2293	0.287	26	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]2C)(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2C)(C[6]C[6,6]H)(H){1|C<3>,6|C<4>}	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6,6]H)(H){1|C<3>,3|H<1>,4|C<4>}	H(C[6]C[6,6]C[6])	117.2540	0.000	1	117.2540	0.000	1	118.2293	0.287	26	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6]2C)(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6,6]H)(H){1|C<3>,3|H<1>,4|C<4>}	C[6](C[6,6]C[6,6]2C)(C[6]C[6,6]H)(H){1|C<3>,6|C<4>}	H(C[6]C[6,6]C[6])	117.5380	0.000	1	117.5380	0.000	1	118.2293	0.287	26	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6,6]H)(H)	C[6](C[6,6]C[5,6]C[6,6]H)(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6,6]H)(H){3|H<1>,5|C<4>}	C[6](C[6,6]C[5,6]C[6,6]H)(C[6]C[6,6]H)(H){1|C<3>,3|H<1>,4|C<4>}	H(C[6]C[6,6]C[6])	118.3823	0.118	3	118.3672	0.010	4	118.2293	0.287	26	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6,6]H)(H)	C[6](C[6,6]C[5,6]C[6,6]H)(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6,6]H)(H){3|H<1>,5|C<4>}	C[6](C[6,6]C[5,6]C[6,6]H)(C[6]C[6,6]H)(H){3|H<1>,5|C<4>}	H(C[6]C[6,6]C[6])	118.3220	0.000	1	118.3672	0.010	4	118.2293	0.287	26	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6,6]H)(H){1|C<3>,1|H<1>,6|C<4>}	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6,6]H)(H){1|O<2>,3|H<1>,4|C<4>}	H(C[6]C[6,6]C[6])	117.8070	0.000	1	118.0132	0.052	4	118.2293	0.287	26	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6,6]H)(H){1|O<2>,3|H<1>,4|C<4>}	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6,6]H)(H){1|C<3>,1|H<1>,6|C<4>}	H(C[6]C[6,6]C[6])	118.3360	0.000	1	118.0132	0.052	4	118.2293	0.287	26	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6,6]H)(H){2|C<3>,2|C<4>,4|H<1>}	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6,6]H)(H){2|C<3>,2|C<4>,4|H<1>}	H(C[6]C[6,6]C[6])	117.9550	0.033	2	118.0132	0.052	4	118.2293	0.287	26	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6a]C[6,6]H)(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6,6]H)(H){2|C<3>,2|C<4>,4|H<1>}	C[6](C[6,6]C[6,6a]C[6,6]H)(C[6]C[6,6]H)(H){2|C<3>,2|H<1>,3|C<4>}	H(C[6]C[6,6]C[6])	118.9510	0.000	1	118.9510	0.000	1	118.2293	0.287	26	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]O)(C[6]C[6,6]H)(H)	C[6](C[6,6]C[5,6]C[6,6]H)(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]O)(C[6]C[6,6]H)(H){3|H<1>,5|C<4>}	C[6](C[6,6]C[5,6]C[6,6]H)(C[6]C[6,6]H)(H){1|O<2>,2|H<1>,5|C<4>}	H(C[6]C[6,6]C[6])	117.5485	0.226	2	117.5485	0.051	2	118.2293	0.287	26	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6a]C[3x6]O)(C[6]C[6,6]H)(H)	C[6](C[6,6]O[6,6]N[6]H)(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]C[3x6]O)(C[6]C[6,6]H)(H){1|C<4>,1|H<1>,1|N<3>,1|O<2>,3|C<3>}	C[6](C[6,6]O[6,6]N[6]H)(C[6]C[6,6]H)(H){1|C<4>,1|H<1>,1|O<2>,2|C<3>}	H(C[6]C[6,6]C[6])	119.0080	0.000	1	119.0080	0.000	1	118.2293	0.287	26	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6a]C[6,6]H)(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]C[6,6]H)(C[6]C[6,6]H)(H){2|C<3>,2|H<1>,3|C<4>}	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6,6]H)(H){2|C<3>,2|C<4>,4|H<1>}	H(C[6]C[6,6]C[6])	117.9600	0.000	1	117.9600	0.000	1	118.2293	0.287	26	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]O[6,6]N[6]H)(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6a]C[3x6]O)(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]O[6,6]N[6]H)(C[6]C[6,6]H)(H){1|C<4>,1|H<1>,1|O<2>,2|C<3>}	C[6](C[6,6]C[6,6a]C[3x6]O)(C[6]C[6,6]H)(H){1|C<4>,1|H<1>,1|N<3>,1|O<2>,3|C<3>}	H(C[6]C[6,6]C[6])	118.9180	0.000	1	118.9180	0.000	1	118.2293	0.287	26	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[3,6,6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[3,6]HH)(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[3,6,6]C[6]C)(C[6]C[6]H)(H){3|C<4>,5|H<1>}	C[6](C[6]C[3,6]HH)(C[6]C[6,6]H)(H){1|H<1>,4|C<4>}	H(C[6]C[6,6]C[6])	116.9120	0.000	1	116.9120	0.000	1	118.6785	1.468	41	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[3x6]C[6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]C[6a]H)(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[3x6]C[6]H)(C[6]C[6]H)(H){2|C<3>,2|C<4>,4|H<1>}	C[6](C[6]C[6,6]C[6a]H)(C[6]C[6,6]H)(H){2|C<3>,2|H<1>,3|C<4>}	H(C[6]C[6,6]C[6])	117.5250	0.000	1	117.5250	0.000	1	118.6785	1.468	41	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[3x6]C[6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]HH)(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[3x6]C[6]H)(C[6]C[6]H)(H){2|C<3>,2|C<4>,4|H<1>}	C[6](C[6]C[6,6]HH)(C[6]C[6,6]H)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6,6]C[6])	117.8135	0.001	2	117.8135	0.000	2	118.6785	1.468	41	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[5,6,6]C[6,6]O)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]HH)(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6,6]C[6,6]O)(C[6]C[6]H)(H){1|C<3>,2|H<1>,5|C<4>}	C[6](C[6]C[5,6]HH)(C[6]C[6,6]H)(H){1|C<3>,2|C<4>,2|O<2>}	H(C[6]C[6,6]C[6])	117.0600	0.000	1	117.0600	0.000	1	118.6785	1.468	41	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[5,6,6]C[6,6a]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]HH)(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6,6]C[6,6a]H)(C[6]C[6]H)(H){1|C<4>,1|N<3>,2|C<3>,3|H<1>}	C[6](C[6]C[5,6]HH)(C[6]C[6,6]H)(H){1|Br<1>,1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6,6]C[6])	117.8440	0.000	1	117.9290	0.050	3	118.6785	1.468	41	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[5,6,6]C[6,6a]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]HH)(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6,6]C[6,6a]H)(C[6]C[6]H)(H){1|C<4>,3|C<3>,3|H<1>}	C[6](C[6]C[5,6]HH)(C[6]C[6,6]H)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6,6]C[6])	117.9715	0.299	2	117.9290	0.050	3	118.6785	1.468	41	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[5,6,6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]HO)(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6,6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|O<2>,2|C<4>,4|H<1>}	C[6](C[6]C[5,6]HO)(C[6]C[6,6]H)(H){1|O<2>,4|C<4>}	H(C[6]C[6,6]C[6])	120.1090	0.000	1	120.1090	0.000	1	118.6785	1.468	41	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[5,6,6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]N[5,6]HH)(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6,6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>,5|H<1>}	C[6](C[6]N[5,6]HH)(C[6]C[6,6]H)(H){4|C<4>}	H(C[6]C[6,6]C[6])	117.6330	0.000	1	118.1693	1.064	6	118.6785	1.468	41	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[5,6,6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]N[5,6]HH)(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6,6]C[6]C)(C[6]C[6]H)(H){1|N<3>,1|O<2>,2|C<4>,4|H<1>}	C[6](C[6]N[5,6]HH)(C[6]C[6,6]H)(H){4|C<4>}	H(C[6]C[6,6]C[6])	117.7905	0.287	4	118.1693	1.064	6	118.6785	1.468	41	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[5,6,6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]N[5,6]HH)(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6,6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|C<4>,5|H<1>}	C[6](C[6]N[5,6]HH)(C[6]C[6,6]H)(H){1|C<3>,3|C<4>}	H(C[6]C[6,6]C[6])	120.2210	0.000	1	118.1693	1.064	6	118.6785	1.468	41	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[5,6,6]C[6]O)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]HH)(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6,6]C[6]O)(C[6]C[6]H)(H){2|H<1>,6|C<4>}	C[6](C[6]C[5,6]HH)(C[6]C[6,6]H)(H){1|C<3>,2|C<4>,2|O<2>}	H(C[6]C[6,6]C[6])	116.9670	0.000	1	116.9670	0.000	1	118.6785	1.468	41	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]2H)(C[6]C[6]H)(H)	C[6](C[6]C[6]SiH)(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2H)(C[6]C[6]H)(H){1|Si<4>,1|C<3>,2|H<1>,4|C<4>}	C[6](C[6]C[6]SiH)(C[6]C[6,6]H)(H){2|C<4>,3|H<1>}	H(C[6]C[6,6]C[6])	117.4760	0.000	1	117.4760	0.000	1	118.6785	1.468	41	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]2O)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]OO)(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]2O)(C[6]C[6]H)(H){1|C<4>,2|C<3>,2|H<1>,2|O<2>}	C[6](C[6]C[6,6]OO)(C[6]C[6,6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6,6]C[6])	118.3500	0.000	1	118.3500	0.000	1	118.6785	1.468	41	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]HH)(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(H){1|O<1>,2|C<4>,4|H<1>}	C[6](C[6]C[6,6]HH)(C[6]C[6,6]H)(H){1|C<3>,4|C<4>}	H(C[6]C[6,6]C[6])	120.2200	0.000	1	119.6610	0.625	2	118.6785	1.468	41	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]HH)(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(H){1|O<1>,3|C<4>,3|H<1>}	C[6](C[6]C[6,6]HH)(C[6]C[6,6]H)(H){1|C<3>,4|C<4>}	H(C[6]C[6,6]C[6])	119.1020	0.000	1	119.6610	0.625	2	118.6785	1.468	41	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6]H)(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(H){1|O<2>,2|H<1>,4|C<3>}	C[6](C[6]C[6a]C[6]H)(C[6]C[6,6]H)(H){1|O<1>,2|C<4>,3|C<3>}	H(C[6]C[6,6]C[6])	122.6900	0.000	1	122.6900	0.000	1	118.6785	1.468	41	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]HH)(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H){4|C<4>,4|H<1>}	C[6](C[6]C[6,6]HH)(C[6]C[6,6]H)(H){2|H<1>,3|C<4>}	H(C[6]C[6,6]C[6])	118.8530	0.000	1	118.8530	0.000	1	118.6785	1.468	41	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]HO)(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,2|O<2>,4|H<1>}	C[6](C[6]C[6,6]HO)(C[6]C[6,6]H)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6,6]C[6])	118.4650	0.072	2	118.4650	0.005	2	118.6785	1.468	41	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6]H)(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H){1|C<3>,3|C<4>,4|H<1>}	C[6](C[6]C[6a]C[6]H)(C[6]C[6,6]H)(H){2|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6,6]C[6])	119.4550	0.000	1	118.3927	0.945	3	118.6785	1.468	41	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6]H)(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H){1|O<2>,2|C<3>,2|C<4>,3|H<1>}	C[6](C[6]C[6a]C[6]H)(C[6]C[6,6]H)(H){2|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6,6]C[6])	118.1760	0.000	1	118.3927	0.945	3	118.6785	1.468	41	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6]H)(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H){2|C<3>,2|C<4>,4|H<1>}	C[6](C[6]C[6a]C[6]H)(C[6]C[6,6]H)(H){2|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6,6]C[6])	117.5470	0.000	1	118.3927	0.945	3	118.6785	1.468	41	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]C[6a]C[6])(C[6]C[6]H)(H)	C[6](C[6]C[6]O[6]H)(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,1|O<1>,1|O<2>,2|C<4>,3|C<3>}	C[6](C[6]C[6]O[6]H)(C[6]C[6,6]H)(H){6|C<3>}	H(C[6]C[6,6]C[6])	120.0700	0.000	1	120.0700	0.000	1	118.6785	1.468	41	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]N[6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]HH)(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]N[6]H)(C[6]C[6]H)(H){1|C<4>,2|C<3>,4|H<1>}	C[6](C[6]C[6,6]HH)(C[6]C[6,6]H)(H){1|N<3>,2|C<4>,2|H<1>}	H(C[6]C[6,6]C[6])	119.1380	0.025	2	119.1163	0.012	4	118.6785	1.468	41	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]N[6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]HH)(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]N[6]H)(C[6]C[6]H)(H){1|S<4>,2|H<1>,4|C<4>}	C[6](C[6]C[6,6]HH)(C[6]C[6,6]H)(H){1|H<1>,1|N<3>,3|C<4>}	H(C[6]C[6,6]C[6])	119.0945	0.183	2	119.1163	0.012	4	118.6785	1.468	41	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]O[6]H)(C[6]C[6]H)(H)	C[6](C[6]N[5a]O[6]H)(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]O[6]H)(C[6]C[6]H)(H){1|N<3>,1|O<2>,2|C<4>,2|H<1>}	C[6](C[6]N[5a]O[6]H)(C[6]C[6,6]H)(H){1|C<4>,1|H<1>,1|O<2>,2|C<3>}	H(C[6]C[6,6]C[6])	120.4315	0.006	2	120.4315	0.000	2	118.6785	1.468	41	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]O[6]H)(C[6]C[6]H)(H)	C[6](C[6]N[6,6]HH)(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]O[6]H)(C[6]C[6]H)(H){1|C<3>,2|N<3>,3|H<1>}	C[6](C[6]N[6,6]HH)(C[6]C[6,6]H)(H){1|H<1>,1|O<2>,2|C<4>}	H(C[6]C[6,6]C[6])	119.9220	0.000	1	119.9220	0.000	1	118.6785	1.468	41	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]S[6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6]H)(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]S[6]H)(C[6]C[6]H)(H){1|C<3>,1|N<3>,2|C<4>,2|H<1>,2|O<1>}	C[6](C[6]C[6a]C[6]H)(C[6]C[6,6]H)(H){1|C<4>,1|S<4>,2|C<3>,3|H<1>}	H(C[6]C[6,6]C[6])	118.6295	0.012	2	118.6295	0.000	2	118.6785	1.468	41	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6]O[6]2)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]HO)(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6]O[6]2)(C[6]C[6]H)(H){1|O<2>,2|H<1>,4|C<4>}	C[6](C[6]C[5,6]HO)(C[6]C[6,6]H)(H){2|C<4>,3|O<2>}	H(C[6]C[6,6]C[6])	118.1395	0.858	2	118.1395	0.736	2	118.6785	1.468	41	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]N[6,6]C[6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]HO)(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6]H)(C[6]C[6]H)(H){1|O<2>,3|C<4>,3|H<1>}	C[6](C[6]C[6,6]HO)(C[6]C[6,6]H)(H){1|N<3>,2|C<4>,2|H<1>}	H(C[6]C[6,6]C[6])	118.9930	0.000	1	118.9930	0.000	1	118.6785	1.468	41	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]N[6,6]C[6]H)(C[6]C[6]H)(H)	C[6](C[6]N[6,6]HH)(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]N[6,6]C[6]H)(C[6]C[6]H)(H){1|C<3>,1|N<3>,1|O<2>,4|H<1>}	C[6](C[6]N[6,6]HH)(C[6]C[6,6]H)(H){1|H<1>,1|N<3>,2|C<4>}	H(C[6]C[6,6]C[6])	120.1670	0.000	1	120.1670	0.000	1	118.6785	1.468	41	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6,6]-4:C[6]-3:H-1:	P[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6a]C[6]2)(C[6]P[6]H)(H)	C[6](P[6]C[6,6a]C[6a]O)(C[6]C[6,6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]C[6]2)(C[6]P[6]H)(H){1|O<1>,2|C<4>,3|C<3>,4|H<1>}	C[6](P[6]C[6,6a]C[6a]O)(C[6]C[6,6]H)(H){2|C<4>,4|C<3>}	H(C[6]C[6,6]C[6])	115.4570	0.000	1	115.4570	0.000	1	115.4570	0.000	1	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	B[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CH)(C[6]B[6]H)(H)	C[6](B[6]C[6]N[6]Cl)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CH)(C[6]B[6]H)(H){1|Cl<1>,1|C<3>,1|H<1>,1|N<3>}	C[6](B[6]C[6]N[6]Cl)(C[6]C[6]H)(H){1|Si<4>,1|C<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	116.2080	0.000	1	116.2080	0.000	1	117.8167	1.960	3	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	B[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]B[6]H)(H)	C[6](B[6]C[6]N[5]2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]B[6]H)(H){1|C<3>,1|H<1>,2|N<3>}	C[6](B[6]C[6]N[5]2)(C[6]C[6]H)(H){1|Si<4>,2|H<1>,5|C<3>}	H(C[6]C[6]2)	118.6210	0.194	2	118.6210	0.038	2	117.8167	1.960	3	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[3,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]CH)(C[6]C[3,6]H)(H)	C[6](C[3,6]C[3,5,6]C[3,5]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]CH)(C[6]C[3,6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[3,6]C[3,5,6]C[3,5]H)(C[6]C[6]H)(H){1|O<2>,2|H<1>,3|C<4>}	H(C[6]C[6]2)	120.2610	0.000	1	120.2610	0.000	1	120.2610	0.000	1	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[3x6]-4:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[3x6]HH)(C[6]C[3x6]Br)(H)	C[6](C[3x6]C[4x6]O[6,6]C)(C[6]C[6]H)(Br)	H(C[6]C[6]2)	C[6](C[6]C[3x6]HH)(C[6]C[3x6]Br)(H){1|C<3>,1|H<1>,1|O<2>,2|C<4>}	C[6](C[3x6]C[4x6]O[6,6]C)(C[6]C[6]H)(Br){2|H<1>,4|C<4>}	H(C[6]C[6]2)	119.1193	0.112	3	119.1193	0.012	3	119.1193	0.012	3	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[3x6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]HO)(C[6]C[3x6]H)(H)	C[6](C[3x6]C[5,3x6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]HO)(C[6]C[3x6]H)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[3x6]C[5,3x6]C[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|N<3>,1|O<2>,2|H<1>,3|C<4>}	H(C[6]C[6]2)	119.4916	1.787	9	119.8572	4.246	17	119.8572	4.246	17	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[3x6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]HO)(C[6]C[3x6]H)(H)	C[6](C[3x6]C[5,3x6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]HO)(C[6]C[3x6]H)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[3x6]C[5,3x6]C[6,6]H)(C[6]C[6]H)(H){1|C<3>,1|N<4>,1|O<2>,2|H<1>,3|C<4>}	H(C[6]C[6]2)	120.2686	2.386	8	119.8572	4.246	17	119.8572	4.246	17	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[4,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]CH)(C[6]C[4,6]H)(H)	C[6](C[4,6]C[4,5,6]C[4]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]CH)(C[6]C[4,6]H)(H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[4,6]C[4,5,6]C[4]H)(C[6]C[6]H)(H){1|H<1>,1|O<1>,4|C<4>}	H(C[6]C[6]2)	117.9270	0.000	1	117.9270	0.000	1	117.9270	0.000	1	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[5,6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,5,6]HH)(C[6]C[5,6,6]H)(H)	C[6](C[5,6,6]C[5,6]O[5,6]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,5,6]HH)(C[6]C[5,6,6]H)(H){1|O<2>,4|C<4>}	C[6](C[5,6,6]C[5,6]O[5,6]C[6])(C[6]C[6]H)(H){1|C<3>,1|O<2>,3|C<4>,4|H<1>}	H(C[6]C[6]2)	119.7610	0.000	1	119.7610	0.000	1	118.4050	1.382	3	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[5,6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6,6]HO)(C[6]C[5,6,6]H)(H)	C[6](C[5,6,6]C[5,5,6,6]S[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6,6]HO)(C[6]C[5,6,6]H)(H){1|C<4>,1|N<3>,1|S<2>,2|H<1>}	C[6](C[5,6,6]C[5,5,6,6]S[5,6]H)(C[6]C[6]H)(H){1|H<1>,2|O<2>,3|C<4>}	H(C[6]C[6]2)	117.7270	0.072	2	117.7270	0.005	2	118.4050	1.382	3	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[3,5,6]HH)(C[6]C[5,6]H)(H)	C[6](C[5,6]C[3,5,5,6]N[5]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[3,5,6]HH)(C[6]C[5,6]H)(H){1|H<1>,2|C<4>,2|N<3>}	C[6](C[5,6]C[3,5,5,6]N[5]H)(C[6]C[6]H)(H){2|C<3>,2|H<1>,3|C<4>}	H(C[6]C[6]2)	117.9540	0.000	1	117.9540	0.000	1	118.8233	2.903	56	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[3,6]CH)(C[6]C[5,6]H)(H)	C[6](C[5,6]C[3,5,6]C[5]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[3,6]CH)(C[6]C[5,6]H)(H){2|H<1>,3|C<4>}	C[6](C[5,6]C[3,5,6]C[5]H)(C[6]C[6]H)(H){1|C<2>,3|H<1>,4|C<4>}	H(C[6]C[6]2)	117.9130	0.283	2	117.9130	0.080	2	118.8233	2.903	56	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[3,6]HH)(C[6]C[5,6]H)(H)	C[6](C[5,6]C[3,5,6]C[5]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[3,6]HH)(C[6]C[5,6]H)(H){1|H<1>,4|C<4>}	C[6](C[5,6]C[3,5,6]C[5]C)(C[6]C[6]H)(H){1|C<3>,2|C<4>,5|H<1>}	H(C[6]C[6]2)	119.8935	4.232	2	119.8935	17.910	2	118.8233	2.903	56	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[3]C[6]H)(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[3]C[6]H)(C[6]C[5,6]H)(H){1|C<3>,3|H<1>,4|C<4>}	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H){1|C<3>,1|O<2>,2|C<4>,4|H<1>}	H(C[6]C[6]2)	118.1590	1.884	2	117.6233	2.635	3	118.8233	2.903	56	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[3]C[6]H)(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[3]C[6]H)(C[6]C[5,6]H)(H){2|C<3>,2|H<1>,4|C<4>}	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H){1|C<3>,1|O<2>,2|C<4>,4|H<1>}	H(C[6]C[6]2)	116.5520	0.000	1	117.6233	2.635	3	118.8233	2.903	56	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,5,6,6]HO)(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,5,6]C[5]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,5,6,6]HO)(C[6]C[5,6]H)(H){1|H<1>,4|C<4>}	C[6](C[5,6]C[5,5,6]C[5]H)(C[6]C[6]H)(H){2|C<4>,3|H<1>,3|O<2>}	H(C[6]C[6]2)	121.5600	0.000	1	121.5600	0.000	1	118.8233	2.903	56	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,5,6]HO)(C[6]C[5,6]H)(H)	C[6](C[5,6]C[3x5,6]C[5]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,5,6]HO)(C[6]C[5,6]H)(H){1|H<1>,2|C<3>,2|C<4>}	C[6](C[5,6]C[3x5,6]C[5]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>,2|C<4>,2|N<3>}	H(C[6]C[6]2)	121.6860	0.000	1	121.6860	0.000	1	118.8233	2.903	56	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,5,6]HO)(C[6]C[5,6]H)(H)	C[6](C[5,6]O[5,6]C[5]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,5,6]HO)(C[6]C[5,6]H)(H){1|H<1>,1|O<2>,3|C<4>}	C[6](C[5,6]O[5,6]C[5]H)(C[6]C[6]H)(H){1|O<2>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	119.9900	0.000	1	119.9900	0.000	1	118.8233	2.903	56	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6,6]HO)(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,5,6,6]O[5]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6,6]HO)(C[6]C[5,6]H)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[5,6]C[5,5,6,6]O[5]H)(C[6]C[6]H)(H){1|O<2>,2|H<1>,3|C<4>}	H(C[6]C[6]2)	117.0380	0.000	1	117.0380	0.000	1	118.8233	2.903	56	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]BrH)(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]BrH)(C[6]C[5,6]H)(H){1|C<3>,1|C<4>,1|N<3>,2|H<1>}	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H){1|Br<1>,1|C<4>,1|N<3>,1|O<1>,3|H<1>}	H(C[6]C[6]2)	121.0500	0.000	1	121.0500	0.000	1	118.8233	2.903	56	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]CH)(C[6]C[5,6]H)(H)	C[6](C[5,6]C[3x5,6]C[5]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]CH)(C[6]C[5,6]H)(H){1|C<3>,1|H<1>,3|C<4>}	C[6](C[5,6]C[3x5,6]C[5]H)(C[6]C[6]H)(H){1|C<3>,1|O<2>,3|C<4>,3|H<1>}	H(C[6]C[6]2)	120.8850	0.000	1	120.8850	0.000	1	118.8233	2.903	56	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]CH)(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,5,6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]CH)(C[6]C[5,6]H)(H){1|C<3>,1|H<1>,1|O<2>,2|C<4>}	C[6](C[5,6]C[5,5,6]C[5,6]H)(C[6]C[6]H)(H){2|H<1>,3|C<3>,3|C<4>}	H(C[6]C[6]2)	119.9430	0.000	1	119.9430	0.000	1	118.8233	2.903	56	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]C[6a]H)(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C[6a]H)(C[6]C[5,6]H)(H){2|C<4>,2|H<1>,3|C<3>}	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H){1|C<3>,1|O<1>,2|H<1>,3|C<4>}	H(C[6]C[6]2)	118.2865	0.235	2	118.2865	0.055	2	118.8233	2.903	56	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]HH)(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,5,6]C[5]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]HH)(C[6]C[5,6]H)(H){1|H<1>,4|C<4>}	C[6](C[5,6]C[5,5,6]C[5]H)(C[6]C[6]H)(H){1|C<3>,1|O<2>,2|C<4>,4|H<1>}	H(C[6]C[6]2)	117.6430	0.000	1	117.8870	0.119	2	118.8233	2.903	56	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]HH)(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,5,6]C[5]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]HH)(C[6]C[5,6]H)(H){2|H<1>,3|C<4>}	C[6](C[5,6]C[5,5,6]C[5]H)(C[6]C[6]H)(H){1|C<3>,1|N<3>,2|C<2>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.1310	0.000	1	117.8870	0.119	2	118.8233	2.903	56	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]HH)(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,5,6]N[5]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]HH)(C[6]C[5,6]H)(H){1|N<3>,2|C<4>,2|H<1>}	C[6](C[5,6]C[5,5,6]N[5]H)(C[6]C[6]H)(H){1|C<3>,1|N<3>,1|S<4>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.3136	0.490	5	118.3136	0.240	5	118.8233	2.903	56	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]HH)(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,5,6]O[5]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]HH)(C[6]C[5,6]H)(H){1|C<3>,1|H<1>,1|O<2>,2|C<4>}	C[6](C[5,6]C[5,5,6]O[5]H)(C[6]C[6]H)(H){2|H<1>,4|C<4>}	H(C[6]C[6]2)	117.6360	0.000	1	117.6360	0.000	1	118.8233	2.903	56	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]HH)(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,6]C[5]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]HH)(C[6]C[5,6]H)(H){1|H<1>,2|C<3>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]C[6])(C[6]C[6]H)(H){1|C<3>,1|O<1>,2|C<4>,2|O<2>,4|H<1>}	H(C[6]C[6]2)	118.3530	0.000	1	118.3530	0.000	1	118.8233	2.903	56	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]HH)(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]HH)(C[6]C[5,6]H)(H){1|C<3>,1|C<4>,1|O<2>,2|H<1>}	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<2>,4|H<1>}	H(C[6]C[6]2)	114.6670	0.000	1	114.6670	0.000	1	118.8233	2.903	56	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]HO)(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,5,6]C[5]N)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]HO)(C[6]C[5,6]H)(H){1|H<1>,1|N<3>,1|O<2>,2|C<4>}	C[6](C[5,6]C[5,5,6]C[5]N)(C[6]C[6]H)(H){1|C<3>,1|O<2>,2|C<4>,4|H<1>}	H(C[6]C[6]2)	118.1150	0.000	1	118.1150	0.000	1	118.8233	2.903	56	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]HO)(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,5]O[5,6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]HO)(C[6]C[5,6]H)(H){1|C<2>,1|H<1>,1|O<2>,2|C<4>}	C[6](C[5,6]C[5,5]O[5,6]C)(C[6]C[6]H)(H){1|H<1>,1|O<2>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	119.2285	0.042	2	119.2285	0.002	2	118.8233	2.903	56	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]HO)(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,5]O[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]HO)(C[6]C[5,6]H)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[5,6]C[5,5]O[5,6]H)(C[6]C[6]H)(H){1|C<3>,1|H<1>,2|C<4>,2|O<2>}	H(C[6]C[6]2)	119.3060	0.000	1	119.3060	0.000	1	118.8233	2.903	56	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]HO)(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,6]C[5]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]HO)(C[6]C[5,6]H)(H){5|C<4>}	C[6](C[5,6]C[5,6]C[5]C)(C[6]C[6]H)(H){1|C<3>,1|O<2>,3|C<4>,3|H<1>}	H(C[6]C[6]2)	119.0650	0.000	1	119.0650	0.000	1	118.8233	2.903	56	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]HO)(C[6]C[5,6]H)(H)	C[6](C[5,6]O[5,6]C[5]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]HO)(C[6]C[5,6]H)(H){1|C<4>,1|H<1>,1|O<2>,2|C<3>}	C[6](C[5,6]O[5,6]C[5]C)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<2>,2|C<3>}	H(C[6]C[6]2)	119.5740	0.000	1	119.5740	0.000	1	118.8233	2.903	56	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]HO)(C[6]C[5,6]H)(H)	C[6](C[5,6]O[5,6]C[5]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]HO)(C[6]C[5,6]H)(H){1|O<2>,2|C<3>,2|H<1>}	C[6](C[5,6]O[5,6]C[5]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<2>,2|C<3>}	H(C[6]C[6]2)	119.0140	0.000	1	119.0140	0.000	1	118.8233	2.903	56	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]CC)(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,6,6]O[5]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]CC)(C[6]C[5,6]H)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[5,6]C[5,6,6]O[5]H)(C[6]C[6]H)(H){1|O<2>,5|C<4>}	H(C[6]C[6]2)	117.6065	0.193	2	117.6065	0.037	2	118.8233	2.903	56	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]HH)(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,6,6]C[5,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]HH)(C[6]C[5,6]H)(H){2|H<1>,3|C<4>}	C[6](C[5,6]C[5,6,6]C[5,6]H)(C[6]C[6]H)(H){1|O<2>,3|C<4>,4|H<1>}	H(C[6]C[6]2)	119.0640	0.000	1	119.0640	0.000	1	118.8233	2.903	56	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]HO)(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,6,6]C[5]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]HO)(C[6]C[5,6]H)(H){2|C<3>,3|C<4>}	C[6](C[5,6]C[5,6,6]C[5]C)(C[6]C[6]H)(H){1|O<1>,2|C<4>,2|H<1>,2|O<2>}	H(C[6]C[6]2)	117.7450	0.000	1	117.7450	0.000	1	118.8233	2.903	56	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]HO)(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,6,6]C[5]O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]HO)(C[6]C[5,6]H)(H){1|O<2>,4|C<4>}	C[6](C[5,6]C[5,6,6]C[5]O)(C[6]C[6]H)(H){2|C<4>,2|O<2>,4|H<1>}	H(C[6]C[6]2)	118.0430	0.000	1	118.0430	0.000	1	118.8233	2.903	56	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]SiH)(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,6,6]C[5]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]SiH)(C[6]C[5,6]H)(H){1|C<3>,1|H<1>,3|C<4>}	C[6](C[5,6]C[5,6,6]C[5]H)(C[6]C[6]H)(H){1|Si<4>,1|O<2>,2|C<4>,4|H<1>}	H(C[6]C[6]2)	117.9680	0.000	1	117.9680	0.000	1	118.8233	2.903	56	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]CH)(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,6a]C[6,6a]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]CH)(C[6]C[5,6]H)(H){4|C<3>}	C[6](C[5,6]C[5,6a]C[6,6a]C[5])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,1|O<1>,4|C<3>}	H(C[6]C[6]2)	118.2970	0.000	1	118.2970	0.000	1	118.8233	2.903	56	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]C[6]H)(C[6]C[5,6]H)(H)	C[6](C[5,6]C[6,6a]C[5,6]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C[6]H)(C[6]C[5,6]H)(H){1|C<4>,1|H<1>,5|C<3>}	C[6](C[5,6]C[6,6a]C[5,6]C[5])(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,1|O<1>,5|C<3>}	H(C[6]C[6]2)	124.6650	0.000	1	124.6650	0.000	1	118.8233	2.903	56	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]HN)(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,6a]C[6,6a]C[5])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]HN)(C[6]C[5,6]H)(H){4|C<3>}	C[6](C[5,6]C[5,6a]C[6,6a]C[5])(C[6]C[6]H)(H){1|H<1>,1|O<1>,2|N<3>,4|C<3>}	H(C[6]C[6]2)	118.4420	0.000	1	118.4420	0.000	1	118.8233	2.903	56	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]BrH)(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,6a]N[5,6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]BrH)(C[6]C[5,6]H)(H){1|C<3>,1|C<4>,1|N<3>,2|H<1>}	C[6](C[5,6]C[5,6a]N[5,6]C)(C[6]C[6]H)(H){1|Br<1>,1|C<4>,1|H<1>,1|S<4>,2|C<3>}	H(C[6]C[6]2)	118.6150	0.000	1	118.6150	0.000	1	118.8233	2.903	56	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]BrH)(C[6]C[5,6]H)(H)	C[6](C[5,6]C[6]N[5]2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]BrH)(C[6]C[5,6]H)(H){1|Br<1>,1|C<4>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[5,6]C[6]N[5]2)(C[6]C[6]H)(H){2|Br<1>,1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	118.3395	0.141	2	118.3395	0.020	2	118.8233	2.903	56	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]ClC)(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5]2C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]ClC)(C[6]C[5,6]H)(H){1|C<4>,1|H<1>,2|C<3>}	C[6](C[5,6]C[5]2C[6])(C[6]C[6]H)(H){1|Cl<1>,1|C<4>,1|N<3>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	121.2433	0.192	4	121.2433	0.037	4	118.8233	2.903	56	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6]H)(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]H)(C[6]C[5,6]H)(H){1|C<4>,2|H<1>,3|C<3>}	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H){1|C<4>,1|O<2>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	117.9710	0.000	1	117.6490	0.207	2	118.8233	2.903	56	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6]H)(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]H)(C[6]C[5,6]H)(H){2|C<4>,2|H<1>,3|C<3>}	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(H){1|C<4>,1|N<3>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	117.3270	0.000	1	117.6490	0.207	2	118.8233	2.903	56	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]HH)(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,5,6]C[5]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]HH)(C[6]C[5,6]H)(H){1|C<3>,3|C<4>}	C[6](C[5,6]C[5,5,6]C[5]C)(C[6]C[6]H)(H){1|N<3>,2|C<4>,5|H<1>}	H(C[6]C[6]2)	118.8220	0.041	2	118.8220	0.002	2	118.8233	2.903	56	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[5,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]HH)(C[6]C[5,6]H)(H)	C[6](C[5,6]C[5,6,6]C[5]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]HH)(C[6]C[5,6]H)(H){1|C<3>,1|H<1>,2|C<4>}	C[6](C[5,6]C[5,6,6]C[5]H)(C[6]C[6]H)(H){1|N<3>,2|C<4>,5|H<1>}	H(C[6]C[6]2)	117.3825	0.151	2	117.3825	0.023	2	118.8233	2.903	56	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[5,6]-4:C[6]-3:I-1:	C[6]-3:	C[6](C[6]C[6]ClH)(C[6]C[5,6]I)(H)	C[6](C[5,6]C[5,6]O[5]H)(C[6]C[6]H)(I)	H(C[6]C[6]2)	C[6](C[6]C[6]ClH)(C[6]C[5,6]I)(H){1|C<4>,2|H<1>,2|O<2>}	C[6](C[5,6]C[5,6]O[5]H)(C[6]C[6]H)(I){1|Cl<1>,1|O<2>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.4110	0.000	1	119.4110	0.000	1	119.4110	0.000	1	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[3,6]HH)(C[6]C[6,6]H)(H)	C[6](C[6,6]C[3,6,6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[3,6]HH)(C[6]C[6,6]H)(H){1|H<1>,4|C<4>}	C[6](C[6,6]C[3,6,6]C[6]C)(C[6]C[6]H)(H){3|C<4>,5|H<1>}	H(C[6]C[6]2)	117.3050	0.000	1	117.3050	0.000	1	118.2938	1.374	41	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]HH)(C[6]C[6,6]H)(H)	C[6](C[6,6]C[5,6,6]C[6,6]O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]HH)(C[6]C[6,6]H)(H){1|C<3>,2|C<4>,2|O<2>}	C[6](C[6,6]C[5,6,6]C[6,6]O)(C[6]C[6]H)(H){1|C<3>,2|H<1>,5|C<4>}	H(C[6]C[6]2)	117.4590	0.000	1	117.4590	0.000	1	118.2938	1.374	41	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]HH)(C[6]C[6,6]H)(H)	C[6](C[6,6]C[5,6,6]C[6,6a]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]HH)(C[6]C[6,6]H)(H){1|Br<1>,1|C<3>,1|H<1>,2|C<4>}	C[6](C[6,6]C[5,6,6]C[6,6a]H)(C[6]C[6]H)(H){1|C<4>,1|N<3>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	118.0320	0.000	1	117.6120	0.182	3	118.2938	1.374	41	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]HH)(C[6]C[6,6]H)(H)	C[6](C[6,6]C[5,6,6]C[6,6a]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]HH)(C[6]C[6,6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6,6]C[5,6,6]C[6,6a]H)(C[6]C[6]H)(H){1|C<4>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	117.4020	0.317	2	117.6120	0.182	3	118.2938	1.374	41	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]HH)(C[6]C[6,6]H)(H)	C[6](C[6,6]C[5,6,6]C[6]O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]HH)(C[6]C[6,6]H)(H){1|C<3>,2|C<4>,2|O<2>}	C[6](C[6,6]C[5,6,6]C[6]O)(C[6]C[6]H)(H){2|H<1>,6|C<4>}	H(C[6]C[6]2)	117.5630	0.000	1	117.5630	0.000	1	118.2938	1.374	41	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]HO)(C[6]C[6,6]H)(H)	C[6](C[6,6]C[5,6,6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]HO)(C[6]C[6,6]H)(H){1|O<2>,4|C<4>}	C[6](C[6,6]C[5,6,6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|O<2>,2|C<4>,4|H<1>}	H(C[6]C[6]2)	118.5280	0.000	1	118.5280	0.000	1	118.2938	1.374	41	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]HO)(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6]O[6]2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]HO)(C[6]C[6,6]H)(H){2|C<4>,3|O<2>}	C[6](C[6,6]C[6]O[6]2)(C[6]C[6]H)(H){1|O<2>,2|H<1>,4|C<4>}	H(C[6]C[6]2)	119.2490	0.745	2	119.2490	0.555	2	118.2938	1.374	41	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]C[6a]H)(C[6]C[6,6]H)(H)	C[6](C[6,6]C[3x6]C[6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]C[6a]H)(C[6]C[6,6]H)(H){2|C<3>,2|H<1>,3|C<4>}	C[6](C[6,6]C[3x6]C[6]H)(C[6]C[6]H)(H){2|C<3>,2|C<4>,4|H<1>}	H(C[6]C[6]2)	117.6630	0.000	1	117.6630	0.000	1	118.2938	1.374	41	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]HH)(C[6]C[6,6]H)(H)	C[6](C[6,6]C[3x6]C[6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]HH)(C[6]C[6,6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6,6]C[3x6]C[6]H)(C[6]C[6]H)(H){2|C<3>,2|C<4>,4|H<1>}	H(C[6]C[6]2)	117.9945	0.001	2	117.9945	0.000	2	118.2938	1.374	41	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]HH)(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]HH)(C[6]C[6,6]H)(H){1|C<3>,4|C<4>}	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(H){1|O<1>,2|C<4>,4|H<1>}	H(C[6]C[6]2)	115.7740	0.000	1	116.4100	0.809	2	118.2938	1.374	41	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]HH)(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]HH)(C[6]C[6,6]H)(H){1|C<3>,4|C<4>}	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(H){1|O<1>,3|C<4>,3|H<1>}	H(C[6]C[6]2)	117.0460	0.000	1	116.4100	0.809	2	118.2938	1.374	41	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]HH)(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]HH)(C[6]C[6,6]H)(H){2|H<1>,3|C<4>}	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H){4|C<4>,4|H<1>}	H(C[6]C[6]2)	118.5060	0.000	1	118.5060	0.000	1	118.2938	1.374	41	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]HH)(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6]N[6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]HH)(C[6]C[6,6]H)(H){1|H<1>,1|N<3>,3|C<4>}	C[6](C[6,6]C[6,6]N[6]H)(C[6]C[6]H)(H){1|S<4>,2|H<1>,4|C<4>}	H(C[6]C[6]2)	118.6130	0.003	2	118.3777	0.075	4	118.2938	1.374	41	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]HH)(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6]N[6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]HH)(C[6]C[6,6]H)(H){1|N<3>,2|C<4>,2|H<1>}	C[6](C[6,6]C[6,6]N[6]H)(C[6]C[6]H)(H){1|C<4>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	118.1425	0.064	2	118.3777	0.075	4	118.2938	1.374	41	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]HO)(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]HO)(C[6]C[6,6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,2|O<2>,4|H<1>}	H(C[6]C[6]2)	118.2330	0.272	2	118.2330	0.074	2	118.2938	1.374	41	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]HO)(C[6]C[6,6]H)(H)	C[6](C[6,6]N[6,6]C[6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]HO)(C[6]C[6,6]H)(H){1|N<3>,2|C<4>,2|H<1>}	C[6](C[6,6]N[6,6]C[6]H)(C[6]C[6]H)(H){1|O<2>,3|C<4>,3|H<1>}	H(C[6]C[6]2)	119.2230	0.000	1	119.2230	0.000	1	118.2938	1.374	41	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]OO)(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6]2O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]OO)(C[6]C[6,6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|N<3>,1|O<2>}	C[6](C[6,6]C[6,6]2O)(C[6]C[6]H)(H){1|C<4>,2|C<3>,2|H<1>,2|O<2>}	H(C[6]C[6]2)	118.4530	0.000	1	118.4530	0.000	1	118.2938	1.374	41	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]O[6]H)(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6]C[6a]C[6])(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]O[6]H)(C[6]C[6,6]H)(H){6|C<3>}	C[6](C[6,6]C[6,6]C[6a]C[6])(C[6]C[6]H)(H){1|H<1>,1|O<1>,1|O<2>,2|C<4>,3|C<3>}	H(C[6]C[6]2)	119.3490	0.000	1	119.3490	0.000	1	118.2938	1.374	41	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]SiH)(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6]2H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]SiH)(C[6]C[6,6]H)(H){2|C<4>,3|H<1>}	C[6](C[6,6]C[6,6]2H)(C[6]C[6]H)(H){1|Si<4>,1|C<3>,2|H<1>,4|C<4>}	H(C[6]C[6]2)	117.5570	0.000	1	117.5570	0.000	1	118.2938	1.374	41	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6]H)(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]H)(C[6]C[6,6]H)(H){1|O<1>,2|C<4>,3|C<3>}	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(H){1|O<2>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	123.9300	0.000	1	123.9300	0.000	1	118.2938	1.374	41	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6]H)(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]H)(C[6]C[6,6]H)(H){2|C<4>,2|H<1>,3|C<3>}	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H){1|C<3>,3|C<4>,4|H<1>}	H(C[6]C[6]2)	119.9170	0.000	1	118.6180	1.267	3	118.2938	1.374	41	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6]H)(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]H)(C[6]C[6,6]H)(H){2|C<4>,2|H<1>,3|C<3>}	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H){1|O<2>,2|C<3>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	117.9270	0.000	1	118.6180	1.267	3	118.2938	1.374	41	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6]H)(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]H)(C[6]C[6,6]H)(H){2|C<4>,2|H<1>,3|C<3>}	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(H){2|C<3>,2|C<4>,4|H<1>}	H(C[6]C[6]2)	118.0100	0.000	1	118.6180	1.267	3	118.2938	1.374	41	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6]H)(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6]S[6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]H)(C[6]C[6,6]H)(H){1|C<4>,1|S<4>,2|C<3>,3|H<1>}	C[6](C[6,6]C[6,6]S[6]H)(C[6]C[6]H)(H){1|C<3>,1|N<3>,2|C<4>,2|H<1>,2|O<1>}	H(C[6]C[6]2)	117.5615	0.243	2	117.5615	0.059	2	118.2938	1.374	41	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]HH)(C[6]C[6,6]H)(H)	C[6](C[6,6]C[5,6,6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]HH)(C[6]C[6,6]H)(H){1|C<3>,3|C<4>}	C[6](C[6,6]C[5,6,6]C[6]C)(C[6]C[6]H)(H){1|N<3>,2|C<4>,5|H<1>}	H(C[6]C[6]2)	117.9760	0.000	1	118.2173	0.205	6	118.2938	1.374	41	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]HH)(C[6]C[6,6]H)(H)	C[6](C[6,6]C[5,6,6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]HH)(C[6]C[6,6]H)(H){4|C<4>}	C[6](C[6,6]C[5,6,6]C[6]C)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>,5|H<1>}	H(C[6]C[6]2)	118.8590	0.000	1	118.2173	0.205	6	118.2938	1.374	41	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]HH)(C[6]C[6,6]H)(H)	C[6](C[6,6]C[5,6,6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]HH)(C[6]C[6,6]H)(H){4|C<4>}	C[6](C[6,6]C[5,6,6]C[6]C)(C[6]C[6]H)(H){1|N<3>,1|O<2>,2|C<4>,4|H<1>}	H(C[6]C[6]2)	118.1172	0.415	4	118.2173	0.205	6	118.2938	1.374	41	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5a]O[6]H)(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6]O[6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5a]O[6]H)(C[6]C[6,6]H)(H){1|C<4>,1|H<1>,1|O<2>,2|C<3>}	C[6](C[6,6]C[6,6]O[6]H)(C[6]C[6]H)(H){1|N<3>,1|O<2>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.4535	0.313	2	118.4535	0.098	2	118.2938	1.374	41	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]HH)(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6]O[6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]HH)(C[6]C[6,6]H)(H){1|H<1>,1|O<2>,2|C<4>}	C[6](C[6,6]C[6,6]O[6]H)(C[6]C[6]H)(H){1|C<3>,2|N<3>,3|H<1>}	H(C[6]C[6]2)	118.6500	0.000	1	118.6500	0.000	1	118.2938	1.374	41	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]HH)(C[6]C[6,6]H)(H)	C[6](C[6,6]N[6,6]C[6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]HH)(C[6]C[6,6]H)(H){1|H<1>,1|N<3>,2|C<4>}	C[6](C[6,6]N[6,6]C[6]H)(C[6]C[6]H)(H){1|C<3>,1|N<3>,1|O<2>,4|H<1>}	H(C[6]C[6]2)	118.5530	0.000	1	118.5530	0.000	1	118.2938	1.374	41	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[3,6]HO)(C[6]C[6]Br)(H)	C[6](C[6]C[3,6]HO)(C[6]C[6]H)(Br)	H(C[6]C[6]2)	C[6](C[6]C[3,6]HO)(C[6]C[6]Br)(H){1|C<4>,2|H<1>,2|O<2>}	C[6](C[6]C[3,6]HO)(C[6]C[6]H)(Br){1|C<4>,2|H<1>,2|O<2>}	H(C[6]C[6]2)	122.1530	0.000	1	122.1530	0.000	1	119.8009	2.484	14	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[5,6]CH)(C[6]C[6]Br)(H)	C[6](C[6]C[5,6]HN)(C[6]C[6]H)(Br)	H(C[6]C[6]2)	C[6](C[6]C[5,6]CH)(C[6]C[6]Br)(H){1|C<3>,1|C<4>,1|N<2>,2|H<1>}	C[6](C[6]C[5,6]HN)(C[6]C[6]H)(Br){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	120.7910	0.000	1	120.7910	0.000	1	119.8009	2.484	14	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]Br)(H)	C[6](C[6]C[6]HN)(C[6]C[6]H)(Br)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]Br)(H){1|C<4>,1|N<3>,1|O<2>,2|H<1>}	C[6](C[6]C[6]HN)(C[6]C[6]H)(Br){1|C<4>,4|H<1>}	H(C[6]C[6]2)	119.0765	1.159	2	119.4142	2.213	6	119.8009	2.484	14	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]Br)(H)	C[6](C[6]C[6]HN)(C[6]C[6]H)(Br)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]Br)(H){1|C<4>,1|N<3>,3|H<1>}	C[6](C[6]C[6]HN)(C[6]C[6]H)(Br){1|C<4>,4|H<1>}	H(C[6]C[6]2)	119.5830	1.768	4	119.4142	2.213	6	119.8009	2.484	14	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]Br)(H)	C[6](C[6]C[6]HO)(C[6]C[6]H)(Br)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]Br)(H){1|C<4>,2|H<1>,2|O<2>}	C[6](C[6]C[6]HO)(C[6]C[6]H)(Br){1|C<4>,4|H<1>}	H(C[6]C[6]2)	119.1900	0.000	1	119.1900	0.000	1	119.8009	2.484	14	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6]HO)(C[6]C[6]Br)(H)	C[6](C[6]C[6]HO)(C[6]C[6]H)(Br)	H(C[6]C[6]2)	C[6](C[6]C[6]HO)(C[6]C[6]Br)(H){1|C<4>,2|H<1>,2|O<2>}	C[6](C[6]C[6]HO)(C[6]C[6]H)(Br){1|C<4>,1|I<1>,1|O<2>,2|H<1>}	H(C[6]C[6]2)	118.9335	0.599	4	118.9335	0.359	4	119.8009	2.484	14	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]N[6]CH)(C[6]C[6]Br)(H)	C[6](C[6]O[6]HN)(C[6]C[6]H)(Br)	H(C[6]C[6]2)	C[6](C[6]N[6]CH)(C[6]C[6]Br)(H){1|C<3>,1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]O[6]HN)(C[6]C[6]H)(Br){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	122.8600	0.000	1	122.8600	0.000	1	119.8009	2.484	14	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[3,6]HO)(C[6]C[6]Cl)(H)	C[6](C[6]C[3,6]HO)(C[6]C[6]H)(Cl)	H(C[6]C[6]2)	C[6](C[6]C[3,6]HO)(C[6]C[6]Cl)(H){1|C<4>,2|H<1>,2|O<2>}	C[6](C[6]C[3,6]HO)(C[6]C[6]H)(Cl){1|C<4>,2|H<1>,2|O<2>}	H(C[6]C[6]2)	119.6500	0.000	1	119.6500	0.000	1	119.2844	3.475	5	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]CH)(C[6]C[6]Cl)(H)	C[6](C[6]C[6]CC)(C[6]C[6]H)(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]CH)(C[6]C[6]Cl)(H){1|C<3>,1|O<1>,2|C<4>}	C[6](C[6]C[6]CC)(C[6]C[6]H)(Cl){1|C<4>,1|H<1>,1|N<2>,2|C<3>}	H(C[6]C[6]2)	117.8230	0.000	1	117.8230	0.000	1	119.2844	3.475	5	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]C[6]ClC)(C[6]C[6]Cl)(H)	C[6](C[6]C[6]ClH)(C[6]C[6]H)(Cl)	H(C[6]C[6]2)	C[6](C[6]C[6]ClC)(C[6]C[6]Cl)(H){1|Cl<1>,1|C<4>,1|H<1>,1|O<1>}	C[6](C[6]C[6]ClH)(C[6]C[6]H)(Cl){3|Cl<1>,1|C<3>,1|C<4>}	H(C[6]C[6]2)	117.9520	0.000	1	117.9520	0.000	1	119.2844	3.475	5	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]N[5a,6]CH)(C[6]C[6]Cl)(H)	C[6](C[6]N[5a,6]HN)(C[6]C[6]H)(Cl)	H(C[6]C[6]2)	C[6](C[6]N[5a,6]CH)(C[6]C[6]Cl)(H){1|C<3>,1|H<1>,2|N<3>}	C[6](C[6]N[5a,6]HN)(C[6]C[6]H)(Cl){1|C<3>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	122.3570	0.000	1	122.3570	0.000	1	119.2844	3.475	5	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:Cl-1:	C[6]-3:	C[6](C[6]N[6]HH)(C[6]C[6]Cl)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(Cl)	H(C[6]C[6]2)	C[6](C[6]N[6]HH)(C[6]C[6]Cl)(H){1|C<4>,1|S<4>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(Cl){1|N<3>,4|H<1>}	H(C[6]C[6]2)	118.6400	0.000	1	118.6400	0.000	1	119.2844	3.475	5	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:F-1:	C[6]-3:	C[6](C[6]S[6]HH)(C[6]C[6]F)(H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(F)	H(C[6]C[6]2)	C[6](C[6]S[6]HH)(C[6]C[6]F)(H){1|H<1>,2|C<4>,2|O<1>}	C[6](C[6]C[6]CH)(C[6]C[6]H)(F){1|S<4>,4|H<1>}	H(C[6]C[6]2)	117.5180	0.000	1	117.5180	0.000	1	117.5180	0.000	1	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]B[6,6]HH)(C[6]C[6]H)(H)	C[6](C[6]N[6,6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]B[6,6]HH)(C[6]C[6]H)(H){1|C<4>,1|N<4>,1|O<2>,2|H<1>}	C[6](C[6]N[6,6]HH)(C[6]C[6]H)(H){1|B<4>,1|C<4>,3|H<1>}	H(C[6]C[6]2)	117.8937	0.257	4	117.8937	0.066	4	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]B[6]HH)(C[6]C[6]H)(H)	C[6](C[6]N[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]B[6]HH)(C[6]C[6]H)(H){2|H<1>,2|N<3>}	C[6](C[6]N[6]HH)(C[6]C[6]H)(H){1|B<3>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	118.4075	0.202	2	118.4075	0.041	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[3,5,5,6,6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[3x5,6,6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[3,5,5,6,6]HH)(C[6]C[6]H)(H){2|H<1>,3|C<4>}	C[6](C[6]C[3x5,6,6]HH)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.0265	0.175	2	118.0265	0.031	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[3,5,6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[3,5,6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[3,5,6]HH)(C[6]C[6]H)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[6]C[3,5,6]HH)(C[6]C[6]H)(H){1|O<2>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	117.5030	0.263	2	117.5030	0.069	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[3,6,6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[3,6,6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[3,6,6]HH)(C[6]C[6]H)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[6]C[3,6,6]HH)(C[6]C[6]H)(H){1|O<2>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	117.6610	0.171	2	117.6610	0.029	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[3,6]C[6a]H)(C[6]C[6]H)(H)	C[6](C[6]N[3,6]C[6a]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[3,6]C[6a]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,4|C<3>}	C[6](C[6]N[3,6]C[6a]H)(C[6]C[6]H)(H){1|H<1>,2|C<4>,3|C<3>}	H(C[6]C[6]2)	119.5600	0.000	1	119.5600	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[3,6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[3,6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[3,6]HH)(C[6]C[6]H)(H){1|C<4>,1|N<3>,3|H<1>}	C[6](C[6]C[3,6]HH)(C[6]C[6]H)(H){1|N<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	117.7080	0.000	1	119.3220	1.183	8	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[3,6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[3,6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[3,6]HH)(C[6]C[6]H)(H){1|N<3>,2|C<4>,2|H<1>}	C[6](C[6]C[3,6]HH)(C[6]C[6]H)(H){1|C<4>,1|N<3>,3|H<1>}	H(C[6]C[6]2)	117.5620	0.000	1	119.3220	1.183	8	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[3,6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[3,6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[3,6]HH)(C[6]C[6]H)(H){2|C<4>,3|H<1>}	C[6](C[6]C[3,6]HH)(C[6]C[6]H)(H){2|C<4>,3|H<1>}	H(C[6]C[6]2)	119.8843	0.368	6	119.3220	1.183	8	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[3,6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[3,6]HO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[3,6]HH)(C[6]C[6]H)(H){1|C<4>,2|H<1>,2|O<2>}	C[6](C[6]C[3,6]HO)(C[6]C[6]H)(H){1|C<4>,1|O<2>,3|H<1>}	H(C[6]C[6]2)	116.3190	0.000	1	116.3190	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[3,6]HO)(C[6]C[6]H)(H)	C[6](C[6]C[3,6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[3,6]HO)(C[6]C[6]H)(H){1|C<4>,1|O<2>,3|H<1>}	C[6](C[6]C[3,6]HH)(C[6]C[6]H)(H){1|C<4>,2|H<1>,2|O<2>}	H(C[6]C[6]2)	120.1840	0.000	1	120.1840	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[3x3,3x5,13x6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[3x3,3x5,13x6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[3x3,3x5,13x6]HH)(C[6]C[6]H)(H){1|Ru<8>,1|C<6>,2|H<1>,3|B<6>}	C[6](C[6]C[3x3,3x5,13x6]HH)(C[6]C[6]H)(H){1|Ru<8>,1|C<6>,2|H<1>,3|B<6>}	H(C[6]C[6]2)	116.6148	0.095	4	116.6148	0.009	4	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[3x5,6,6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[3,5,5,6,6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[3x5,6,6]HH)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[3,5,5,6,6]HH)(C[6]C[6]H)(H){2|H<1>,3|C<4>}	H(C[6]C[6]2)	117.8420	0.598	2	117.8420	0.358	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[3x6]CC)(C[6]C[6]H)(H)	C[6](C[6]C[4x6]N[5a]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[3x6]CC)(C[6]C[6]H)(H){1|N<3>,2|C<4>,2|H<1>}	C[6](C[6]C[4x6]N[5a]H)(C[6]C[6]H)(H){1|C<3>,1|N<2>,5|C<4>}	H(C[6]C[6]2)	117.0930	0.000	1	117.0930	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[3x6]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[3x6]C[6]C)(C[6]C[6]H)(H){1|O<1>,2|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<3>,4|C<4>}	H(C[6]C[6]2)	117.4855	0.100	2	117.4855	0.010	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[3x6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[4x6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[3x6]HH)(C[6]C[6]H)(H){2|C<4>,3|H<1>}	C[6](C[6]C[4x6]HH)(C[6]C[6]H)(H){1|C<4>,2|H<1>,2|O<2>}	H(C[6]C[6]2)	105.5750	0.000	1	105.5750	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[3x6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[3x6]HH)(C[6]C[6]H)(H){2|H<1>,3|C<4>}	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H){1|O<2>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	117.8000	0.000	1	117.8000	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[4]C[6]H)(C[6]C[6]H)(H)	C[6](C[6]N[6]CH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[4]C[6]H)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>,2|C<3>,2|C<4>}	C[6](C[6]N[6]CH)(C[6]C[6]H)(H){1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	120.3960	0.000	1	120.3960	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[4]N[6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[4]N[6]H)(C[6]C[6]H)(H){1|H<1>,3|C<3>,3|C<4>}	C[6](C[6]C[6]CH)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,1|O<1>}	H(C[6]C[6]2)	120.4420	0.000	1	120.4420	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[4x6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[3x6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[4x6]HH)(C[6]C[6]H)(H){1|C<4>,2|H<1>,2|O<2>}	C[6](C[6]C[3x6]HH)(C[6]C[6]H)(H){2|C<4>,3|H<1>}	H(C[6]C[6]2)	111.1010	0.000	1	111.1010	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[4x6]N[5a]H)(C[6]C[6]H)(H)	C[6](C[6]C[3x6]CC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[4x6]N[5a]H)(C[6]C[6]H)(H){1|C<3>,1|N<2>,5|C<4>}	C[6](C[6]C[3x6]CC)(C[6]C[6]H)(H){1|N<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	117.4540	0.000	1	117.4540	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,3x6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[5,3x6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,3x6]HH)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[5,3x6]HH)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	120.9195	0.355	8	120.9195	0.126	8	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,5,6,6]CH)(C[6]C[6]H)(H)	C[6](C[6]C[5,6,6]HO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,5,6,6]CH)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>,2|C<4>}	C[6](C[6]C[5,6,6]HO)(C[6]C[6]H)(H){1|O<2>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	116.9805	0.289	2	116.9805	0.084	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,5,6,6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[5,5,6,6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,5,6,6]HH)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[5,5,6,6]HH)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.7050	0.066	2	119.7050	0.004	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,5,6,6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[5,6,6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,5,6,6]HH)(C[6]C[6]H)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6,6]HH)(C[6]C[6]H)(H){1|F<1>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	117.9850	0.000	1	118.0430	0.007	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,5,6,6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[5,6,6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,5,6,6]HH)(C[6]C[6]H)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6,6]HH)(C[6]C[6]H)(H){1|O<2>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.1010	0.000	1	118.0430	0.007	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,5,6,6]HO)(C[6]C[6]H)(H)	C[6](C[6]C[5,6,6]CH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,5,6,6]HO)(C[6]C[6]H)(H){1|C<3>,1|H<1>,3|C<4>}	C[6](C[6]C[5,6,6]CH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<2>,2|H<1>}	H(C[6]C[6]2)	117.5286	0.292	8	117.5286	0.085	8	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,5,6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[5,5,6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,5,6]HH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<2>,2|H<1>}	C[6](C[6]C[5,5,6]HH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<2>,2|H<1>}	H(C[6]C[6]2)	120.5570	0.000	1	120.4685	0.016	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,5,6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[5,5,6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,5,6]HH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<2>,2|H<1>}	C[6](C[6]C[5,5,6]HH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<2>,2|H<1>}	H(C[6]C[6]2)	120.3800	0.000	1	120.4685	0.016	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,5,6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,5,6]HH)(C[6]C[6]H)(H){2|H<1>,3|C<4>}	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,3|H<1>}	H(C[6]C[6]2)	117.5040	0.000	1	117.5040	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6,6]CH)(C[6]C[6]H)(H)	C[6](C[6]C[5,5,6,6]HO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6,6]CH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<2>,2|H<1>}	C[6](C[6]C[5,5,6,6]HO)(C[6]C[6]H)(H){1|C<3>,1|H<1>,3|C<4>}	H(C[6]C[6]2)	117.0614	0.208	8	117.0614	0.043	8	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6,6]C[6a]O)(C[6]C[6]H)(H)	C[6](C[6]C[5,6,6]C[6a]O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6,6]C[6a]O)(C[6]C[6]H)(H){1|C<4>,1|O<2>,4|C<3>}	C[6](C[6]C[5,6,6]C[6a]O)(C[6]C[6]H)(H){1|C<4>,1|O<2>,4|C<3>}	H(C[6]C[6]2)	117.4715	0.033	2	117.4715	0.001	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6,6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[5,5,6,6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6,6]HH)(C[6]C[6]H)(H){1|F<1>,2|C<4>,2|H<1>}	C[6](C[6]C[5,5,6,6]HH)(C[6]C[6]H)(H){1|O<2>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.2410	0.000	1	118.3070	0.009	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6,6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[5,5,6,6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6,6]HH)(C[6]C[6]H)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[6]C[5,5,6,6]HH)(C[6]C[6]H)(H){1|O<2>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.3730	0.000	1	118.3070	0.009	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6,6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[5,6,6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6,6]HH)(C[6]C[6]H)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6,6]HH)(C[6]C[6]H)(H){1|O<2>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	120.5245	0.084	2	121.5212	1.256	8	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6,6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[5,6,6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6,6]HH)(C[6]C[6]H)(H){2|C<4>,3|H<1>}	C[6](C[6]C[5,6,6]HH)(C[6]C[6]H)(H){2|C<4>,3|H<1>}	H(C[6]C[6]2)	122.3517	1.016	4	121.5212	1.256	8	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6,6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[5,6,6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6,6]HH)(C[6]C[6]H)(H){2|H<1>,3|C<4>}	C[6](C[6]C[5,6,6]HH)(C[6]C[6]H)(H){2|H<1>,3|C<4>}	H(C[6]C[6]2)	120.8570	0.249	2	121.5212	1.256	8	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6,6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]CC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6,6]HH)(C[6]C[6]H)(H){5|C<4>}	C[6](C[6]C[5,6]CC)(C[6]C[6]H)(H){1|C<4>,1|O<2>,3|H<1>}	H(C[6]C[6]2)	117.4520	0.000	1	117.4520	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6,6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6,6]HH)(C[6]C[6]H)(H){2|H<1>,3|C<4>}	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H){1|O<2>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	117.8517	0.162	3	118.9959	1.154	7	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6,6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6,6]HH)(C[6]C[6]H)(H){2|H<1>,3|C<4>}	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H){2|C<4>,3|H<1>}	H(C[6]C[6]2)	119.8540	0.016	4	118.9959	1.154	7	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6,6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6,6]HH)(C[6]C[6]H)(H){1|N<3>,2|C<4>,2|H<1>}	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H){2|C<4>,3|H<1>}	H(C[6]C[6]2)	118.1550	0.000	1	118.1550	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6,6]HO)(C[6]C[6]H)(H)	C[6](C[6]C[5,5,6,6]CH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6,6]HO)(C[6]C[6]H)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[6]C[5,5,6,6]CH)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>,2|C<4>}	H(C[6]C[6]2)	117.7625	0.172	2	117.7625	0.030	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6,6]HO)(C[6]C[6]H)(H)	C[6](C[6]C[5,6,6]HO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6,6]HO)(C[6]C[6]H)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6,6]HO)(C[6]C[6]H)(H){1|O<2>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	120.6755	2.521	8	120.6755	6.354	8	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]B[5]C)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]C[6a]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]B[5]C)(C[6]C[6]H)(H){1|C<4>,2|C<3>,2|H<1>,2|O<2>}	C[6](C[6]C[5,6]C[6a]H)(C[6]C[6]H)(H){1|B<3>,1|H<1>,2|C<4>,3|C<3>}	H(C[6]C[6]2)	120.1865	0.081	2	120.1865	0.007	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]CC)(C[6]C[6]H)(H)	C[6](C[6]C[5,6,6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]CC)(C[6]C[6]H)(H){1|C<4>,1|O<2>,3|H<1>}	C[6](C[6]C[5,6,6]HH)(C[6]C[6]H)(H){5|C<4>}	H(C[6]C[6]2)	116.9800	0.000	1	116.9800	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]CC)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]CC)(C[6]C[6]H)(H){1|C<3>,1|C<4>,2|H<1>}	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H){2|C<3>,2|C<4>}	H(C[6]C[6]2)	116.8510	0.000	1	116.8510	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]CH)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]CH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]CH)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]CH)(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	121.1810	0.000	1	120.6590	0.545	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]CH)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]CH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]CH)(C[6]C[6]H)(H){1|H<1>,2|C<3>,2|C<4>}	C[6](C[6]C[5,6]CH)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	120.1370	0.000	1	120.6590	0.545	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]CH)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]C[6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]CH)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]C[6]H)(C[6]C[6]H)(H){2|C<3>,3|C<4>,3|H<1>}	H(C[6]C[6]2)	119.9610	0.085	2	119.9610	0.007	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]CH)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]C[6a]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]CH)(C[6]C[6]H)(H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]C[5,6]C[6a]H)(C[6]C[6]H)(H){2|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.0320	0.000	1	120.0320	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]CH)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]CH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,3|H<1>}	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	120.6030	0.093	2	120.6417	0.009	3	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]CH)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]CH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,3|H<1>}	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H){1|C<4>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.7190	0.000	1	120.6417	0.009	3	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]CH)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]HO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]CH)(C[6]C[6]H)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]HO)(C[6]C[6]H)(H){1|C<3>,1|H<1>,3|C<4>}	H(C[6]C[6]2)	117.5065	0.298	2	117.6010	0.051	4	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]CH)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]HO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]CH)(C[6]C[6]H)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]HO)(C[6]C[6]H)(H){1|H<1>,4|C<4>}	H(C[6]C[6]2)	117.6955	0.170	2	117.6010	0.051	4	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]CH)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]CH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|S<2>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	117.4850	0.000	1	117.7198	0.221	4	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]CH)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]CH)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,3|H<1>}	H(C[6]C[6]2)	118.3880	0.000	1	117.7198	0.221	4	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]CH)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]CH)(C[6]C[6]H)(H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	117.5030	0.262	2	117.7198	0.221	4	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]C[6]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]CH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C[6]H)(C[6]C[6]H)(H){2|C<3>,3|C<4>,3|H<1>}	C[6](C[6]C[5,6]CH)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	120.4360	0.395	2	120.4360	0.156	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]C[6a]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]B[5]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C[6a]H)(C[6]C[6]H)(H){1|B<3>,1|H<1>,2|C<4>,3|C<3>}	C[6](C[6]C[5,6]B[5]C)(C[6]C[6]H)(H){1|C<4>,2|C<3>,2|H<1>,2|O<2>}	H(C[6]C[6]2)	121.3140	0.058	2	121.3140	0.003	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]C[6a]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]CH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C[6a]H)(C[6]C[6]H)(H){2|C<4>,2|H<1>,3|C<3>}	C[6](C[6]C[5,6]CH)(C[6]C[6]H)(H){1|C<4>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.6710	0.000	1	120.6710	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]FF)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]FF)(C[6]C[6]H)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|O<2>,2|C<4>,2|F<1>}	H(C[6]C[6]2)	119.2840	0.000	1	119.2840	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]FF)(C[6]C[6]H)(H)	C[6](C[6]C[6]HO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]FF)(C[6]C[6]H)(H){1|H<1>,2|C<4>,2|O<2>}	C[6](C[6]C[6]HO)(C[6]C[6]H)(H){1|O<2>,2|C<4>,2|F<1>}	H(C[6]C[6]2)	119.0550	0.000	1	119.0550	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[5,5,6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,3|H<1>}	C[6](C[6]C[5,5,6]HH)(C[6]C[6]H)(H){2|H<1>,3|C<4>}	H(C[6]C[6]2)	117.6840	0.000	1	117.6840	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[5,6,6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6,6]HH)(C[6]C[6]H)(H){2|H<1>,3|C<4>}	H(C[6]C[6]2)	118.4250	0.476	3	119.3316	0.804	7	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[5,6,6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H){2|C<4>,3|H<1>}	C[6](C[6]C[5,6,6]HH)(C[6]C[6]H)(H){2|H<1>,3|C<4>}	H(C[6]C[6]2)	120.0115	0.140	4	119.3316	0.804	7	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]CC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H){2|C<3>,2|C<4>}	C[6](C[6]C[5,6]CC)(C[6]C[6]H)(H){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	117.7300	0.000	1	117.7300	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]CH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]CH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,3|H<1>}	H(C[6]C[6]2)	120.4080	0.057	2	120.3107	0.030	3	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]CH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]C[5,6]CH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,3|H<1>}	H(C[6]C[6]2)	120.1160	0.000	1	120.3107	0.030	3	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>,2|H<1>}	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H){2|C<4>,3|H<1>}	H(C[6]C[6]2)	118.6420	0.000	1	118.7199	4.040	60	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<2>,2|H<1>}	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H){1|O<2>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.0990	0.000	1	118.7199	4.040	60	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,2|H<1>}	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	120.5975	4.950	2	118.7199	4.040	60	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,3|H<1>}	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,3|H<1>}	H(C[6]C[6]2)	120.9179	2.157	16	118.7199	4.040	60	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,3|H<1>}	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H){2|C<4>,3|H<1>}	H(C[6]C[6]2)	118.7140	0.000	1	118.7199	4.040	60	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H){1|C<4>,1|N<3>,3|H<1>}	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H){1|C<4>,1|N<3>,3|H<1>}	H(C[6]C[6]2)	117.5905	0.200	4	118.7199	4.040	60	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H){1|Fe<10>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H){1|Fe<10>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	117.3624	0.385	16	118.7199	4.040	60	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<2>,2|H<1>}	H(C[6]C[6]2)	117.8260	0.000	1	118.7199	4.040	60	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H){1|O<2>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	117.8402	0.056	4	118.7199	4.040	60	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H){2|H<1>,3|C<4>}	H(C[6]C[6]2)	119.1110	0.259	2	118.7199	4.040	60	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H){2|C<4>,3|H<1>}	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	117.8570	0.000	1	118.7199	4.040	60	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H){2|C<4>,3|H<1>}	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,3|H<1>}	H(C[6]C[6]2)	117.3410	0.000	1	118.7199	4.040	60	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H){2|C<4>,3|H<1>}	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H){2|C<4>,3|H<1>}	H(C[6]C[6]2)	118.2576	1.176	8	118.7199	4.040	60	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H){2|H<1>,3|C<4>}	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H){1|O<2>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	117.5155	1.095	2	118.7199	4.040	60	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]HO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<2>,2|H<1>}	C[6](C[6]C[5,6]HO)(C[6]C[6]H)(H){1|C<3>,1|C<4>,3|H<1>}	H(C[6]C[6]2)	119.5227	0.737	3	119.5227	0.543	3	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]N[5]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>,2|H<1>}	C[6](C[6]C[5,6]N[5]H)(C[6]C[6]H)(H){2|C<3>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	122.5750	0.000	1	122.5750	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<2>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,3|H<1>}	H(C[6]C[6]2)	117.8760	0.000	1	117.8760	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H)	C[6](C[6]N[5,6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>,2|H<1>}	C[6](C[6]N[5,6]HH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	118.0750	0.000	1	118.0750	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H)	C[6](C[6]N[5,6]HO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H){1|C<3>,1|N<3>,1|O<2>,2|H<1>}	C[6](C[6]N[5,6]HO)(C[6]C[6]H)(H){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	118.2630	0.000	1	118.2630	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]HN)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]HN)(C[6]C[6]H)(H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	117.3530	0.000	1	117.3530	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]HO)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]CH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]HO)(C[6]C[6]H)(H){1|C<3>,1|H<1>,3|C<4>}	C[6](C[6]C[5,6]CH)(C[6]C[6]H)(H){1|O<2>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.8500	0.297	2	119.3957	0.309	4	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]HO)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]CH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]HO)(C[6]C[6]H)(H){1|H<1>,4|C<4>}	C[6](C[6]C[5,6]CH)(C[6]C[6]H)(H){1|O<2>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.9415	0.112	2	119.3957	0.309	4	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]HO)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]HO)(C[6]C[6]H)(H){1|C<3>,1|C<4>,3|H<1>}	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<2>,2|H<1>}	H(C[6]C[6]2)	119.8597	0.421	3	119.8597	0.177	3	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]HO)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]HO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]HO)(C[6]C[6]H)(H){1|C<4>,1|N<3>,1|O<2>,2|H<1>}	C[6](C[6]C[5,6]HO)(C[6]C[6]H)(H){1|O<2>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	117.1840	0.000	1	117.5375	0.250	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]HO)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]HO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]HO)(C[6]C[6]H)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]HO)(C[6]C[6]H)(H){1|C<4>,1|N<3>,1|O<2>,2|H<1>}	H(C[6]C[6]2)	117.8910	0.000	1	117.5375	0.250	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5,6]N[5]H)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]N[5]H)(C[6]C[6]H)(H){2|C<3>,2|C<4>,3|H<1>}	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	122.9380	0.000	1	122.9380	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]C[6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<2>,5|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){2|C<4>,3|H<1>}	H(C[6]C[6]2)	118.4330	0.000	1	119.3633	2.163	3	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]C[6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6]H)(C[6]C[6]H)(H){1|C<3>,1|O<2>,2|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){2|C<4>,3|H<1>}	H(C[6]C[6]2)	121.0590	0.000	1	119.3633	2.163	3	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5]C[6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5]C[6]H)(C[6]C[6]H)(H){1|C<3>,2|C<4>,5|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){2|C<4>,3|H<1>}	H(C[6]C[6]2)	118.5980	0.000	1	119.3633	2.163	3	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]CH)(C[6]C[6]H)(H)	C[6](C[6]N[5a,6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]CH)(C[6]C[6]H)(H){1|C<3>,1|N<3>,2|H<1>}	C[6](C[6]N[5a,6]HH)(C[6]C[6]H)(H){1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	117.3260	0.000	1	117.3260	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]C[6a]H)(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]C[6a]H)(C[6]C[6]H)(H){2|H<1>,4|C<3>}	C[6](C[6]C[5a,6]HH)(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	117.3490	0.000	1	117.3490	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]C[6a]H)(C[6]C[6]H)(H)	C[6](C[6]N[5a,6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]C[6a]H)(C[6]C[6]H)(H){1|N<3>,2|H<1>,3|C<3>}	C[6](C[6]N[5a,6]HH)(C[6]C[6]H)(H){1|H<1>,3|C<3>}	H(C[6]C[6]2)	117.5460	0.000	1	117.5460	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]C[6a]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]HH)(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[5a,6]C[6a]H)(C[6]C[6]H)(H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	117.4730	0.000	1	117.4730	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]HH)(C[6]C[6]H)(H){1|C<3>,1|N<3>,2|H<1>}	C[6](C[6]C[5a,6]HH)(C[6]C[6]H)(H){2|C<3>,2|H<1>}	H(C[6]C[6]2)	117.2180	0.000	1	117.5768	0.149	4	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]HH)(C[6]C[6]H)(H){1|C<3>,1|S<2>,2|H<1>}	C[6](C[6]C[5a,6]HH)(C[6]C[6]H)(H){2|C<3>,2|H<1>}	H(C[6]C[6]2)	117.3400	0.000	1	117.5768	0.149	4	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]HH)(C[6]C[6]H)(H){2|C<3>,2|H<1>}	C[6](C[6]C[5a,6]HH)(C[6]C[6]H)(H){1|C<3>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	117.6700	0.000	1	117.5768	0.149	4	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]HH)(C[6]C[6]H)(H){2|C<3>,2|H<1>}	C[6](C[6]C[5a,6]HH)(C[6]C[6]H)(H){1|C<3>,1|S<2>,2|H<1>}	H(C[6]C[6]2)	118.0790	0.000	1	117.5768	0.149	4	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a,6]HO)(C[6]C[6]H)(H)	C[6](C[6]N[5a,6]HO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a,6]HO)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>,1|O<2>}	C[6](C[6]N[5a,6]HO)(C[6]C[6]H)(H){1|H<1>,1|O<2>,2|C<3>}	H(C[6]C[6]2)	120.6110	0.000	1	120.6110	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]C[6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6]H)(C[6]C[6]H)(H){1|C<4>,2|C<3>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,3|H<1>}	H(C[6]C[6]2)	117.9440	0.000	1	117.9440	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[5a]O[6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6]HO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[5a]O[6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|N<2>,1|O<2>}	C[6](C[6]C[6]HO)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<2>,2|H<1>}	H(C[6]C[6]2)	119.1890	0.000	1	119.1890	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]CC)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]CC)(C[6]C[6]H)(H){2|C<4>,3|H<1>}	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H){5|C<4>}	H(C[6]C[6]2)	117.7140	0.000	1	117.7140	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]CH)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]C[6a]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]CH)(C[6]C[6]H)(H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6]C[6a]H)(C[6]C[6]H)(H){2|C<3>,2|H<1>,3|C<4>}	H(C[6]C[6]2)	117.9178	0.722	6	117.9178	0.522	6	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]CH)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]CH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,3|H<1>}	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	117.8205	0.193	2	117.7542	0.044	4	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]CH)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]CH)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H){2|H<1>,3|C<4>}	H(C[6]C[6]2)	117.8850	0.000	1	117.7542	0.044	4	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]CH)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]CH)(C[6]C[6]H)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H){1|H<1>,1|O<2>,3|C<4>}	H(C[6]C[6]2)	117.4910	0.000	1	117.7542	0.044	4	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]CH)(C[6]C[6]H)(H)	C[6](C[6]S[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]CH)(C[6]C[6]H)(H){1|S<2>,2|C<3>,2|H<1>}	C[6](C[6]S[6]HH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	116.9540	0.000	1	116.9540	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]C[6a]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]CH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]C[6a]H)(C[6]C[6]H)(H){2|C<3>,2|H<1>,3|C<4>}	C[6](C[6]C[6,6]CH)(C[6]C[6]H)(H){1|C<4>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	118.4933	1.517	6	118.4933	2.302	6	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]C[6a]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]C[6a]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]C[6a]H)(C[6]C[6]H)(H){1|C<4>,2|H<1>,4|C<3>}	C[6](C[6]C[6,6]C[6a]H)(C[6]C[6]H)(H){1|C<4>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	117.5855	1.033	2	117.7465	0.468	4	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]C[6a]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]C[6a]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]C[6a]H)(C[6]C[6]H)(H){1|H<1>,5|C<3>}	C[6](C[6]C[6,6]C[6a]H)(C[6]C[6]H)(H){1|H<1>,5|C<3>}	H(C[6]C[6]2)	117.9075	0.482	2	117.7465	0.468	4	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]C[6a]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]C[6a]H)(C[6]C[6]H)(H){1|C<4>,3|C<3>,3|H<1>}	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H){1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	117.5545	0.186	2	118.5837	3.195	3	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]C[6a]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]C[6a]H)(C[6]C[6]H)(H){1|O<2>,2|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	120.6420	0.000	1	118.5837	3.195	3	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]C[6a]H)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]C[6a]H)(C[6]C[6]H)(H){1|C<4>,2|H<1>,4|C<3>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<4>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	117.8070	0.000	1	117.8070	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]ClH)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]HO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]ClH)(C[6]C[6]H)(H){1|H<1>,2|C<4>,2|O<2>}	C[6](C[6]C[6,6]HO)(C[6]C[6]H)(H){1|Cl<1>,1|C<4>,1|O<2>,2|H<1>}	H(C[6]C[6]2)	118.0530	0.000	1	118.0530	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[3x6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[6]C[3x6]HH)(C[6]C[6]H)(H){2|H<1>,3|C<4>}	H(C[6]C[6]2)	118.4930	0.000	1	118.4930	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[5,6,6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H){2|C<4>,3|H<1>}	C[6](C[6]C[5,6,6]HH)(C[6]C[6]H)(H){1|N<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.3710	0.000	1	118.3710	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]CC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H){5|C<4>}	C[6](C[6]C[6,6]CC)(C[6]C[6]H)(H){2|C<4>,3|H<1>}	H(C[6]C[6]2)	117.7460	0.000	1	117.7460	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]CH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[6,6]CH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,3|H<1>}	H(C[6]C[6]2)	118.0595	0.064	2	118.3090	0.126	4	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]CH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H){1|H<1>,1|O<2>,3|C<4>}	C[6](C[6]C[6,6]CH)(C[6]C[6]H)(H){1|O<2>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.8090	0.000	1	118.3090	0.126	4	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]CH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H){2|H<1>,3|C<4>}	C[6](C[6]C[6,6]CH)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.3080	0.000	1	118.3090	0.126	4	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]C[6a]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[6,6]C[6a]H)(C[6]C[6]H)(H){1|O<2>,2|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	117.2080	0.000	1	117.6870	0.197	3	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]C[6a]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H){1|C<4>,1|H<1>,2|C<3>}	C[6](C[6]C[6,6]C[6a]H)(C[6]C[6]H)(H){1|C<4>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	117.9265	0.221	2	117.6870	0.197	3	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H){1|C<2>,2|C<4>,2|H<1>}	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H){1|O<2>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.3285	0.088	2	118.8536	2.746	50	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,2|H<1>}	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	118.7197	2.560	10	118.8536	2.746	50	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,3|H<1>}	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,3|H<1>}	H(C[6]C[6]2)	121.2305	1.385	2	118.8536	2.746	50	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,3|H<1>}	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H){2|C<4>,3|H<1>}	H(C[6]C[6]2)	118.0680	0.000	1	118.8536	2.746	50	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,3|H<1>}	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H){2|H<1>,3|C<4>}	H(C[6]C[6]2)	118.2490	0.000	1	118.8536	2.746	50	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H){1|C<2>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.1905	0.013	2	118.8536	2.746	50	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H){1|O<2>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.4050	1.802	14	118.8536	2.746	50	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H){2|C<4>,3|H<1>}	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,3|H<1>}	H(C[6]C[6]2)	121.3000	0.000	1	118.8536	2.746	50	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H){2|C<4>,3|H<1>}	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H){2|C<4>,3|H<1>}	H(C[6]C[6]2)	118.1320	0.148	10	118.8536	2.746	50	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H){2|C<4>,3|H<1>}	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H){2|H<1>,3|C<4>}	H(C[6]C[6]2)	118.5720	0.241	3	118.8536	2.746	50	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H){2|H<1>,3|C<4>}	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,3|H<1>}	H(C[6]C[6]2)	118.0130	0.000	1	118.8536	2.746	50	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H){2|H<1>,3|C<4>}	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H){2|C<4>,3|H<1>}	H(C[6]C[6]2)	118.5490	0.516	3	118.8536	2.746	50	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<4>,4|H<1>}	H(C[6]C[6]2)	118.5440	0.000	1	119.5045	1.845	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H){2|H<1>,3|C<4>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<4>,1|O<2>,3|H<1>}	H(C[6]C[6]2)	120.4650	0.000	1	119.5045	1.845	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H)	C[6](C[6]N[6,6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H){1|C<4>,1|N<3>,1|O<2>,2|H<1>}	C[6](C[6]N[6,6]HH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.3373	1.296	3	119.5842	1.364	4	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H)	C[6](C[6]N[6,6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H){1|C<4>,1|N<3>,3|H<1>}	C[6](C[6]N[6,6]HH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	120.3250	0.000	1	119.5842	1.364	4	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]HO)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]ClH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]HO)(C[6]C[6]H)(H){1|Cl<1>,1|C<4>,1|O<2>,2|H<1>}	C[6](C[6]C[6,6]ClH)(C[6]C[6]H)(H){1|H<1>,2|C<4>,2|O<2>}	H(C[6]C[6]2)	118.3410	0.000	1	118.3410	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]HO)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]HO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]HO)(C[6]C[6]H)(H){1|C<4>,2|H<1>,2|O<2>}	C[6](C[6]C[6,6]HO)(C[6]C[6]H)(H){1|H<1>,2|C<4>,2|O<2>}	H(C[6]C[6]2)	117.9780	0.000	1	118.0745	0.019	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]HO)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]HO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]HO)(C[6]C[6]H)(H){1|H<1>,2|C<4>,2|O<2>}	C[6](C[6]C[6,6]HO)(C[6]C[6]H)(H){1|C<4>,2|H<1>,2|O<2>}	H(C[6]C[6]2)	118.1710	0.000	1	118.0745	0.019	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]CC)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]CC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]CC)(C[6]C[6]H)(H){1|C<4>,3|C<3>}	C[6](C[6]C[6,6a]CC)(C[6]C[6]H)(H){1|C<4>,3|C<3>}	H(C[6]C[6]2)	117.5700	0.099	2	117.5700	0.010	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]CC)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]CC)(C[6]C[6]H)(H){2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]HH)(C[6]C[6]H)(H){2|C<3>,2|C<4>}	H(C[6]C[6]2)	117.0580	0.000	1	117.0580	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]CH)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]CH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]CH)(C[6]C[6]H)(H){1|C<4>,1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]CH)(C[6]C[6]H)(H){1|H<1>,3|C<3>}	H(C[6]C[6]2)	118.3930	0.000	1	117.9005	0.485	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]CH)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]CH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]CH)(C[6]C[6]H)(H){1|H<1>,3|C<3>}	C[6](C[6]C[6,6a]CH)(C[6]C[6]H)(H){1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	117.4080	0.000	1	117.9005	0.485	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]CH)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]CO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]CH)(C[6]C[6]H)(H){1|O<2>,3|C<3>}	C[6](C[6]C[6,6a]CO)(C[6]C[6]H)(H){1|H<1>,3|C<3>}	H(C[6]C[6]2)	123.7790	0.000	1	123.7790	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]CH)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]N[5a]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]CH)(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]N[5a]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,3|C<3>}	H(C[6]C[6]2)	117.7177	0.246	6	117.7177	0.061	6	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]CO)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]CH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]CO)(C[6]C[6]H)(H){1|H<1>,3|C<3>}	C[6](C[6]C[6,6a]CH)(C[6]C[6]H)(H){1|O<2>,3|C<3>}	H(C[6]C[6]2)	123.0290	0.000	1	123.0290	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]CO)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]CO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]CO)(C[6]C[6]H)(H){1|C<2>,1|O<2>,2|C<3>}	C[6](C[6]C[6,6a]CO)(C[6]C[6]H)(H){1|C<2>,1|O<2>,2|C<3>}	H(C[6]C[6]2)	119.4310	1.930	4	119.4310	3.725	4	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]C[6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]C[6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C[6]H)(C[6]C[6]H)(H){1|C<4>,2|H<1>,4|C<3>}	C[6](C[6]C[6,6a]C[6]H)(C[6]C[6]H)(H){1|H<1>,2|C<4>,4|C<3>}	H(C[6]C[6]2)	120.6590	0.000	1	120.4760	0.067	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]C[6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]C[6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C[6]H)(C[6]C[6]H)(H){1|H<1>,2|C<4>,4|C<3>}	C[6](C[6]C[6,6a]C[6]H)(C[6]C[6]H)(H){1|C<4>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.2930	0.000	1	120.4760	0.067	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]C[6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C[6]H)(C[6]C[6]H)(H){2|C<3>,2|C<4>,3|H<1>}	C[6](C[6]C[6,6a]HH)(C[6]C[6]H)(H){1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	117.9020	0.000	1	117.9020	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]C[6a]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]C[6a]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C[6a]H)(C[6]C[6]H)(H){1|H<1>,5|C<3>}	C[6](C[6]C[6,6a]C[6a]H)(C[6]C[6]H)(H){1|H<1>,5|C<3>}	H(C[6]C[6]2)	118.0185	0.381	12	118.0185	0.145	12	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]C[6a]O)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]C[6a]O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C[6a]O)(C[6]C[6]H)(H){1|O<2>,5|C<3>}	C[6](C[6]C[6,6a]C[6a]O)(C[6]C[6]H)(H){1|O<2>,5|C<3>}	H(C[6]C[6]2)	117.5440	0.283	4	117.5440	0.080	4	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]CC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]HH)(C[6]C[6]H)(H){2|C<3>,2|C<4>}	C[6](C[6]C[6,6a]CC)(C[6]C[6]H)(H){2|C<3>,2|H<1>}	H(C[6]C[6]2)	118.3370	0.000	1	118.3370	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]C[6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]HH)(C[6]C[6]H)(H){1|C<4>,1|H<1>,2|C<3>}	C[6](C[6]C[6,6a]C[6]H)(C[6]C[6]H)(H){2|C<3>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	117.7710	0.000	1	117.7710	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]HH)(C[6]C[6]H)(H){2|C<3>,2|H<1>}	C[6](C[6]C[6,6a]HH)(C[6]C[6]H)(H){2|C<3>,2|H<1>}	H(C[6]C[6]2)	120.1859	2.057	8	120.1859	4.230	8	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]HN)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]N[5a]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]HN)(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[6,6a]N[5a]H)(C[6]C[6]H)(H){1|H<1>,2|N<3>,3|C<3>}	H(C[6]C[6]2)	117.6825	0.262	2	117.6825	0.069	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]N[5a]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]CH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]N[5a]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,3|C<3>}	C[6](C[6]C[6,6a]CH)(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	118.3977	0.291	6	118.3977	0.085	6	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]N[5a]H)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]HN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]N[5a]H)(C[6]C[6]H)(H){1|H<1>,2|N<3>,3|C<3>}	C[6](C[6]C[6,6a]HN)(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6]2)	118.1645	0.349	2	118.1645	0.122	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2C)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2C)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<2>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	117.8030	0.082	2	117.8030	0.007	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2H)(C[6]C[6]H)(H)	C[6](C[6]C[6]BrH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2H)(C[6]C[6]H)(H){2|Br<1>,1|C<2>,1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]C[6]BrH)(C[6]C[6]H)(H){1|Br<1>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	117.6560	0.000	1	117.6560	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2H)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2H)(C[6]C[6]H)(H){1|C<3>,3|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.0300	0.000	1	118.0455	0.000	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2H)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2H)(C[6]C[6]H)(H){1|C<4>,2|C<3>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,3|H<1>}	H(C[6]C[6]2)	118.0610	0.000	1	118.0455	0.000	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2H)(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2H)(C[6]C[6]H)(H){1|C<3>,1|O<1>,2|N<3>,3|C<4>}	C[6](C[6]C[6]N[6]C)(C[6]C[6]H)(H){2|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	121.2390	0.000	1	121.2390	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]2H)(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]2H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<1>,2|H<1>,2|N<2>}	C[6](C[6]C[6]N[6]H)(C[6]C[6]H)(H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	120.4580	0.000	1	120.4580	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]BrH)(C[6]C[6]H)(H)	C[6](C[6]C[6]2H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]BrH)(C[6]C[6]H)(H){1|Br<1>,2|C<4>,2|H<1>}	C[6](C[6]C[6]2H)(C[6]C[6]H)(H){2|Br<1>,1|C<2>,1|C<4>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	118.5790	0.000	1	118.5790	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CC)(C[6]C[6]H)(H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CC)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|S<2>}	C[6](C[6]C[6]CH)(C[6]C[6]H)(H){1|C<3>,3|C<4>}	H(C[6]C[6]2)	117.4860	0.000	1	119.0840	5.409	6	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CC)(C[6]C[6]H)(H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CC)(C[6]C[6]H)(H){1|C<3>,1|C<4>,2|H<1>}	C[6](C[6]C[6]CH)(C[6]C[6]H)(H){1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	117.6713	0.202	3	119.0840	5.409	6	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CC)(C[6]C[6]H)(H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CC)(C[6]C[6]H)(H){2|C<3>,2|H<1>}	C[6](C[6]C[6]CH)(C[6]C[6]H)(H){1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	122.0020	1.181	2	119.0840	5.409	6	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CH)(C[6]C[6]H)(H)	C[6](C[6]C[4]N[6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CH)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,1|O<1>}	C[6](C[6]C[4]N[6]H)(C[6]C[6]H)(H){1|H<1>,3|C<3>,3|C<4>}	H(C[6]C[6]2)	119.8900	0.000	1	119.8900	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CH)(C[6]C[6]H)(H)	C[6](C[6]C[6]CC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CH)(C[6]C[6]H)(H){1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[6]CC)(C[6]C[6]H)(H){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	117.6343	0.221	4	119.0426	5.496	7	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CH)(C[6]C[6]H)(H)	C[6](C[6]C[6]CC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CH)(C[6]C[6]H)(H){1|C<3>,3|C<4>}	C[6](C[6]C[6]CC)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|S<2>}	H(C[6]C[6]2)	117.8580	0.000	1	119.0426	5.496	7	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CH)(C[6]C[6]H)(H)	C[6](C[6]C[6]CC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CH)(C[6]C[6]H)(H){1|C<4>,1|H<1>,2|C<3>}	C[6](C[6]C[6]CC)(C[6]C[6]H)(H){2|C<3>,2|H<1>}	H(C[6]C[6]2)	122.4515	0.500	2	119.0426	5.496	7	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CH)(C[6]C[6]H)(H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|O<1>}	C[6](C[6]C[6]CH)(C[6]C[6]H)(H){2|C<3>,3|H<1>}	H(C[6]C[6]2)	120.7635	0.508	2	118.6909	25.886	16	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CH)(C[6]C[6]H)(H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,2|O<2>}	C[6](C[6]C[6]CH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,3|H<1>}	H(C[6]C[6]2)	121.3350	0.000	1	118.6909	25.886	16	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CH)(C[6]C[6]H)(H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,2|H<1>}	C[6](C[6]C[6]CH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	111.6785	0.835	2	118.6909	25.886	16	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CH)(C[6]C[6]H)(H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,2|H<1>}	C[6](C[6]C[6]CH)(C[6]C[6]H)(H){1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	119.6000	0.000	1	118.6909	25.886	16	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CH)(C[6]C[6]H)(H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,3|H<1>}	C[6](C[6]C[6]CH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,2|O<2>}	H(C[6]C[6]2)	120.7350	0.000	1	118.6909	25.886	16	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CH)(C[6]C[6]H)(H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,3|H<1>}	C[6](C[6]C[6]CH)(C[6]C[6]H)(H){1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	117.8220	0.000	1	118.6909	25.886	16	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CH)(C[6]C[6]H)(H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,3|H<1>}	C[6](C[6]C[6]CH)(C[6]C[6]H)(H){1|H<1>,1|N<2>,2|C<4>}	H(C[6]C[6]2)	108.7570	0.000	1	118.6909	25.886	16	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CH)(C[6]C[6]H)(H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CH)(C[6]C[6]H)(H){1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[6]CH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,3|H<1>}	H(C[6]C[6]2)	117.8010	0.000	1	118.6909	25.886	16	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CH)(C[6]C[6]H)(H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CH)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[6]CH)(C[6]C[6]H)(H){1|O<2>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	117.8890	0.000	1	118.6909	25.886	16	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CH)(C[6]C[6]H)(H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CH)(C[6]C[6]H)(H){1|C<4>,1|H<1>,2|C<3>}	C[6](C[6]C[6]CH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.4770	0.000	1	118.6909	25.886	16	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CH)(C[6]C[6]H)(H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CH)(C[6]C[6]H)(H){1|H<1>,1|N<2>,2|C<4>}	C[6](C[6]C[6]CH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,3|H<1>}	H(C[6]C[6]2)	131.2060	0.000	1	118.6909	25.886	16	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CH)(C[6]C[6]H)(H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CH)(C[6]C[6]H)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[6]C[6]CH)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	117.9680	0.000	1	118.6909	25.886	16	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CH)(C[6]C[6]H)(H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CH)(C[6]C[6]H)(H){2|C<3>,3|H<1>}	C[6](C[6]C[6]CH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|O<1>}	H(C[6]C[6]2)	120.7905	0.972	2	118.6909	25.886	16	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CH)(C[6]C[6]H)(H)	C[6](C[6]C[6]FeH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CH)(C[6]C[6]H)(H){1|Fe<7>,1|C<4>,2|H<1>}	C[6](C[6]C[6]FeH)(C[6]C[6]H)(H){1|H<1>,3|C<4>}	H(C[6]C[6]2)	119.2190	0.000	1	119.2190	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CH)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|P<4>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){2|C<4>,3|H<1>}	H(C[6]C[6]2)	117.4850	0.000	1	118.3386	1.703	21	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CH)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|P<4>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){2|H<1>,3|C<4>}	H(C[6]C[6]2)	117.7090	0.000	1	118.3386	1.703	21	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CH)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CH)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){2|C<4>,3|H<1>}	H(C[6]C[6]2)	117.6660	0.000	1	118.3386	1.703	21	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CH)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CH)(C[6]C[6]H)(H){1|C<3>,3|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	117.7605	0.029	2	118.3386	1.703	21	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CH)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CH)(C[6]C[6]H)(H){1|C<4>,1|O<2>,3|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	117.7040	0.000	1	118.3386	1.703	21	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CH)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CH)(C[6]C[6]H)(H){1|C<4>,2|H<1>,2|S<4>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){2|C<4>,3|H<1>}	H(C[6]C[6]2)	116.9810	0.000	1	118.3386	1.703	21	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CH)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CH)(C[6]C[6]H)(H){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<3>,1|H<1>,3|C<4>}	H(C[6]C[6]2)	118.1000	0.000	1	118.3386	1.703	21	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CH)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CH)(C[6]C[6]H)(H){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	117.8550	0.000	1	118.3386	1.703	21	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CH)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CH)(C[6]C[6]H)(H){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){2|C<4>,3|H<1>}	H(C[6]C[6]2)	119.0140	1.493	11	118.3386	1.703	21	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CH)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CH)(C[6]C[6]H)(H){2|C<4>,3|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){2|C<4>,3|H<1>}	H(C[6]C[6]2)	116.9360	0.000	1	118.3386	1.703	21	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CH)(C[6]C[6]H)(H)	C[6](C[6]C[6]HN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CH)(C[6]C[6]H)(H){1|C<4>,1|N<3>,3|H<1>}	C[6](C[6]C[6]HN)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.0160	0.000	1	117.8350	0.025	3	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CH)(C[6]C[6]H)(H)	C[6](C[6]C[6]HN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CH)(C[6]C[6]H)(H){1|N<3>,2|C<4>,2|H<1>}	C[6](C[6]C[6]HN)(C[6]C[6]H)(H){1|O<2>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	117.7445	0.009	2	117.8350	0.025	3	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CH)(C[6]C[6]H)(H)	C[6](C[6]C[6]HO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CH)(C[6]C[6]H)(H){1|C<4>,1|O<2>,3|H<1>}	C[6](C[6]C[6]HO)(C[6]C[6]H)(H){2|C<4>,3|H<1>}	H(C[6]C[6]2)	118.2990	0.000	1	118.2990	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CH)(C[6]C[6]H)(H)	C[6](C[6]C[6]HW)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CH)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<1>,1|W<7>}	C[6](C[6]C[6]HW)(C[6]C[6]H)(H){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.9920	0.000	1	119.3340	0.866	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CH)(C[6]C[6]H)(H)	C[6](C[6]C[6]HW)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CH)(C[6]C[6]H)(H){1|C<4>,1|W<7>,3|H<1>}	C[6](C[6]C[6]HW)(C[6]C[6]H)(H){2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.6760	0.000	1	119.3340	0.866	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CH)(C[6]C[6]H)(H)	C[6](C[6]N[5a]C[6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CH)(C[6]C[6]H)(H){1|C<3>,1|N<3>,2|H<1>}	C[6](C[6]N[5a]C[6]H)(C[6]C[6]H)(H){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	117.9805	0.347	2	117.9805	0.121	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CH)(C[6]C[6]H)(H)	C[6](C[6]N[6]CH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CH)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,1|O<1>}	C[6](C[6]N[6]CH)(C[6]C[6]H)(H){1|C<3>,1|H<1>,2|C<4>}	H(C[6]C[6]2)	118.6940	0.018	4	118.7786	0.036	5	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CH)(C[6]C[6]H)(H)	C[6](C[6]N[6]CH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CH)(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<4>}	C[6](C[6]N[6]CH)(C[6]C[6]H)(H){1|Mn<6>,1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.1170	0.000	1	118.7786	0.036	5	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CH)(C[6]C[6]H)(H)	C[6](C[6]N[6a]C[6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CH)(C[6]C[6]H)(H){1|C<4>,1|N<3>,1|O<2>,2|H<1>}	C[6](C[6]N[6a]C[6]H)(C[6]C[6]H)(H){1|F<1>,2|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	117.8530	0.000	1	117.8530	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CH)(C[6]C[6]H)(H)	C[6](C[6]O[6]CH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<2>,2|H<1>}	C[6](C[6]O[6]CH)(C[6]C[6]H)(H){1|H<1>,2|C<4>}	H(C[6]C[6]2)	118.2950	0.000	1	118.2950	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CN)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CN)(C[6]C[6]H)(H){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|H<1>,1|N<2>,3|C<4>}	H(C[6]C[6]2)	118.5290	0.000	1	118.2624	0.077	5	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CN)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CN)(C[6]C[6]H)(H){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<4>}	H(C[6]C[6]2)	118.0390	0.000	1	118.2624	0.077	5	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CN)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CN)(C[6]C[6]H)(H){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|N<2>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.4225	0.052	2	118.2624	0.077	5	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CN)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CN)(C[6]C[6]H)(H){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|N<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	117.8990	0.000	1	118.2624	0.077	5	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CN)(C[6]C[6]H)(H)	C[6](C[6]C[6]HO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CN)(C[6]C[6]H)(H){1|C<3>,1|O<2>,2|H<1>}	C[6](C[6]C[6]HO)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	118.2590	0.151	2	118.2590	0.023	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CO)(C[6]C[6]H)(H)	C[6](C[6]C[6]CO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CO)(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]CO)(C[6]C[6]H)(H){1|C<2>,1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	120.0266	1.979	8	120.0266	3.918	8	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CO)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CO)(C[6]C[6]H)(H){1|C<4>,1|O<1>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|O<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	121.7850	0.000	1	119.9530	6.712	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CO)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CO)(C[6]C[6]H)(H){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|O<2>,4|C<4>}	H(C[6]C[6]2)	118.1210	0.000	1	119.9530	6.712	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CO)(C[6]C[6]H)(H)	C[6](C[6]C[6]HO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CO)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<2>,2|H<1>}	C[6](C[6]C[6]HO)(C[6]C[6]H)(H){1|O<2>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	117.9265	0.199	2	117.7840	0.081	3	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CO)(C[6]C[6]H)(H)	C[6](C[6]C[6]HO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CO)(C[6]C[6]H)(H){1|C<4>,2|H<1>,2|O<2>}	C[6](C[6]C[6]HO)(C[6]C[6]H)(H){1|H<1>,2|C<4>,2|O<2>}	H(C[6]C[6]2)	117.4990	0.000	1	117.7840	0.081	3	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CO)(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6]O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CO)(C[6]C[6]H)(H){1|H<1>,1|O<2>,2|C<3>}	C[6](C[6]C[6a]C[6]O)(C[6]C[6]H)(H){1|C<2>,1|H<1>,1|O<2>,3|C<3>}	H(C[6]C[6]2)	120.8510	0.361	2	120.7037	0.670	6	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CO)(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6]O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CO)(C[6]C[6]H)(H){1|H<1>,1|O<2>,2|C<3>}	C[6](C[6]C[6a]C[6]O)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<2>,3|C<3>}	H(C[6]C[6]2)	120.6300	1.026	4	120.7037	0.670	6	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]ClH)(C[6]C[6]H)(H)	C[6](C[6]C[6]ClH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]ClH)(C[6]C[6]H)(H){1|Cl<1>,1|C<4>,1|O<2>,2|H<1>}	C[6](C[6]C[6]ClH)(C[6]C[6]H)(H){1|Cl<1>,1|C<4>,1|O<2>,2|H<1>}	H(C[6]C[6]2)	118.3960	0.740	2	118.3960	0.547	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]ClH)(C[6]C[6]H)(H)	C[6](C[6]C[6]HO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]ClH)(C[6]C[6]H)(H){1|Cl<1>,1|C<4>,1|O<2>,2|H<1>}	C[6](C[6]C[6]HO)(C[6]C[6]H)(H){1|Cl<1>,1|C<4>,1|O<2>,2|H<1>}	H(C[6]C[6]2)	118.2650	0.000	1	119.4660	2.885	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]ClH)(C[6]C[6]H)(H)	C[6](C[6]C[6]HO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]ClH)(C[6]C[6]H)(H){1|H<1>,2|C<4>,2|O<2>}	C[6](C[6]C[6]HO)(C[6]C[6]H)(H){1|Cl<1>,1|C<4>,1|O<2>,2|H<1>}	H(C[6]C[6]2)	120.6670	0.000	1	119.4660	2.885	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]FH)(C[6]C[6]H)(H)	C[6](C[6]C[6]FH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]FH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|F<1>,2|H<1>}	C[6](C[6]C[6]FH)(C[6]C[6]H)(H){1|C<4>,1|F<1>,1|O<2>,2|H<1>}	H(C[6]C[6]2)	118.6560	0.000	1	118.7110	0.006	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]FH)(C[6]C[6]H)(H)	C[6](C[6]C[6]FH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]FH)(C[6]C[6]H)(H){1|C<4>,1|F<1>,1|O<2>,2|H<1>}	C[6](C[6]C[6]FH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|F<1>,2|H<1>}	H(C[6]C[6]2)	118.7660	0.000	1	118.7110	0.006	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]FH)(C[6]C[6]H)(H)	C[6](C[6]N[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]FH)(C[6]C[6]H)(H){1|N<3>,4|H<1>}	C[6](C[6]N[6]HH)(C[6]C[6]H)(H){1|C<4>,1|F<1>,1|H<1>,1|S<4>}	H(C[6]C[6]2)	119.2720	0.000	1	119.2720	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]FeC)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]FeC)(C[6]C[6]H)(H){1|C<4>,3|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|Fe<7>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.3410	0.000	1	119.3410	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]FeH)(C[6]C[6]H)(H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]FeH)(C[6]C[6]H)(H){1|H<1>,3|C<4>}	C[6](C[6]C[6]CH)(C[6]C[6]H)(H){1|Fe<7>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	118.6590	0.000	1	118.6590	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]GeH)(C[6]C[6]H)(H)	C[6](C[6]C[6]GeH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]GeH)(C[6]C[6]H)(H){1|Ge<2>,1|C<4>,3|H<1>}	C[6](C[6]C[6]GeH)(C[6]C[6]H)(H){1|Ge<2>,1|C<4>,3|H<1>}	H(C[6]C[6]2)	117.9105	0.490	2	117.9105	0.240	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[3x6]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<3>,4|C<4>}	C[6](C[6]C[3x6]C[6]C)(C[6]C[6]H)(H){1|O<1>,2|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.1630	0.014	2	118.1630	0.000	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]CH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,3|H<1>}	C[6](C[6]C[5,6]CH)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	116.6680	0.000	1	117.5505	0.385	4	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]CH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]CH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|S<2>,2|H<1>}	H(C[6]C[6]2)	117.8420	0.000	1	117.5505	0.385	4	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]CH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]CH)(C[6]C[6]H)(H){1|C<4>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	117.8460	0.342	2	117.5505	0.385	4	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]FF)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|O<2>,2|C<4>,2|F<1>}	C[6](C[6]C[5,6]FF)(C[6]C[6]H)(H){1|O<2>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	117.8370	0.000	1	117.8370	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,3|H<1>}	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<2>,2|H<1>}	H(C[6]C[6]2)	118.4040	0.000	1	118.4040	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]HN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>,2|H<1>}	C[6](C[6]C[5,6]HN)(C[6]C[6]H)(H){1|C<4>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	118.4250	0.000	1	118.4250	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[5]C[6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){2|C<4>,3|H<1>}	C[6](C[6]C[5]C[6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<2>,5|H<1>}	H(C[6]C[6]2)	117.7700	0.000	1	119.4563	2.366	3	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[5]C[6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){2|C<4>,3|H<1>}	C[6](C[6]C[5]C[6]H)(C[6]C[6]H)(H){1|C<3>,1|O<2>,2|C<4>,4|H<1>}	H(C[6]C[6]2)	120.7820	0.000	1	119.4563	2.366	3	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[5]C[6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){2|C<4>,3|H<1>}	C[6](C[6]C[5]C[6]H)(C[6]C[6]H)(H){1|C<3>,2|C<4>,5|H<1>}	H(C[6]C[6]2)	119.8170	0.000	1	119.4563	2.366	3	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[5a]C[6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,3|H<1>}	C[6](C[6]C[5a]C[6]H)(C[6]C[6]H)(H){1|C<4>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	117.9660	0.000	1	117.9660	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]C[6a]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6]C[6a]H)(C[6]C[6]H)(H){1|C<4>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	118.2850	0.000	1	118.2850	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<4>,1|O<2>,3|H<1>}	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H){2|H<1>,3|C<4>}	H(C[6]C[6]2)	121.7120	0.000	1	120.0365	5.615	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<4>,4|H<1>}	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.3610	0.000	1	120.0365	5.615	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6]2C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[6]2C)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<2>,4|H<1>}	H(C[6]C[6]2)	118.1470	0.099	2	118.1470	0.010	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6]2H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,3|H<1>}	C[6](C[6]C[6]2H)(C[6]C[6]H)(H){1|C<4>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	118.0840	0.000	1	118.0445	0.003	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6]2H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[6]2H)(C[6]C[6]H)(H){1|C<3>,3|C<4>,4|H<1>}	H(C[6]C[6]2)	118.0050	0.000	1	118.0445	0.003	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,2|H<1>}	C[6](C[6]C[6]CH)(C[6]C[6]H)(H){1|C<3>,3|H<1>}	H(C[6]C[6]2)	118.1805	0.042	2	118.4070	1.163	21	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<3>,1|H<1>,3|C<4>}	C[6](C[6]C[6]CH)(C[6]C[6]H)(H){1|C<4>,4|H<1>}	H(C[6]C[6]2)	121.3310	0.000	1	118.4070	1.163	21	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[6]CH)(C[6]C[6]H)(H){1|C<4>,1|O<2>,3|H<1>}	H(C[6]C[6]2)	118.1260	0.000	1	118.4070	1.163	21	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[6]CH)(C[6]C[6]H)(H){1|C<4>,4|H<1>}	H(C[6]C[6]2)	117.8520	0.000	1	118.4070	1.163	21	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){2|C<4>,3|H<1>}	C[6](C[6]C[6]CH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|P<4>,2|H<1>}	H(C[6]C[6]2)	117.5780	0.000	1	118.4070	1.163	21	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){2|C<4>,3|H<1>}	C[6](C[6]C[6]CH)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.7640	0.000	1	118.4070	1.163	21	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){2|C<4>,3|H<1>}	C[6](C[6]C[6]CH)(C[6]C[6]H)(H){1|C<4>,2|H<1>,2|S<4>}	H(C[6]C[6]2)	118.4620	0.000	1	118.4070	1.163	21	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){2|C<4>,3|H<1>}	C[6](C[6]C[6]CH)(C[6]C[6]H)(H){1|C<4>,4|H<1>}	H(C[6]C[6]2)	118.3598	1.145	11	118.4070	1.163	21	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){2|C<4>,3|H<1>}	C[6](C[6]C[6]CH)(C[6]C[6]H)(H){2|C<4>,3|H<1>}	H(C[6]C[6]2)	118.0060	0.000	1	118.4070	1.163	21	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){2|H<1>,3|C<4>}	C[6](C[6]C[6]CH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|P<4>,2|H<1>}	H(C[6]C[6]2)	118.1090	0.000	1	118.4070	1.163	21	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6]CN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|H<1>,1|N<2>,3|C<4>}	C[6](C[6]C[6]CN)(C[6]C[6]H)(H){1|C<4>,4|H<1>}	H(C[6]C[6]2)	117.7550	0.000	1	117.3748	1.236	5	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6]CN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|H<1>,1|N<3>,3|C<4>}	C[6](C[6]C[6]CN)(C[6]C[6]H)(H){1|C<4>,4|H<1>}	H(C[6]C[6]2)	118.0490	0.000	1	117.3748	1.236	5	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6]CN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|N<2>,2|C<4>,2|H<1>}	C[6](C[6]C[6]CN)(C[6]C[6]H)(H){1|C<4>,4|H<1>}	H(C[6]C[6]2)	117.8335	0.187	2	117.3748	1.236	5	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6]CN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|N<3>,2|C<4>,2|H<1>}	C[6](C[6]C[6]CN)(C[6]C[6]H)(H){1|C<4>,4|H<1>}	H(C[6]C[6]2)	115.4030	0.000	1	117.3748	1.236	5	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6]CO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|O<2>,2|C<3>,2|H<1>}	C[6](C[6]C[6]CO)(C[6]C[6]H)(H){1|C<4>,1|O<1>,2|H<1>}	H(C[6]C[6]2)	118.9710	0.000	1	118.5100	0.425	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6]CO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|O<2>,4|C<4>}	C[6](C[6]C[6]CO)(C[6]C[6]H)(H){1|C<4>,4|H<1>}	H(C[6]C[6]2)	118.0490	0.000	1	118.5100	0.425	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6]FeC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|Fe<7>,2|C<4>,2|H<1>}	C[6](C[6]C[6]FeC)(C[6]C[6]H)(H){1|C<4>,3|H<1>}	H(C[6]C[6]2)	118.8710	0.000	1	118.8710	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|Au<3>,1|C<4>,3|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|Au<3>,1|C<4>,3|H<1>}	H(C[6]C[6]2)	118.3895	0.011	2	118.7580	4.085	51	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<2>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<4>,4|H<1>}	H(C[6]C[6]2)	119.8520	0.000	1	118.7580	4.085	51	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,3|H<1>}	H(C[6]C[6]2)	118.0075	0.575	2	118.7580	4.085	51	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<3>,3|H<1>}	H(C[6]C[6]2)	118.7998	1.333	6	118.7580	4.085	51	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,3|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	118.1150	0.129	2	118.7580	4.085	51	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,3|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,3|H<1>}	H(C[6]C[6]2)	118.2498	0.698	6	118.7580	4.085	51	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,3|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<4>,1|N<3>,3|H<1>}	H(C[6]C[6]2)	117.8428	0.218	5	118.7580	4.085	51	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,3|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<4>,1|N<4>,3|H<1>}	H(C[6]C[6]2)	118.0005	0.312	2	118.7580	4.085	51	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<3>,1|P<4>,3|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<4>,3|H<1>}	H(C[6]C[6]2)	121.4800	0.000	1	118.7580	4.085	51	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<3>,3|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	118.4428	0.803	6	118.7580	4.085	51	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<3>,3|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<3>,3|H<1>}	H(C[6]C[6]2)	115.2765	0.920	2	118.7580	4.085	51	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<3>,3|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){2|C<3>,2|H<1>}	H(C[6]C[6]2)	119.5960	0.000	1	118.7580	4.085	51	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<4>,1|N<3>,3|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,3|H<1>}	H(C[6]C[6]2)	118.3604	0.259	5	118.7580	4.085	51	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<4>,1|N<4>,3|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,3|H<1>}	H(C[6]C[6]2)	118.3335	0.168	2	118.7580	4.085	51	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<4>,1|P<4>,3|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<4>,4|H<1>}	H(C[6]C[6]2)	123.4160	0.000	1	118.7580	4.085	51	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<4>,3|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<3>,1|P<4>,3|H<1>}	H(C[6]C[6]2)	123.2550	0.000	1	118.7580	4.085	51	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<2>,2|H<1>}	H(C[6]C[6]2)	118.6980	0.000	1	118.7580	4.085	51	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<4>,1|P<4>,3|H<1>}	H(C[6]C[6]2)	123.6650	0.000	1	118.7580	4.085	51	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<4>,4|H<1>}	H(C[6]C[6]2)	113.2090	0.000	1	118.7580	4.085	51	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){2|C<4>,3|H<1>}	H(C[6]C[6]2)	124.0050	0.000	1	118.7580	4.085	51	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){2|C<3>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<3>,3|H<1>}	H(C[6]C[6]2)	120.4770	0.000	1	118.7580	4.085	51	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){2|C<4>,3|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<4>,4|H<1>}	H(C[6]C[6]2)	122.7880	0.000	1	118.7580	4.085	51	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6]HN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<4>,1|N<3>,1|O<2>,2|H<1>}	C[6](C[6]C[6]HN)(C[6]C[6]H)(H){1|C<4>,1|O<2>,3|H<1>}	H(C[6]C[6]2)	118.0670	0.000	1	118.2409	0.855	9	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6]HN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<4>,1|N<3>,3|H<1>}	C[6](C[6]C[6]HN)(C[6]C[6]H)(H){1|C<4>,1|O<2>,3|H<1>}	H(C[6]C[6]2)	119.1853	0.685	3	118.2409	0.855	9	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6]HN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<4>,1|N<3>,3|H<1>}	C[6](C[6]C[6]HN)(C[6]C[6]H)(H){1|C<4>,4|H<1>}	H(C[6]C[6]2)	117.7090	0.667	5	118.2409	0.855	9	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6]HO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<2>,2|H<1>}	C[6](C[6]C[6]HO)(C[6]C[6]H)(H){1|C<4>,4|H<1>}	H(C[6]C[6]2)	118.1300	0.000	1	118.6928	1.597	6	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6]HO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<2>,2|H<1>}	C[6](C[6]C[6]HO)(C[6]C[6]H)(H){2|C<4>,3|H<1>}	H(C[6]C[6]2)	118.3800	0.000	1	118.6928	1.597	6	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6]HO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<4>,1|N<3>,1|O<2>,2|H<1>}	C[6](C[6]C[6]HO)(C[6]C[6]H)(H){1|C<4>,1|O<2>,3|H<1>}	H(C[6]C[6]2)	121.2320	0.000	1	118.6928	1.597	6	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6]HO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<4>,1|O<2>,3|H<1>}	C[6](C[6]C[6]HO)(C[6]C[6]H)(H){1|N<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.0700	0.413	2	118.6928	1.597	6	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6]HO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<4>,1|O<2>,3|H<1>}	C[6](C[6]C[6]HO)(C[6]C[6]H)(H){2|C<4>,3|H<1>}	H(C[6]C[6]2)	118.2750	0.000	1	118.6928	1.597	6	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6]HS)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<4>,1|O<2>,1|S<4>,2|H<1>}	C[6](C[6]C[6]HS)(C[6]C[6]H)(H){2|C<4>,3|H<1>}	H(C[6]C[6]2)	118.6030	0.000	1	118.6831	1.161	11	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6]HS)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<4>,1|S<2>,3|H<1>}	C[6](C[6]C[6]HS)(C[6]C[6]H)(H){1|C<4>,4|H<1>}	H(C[6]C[6]2)	117.5480	0.000	1	118.6831	1.161	11	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6]HS)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<4>,1|S<4>,3|H<1>}	C[6](C[6]C[6]HS)(C[6]C[6]H)(H){1|Br<1>,1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.2790	2.546	2	118.6831	1.161	11	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6]HS)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<4>,1|S<4>,3|H<1>}	C[6](C[6]C[6]HS)(C[6]C[6]H)(H){1|C<3>,1|C<4>,3|H<1>}	H(C[6]C[6]2)	117.8650	0.000	1	118.6831	1.161	11	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6]HS)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<4>,1|S<4>,3|H<1>}	C[6](C[6]C[6]HS)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.8233	0.683	6	118.6831	1.161	11	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6]HW)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,1|W<7>}	C[6](C[6]C[6]HW)(C[6]C[6]H)(H){1|C<3>,3|H<1>}	H(C[6]C[6]2)	118.8180	0.000	1	118.8400	0.001	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6]HW)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|W<7>,2|C<4>,2|H<1>}	C[6](C[6]C[6]HW)(C[6]C[6]H)(H){1|C<4>,3|H<1>}	H(C[6]C[6]2)	118.8620	0.000	1	118.8400	0.001	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<4>,1|N<3>,3|H<1>}	C[6](C[6]C[6]N[6]H)(C[6]C[6]H)(H){1|Br<1>,1|C<4>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	117.8450	0.000	1	117.8450	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6]SiH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|Si<4>,1|C<3>,2|H<1>}	C[6](C[6]C[6]SiH)(C[6]C[6]H)(H){1|C<3>,3|H<1>}	H(C[6]C[6]2)	118.2717	0.271	4	118.2717	0.074	4	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6]2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[6a]C[6]2)(C[6]C[6]H)(H){1|C<4>,4|C<3>,5|H<1>}	H(C[6]C[6]2)	117.7060	0.000	1	117.7060	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[6a]C[6]C)(C[6]C[6]H)(H){1|C<4>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	117.8250	0.000	1	117.8250	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<2>,2|H<1>}	C[6](C[6]C[6a]C[6]H)(C[6]C[6]H)(H){1|C<4>,1|O<2>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	118.1900	0.000	1	118.1155	0.011	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){2|C<3>,3|H<1>}	C[6](C[6]C[6a]C[6]H)(C[6]C[6]H)(H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	118.0410	0.000	1	118.1155	0.011	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6]N)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>,2|H<1>}	C[6](C[6]C[6a]C[6]N)(C[6]C[6]H)(H){1|C<4>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	117.7470	0.000	1	117.7470	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6]O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>,2|C<4>}	C[6](C[6]C[6a]C[6]O)(C[6]C[6]H)(H){1|C<4>,1|O<2>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	118.7050	0.000	1	118.2460	0.421	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6]O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>,2|C<4>}	C[6](C[6]C[6a]C[6]O)(C[6]C[6]H)(H){1|C<4>,3|C<3>,3|H<1>}	H(C[6]C[6]2)	117.7870	0.000	1	118.2460	0.421	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6a]O[6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<2>,2|H<1>}	C[6](C[6]C[6a]O[6]H)(C[6]C[6]H)(H){1|C<4>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	118.9310	0.000	1	118.9310	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]N[6]CH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<4>,2|H<1>}	C[6](C[6]N[6]CH)(C[6]C[6]H)(H){1|C<4>,4|H<1>}	H(C[6]C[6]2)	117.8550	0.310	2	118.5406	0.635	5	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]N[6]CH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<4>,1|N<3>,3|H<1>}	C[6](C[6]N[6]CH)(C[6]C[6]H)(H){1|C<4>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.7580	0.000	1	118.5406	0.635	5	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]N[6]CH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|N<3>,2|C<4>,2|H<1>}	C[6](C[6]N[6]CH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	118.5410	0.000	1	118.5406	0.635	5	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]N[6]CH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|N<3>,2|C<4>,2|H<1>}	C[6](C[6]N[6]CH)(C[6]C[6]H)(H){2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.6940	0.000	1	118.5406	0.635	5	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]N[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<3>,1|N<3>,3|H<1>}	C[6](C[6]N[6]HH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.5770	0.000	1	120.2928	3.139	6	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]N[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<4>,1|N<3>,3|H<1>}	C[6](C[6]N[6]HH)(C[6]C[6]H)(H){1|C<4>,1|S<4>,2|H<1>}	H(C[6]C[6]2)	121.3293	2.056	3	120.2928	3.139	6	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]N[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|N<3>,4|H<1>}	C[6](C[6]N[6]HH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.0960	0.798	2	120.2928	3.139	6	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]O[6]CH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[6]O[6]CH)(C[6]C[6]H)(H){1|C<4>,2|H<1>}	H(C[6]C[6]2)	121.4410	0.000	1	121.4410	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	C[6](C[6]O[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<3>,1|O<2>,3|H<1>}	C[6](C[6]O[6]HH)(C[6]C[6]H)(H){1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.1050	0.298	2	119.1050	0.089	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HN)(C[6]C[6]H)(H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HN)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[6]CH)(C[6]C[6]H)(H){1|C<4>,1|N<3>,3|H<1>}	H(C[6]C[6]2)	117.9760	0.000	1	118.2157	0.045	3	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HN)(C[6]C[6]H)(H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HN)(C[6]C[6]H)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[6]C[6]CH)(C[6]C[6]H)(H){1|N<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.3355	0.063	2	118.2157	0.045	3	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HN)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HN)(C[6]C[6]H)(H){1|C<4>,1|O<2>,3|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<4>,1|N<3>,1|O<2>,2|H<1>}	H(C[6]C[6]2)	118.7050	0.000	1	119.0941	0.923	9	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HN)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HN)(C[6]C[6]H)(H){1|C<4>,1|O<2>,3|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<4>,1|N<3>,3|H<1>}	H(C[6]C[6]2)	120.0707	1.145	3	119.0941	0.923	9	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HN)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HN)(C[6]C[6]H)(H){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<4>,1|N<3>,3|H<1>}	H(C[6]C[6]2)	118.5860	0.338	5	119.0941	0.923	9	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HN)(C[6]C[6]H)(H)	C[6](C[6]C[6]HO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HN)(C[6]C[6]H)(H){1|C<4>,1|O<1>,1|O<2>,2|H<1>}	C[6](C[6]C[6]HO)(C[6]C[6]H)(H){1|Br<1>,1|C<4>,1|N<2>,2|H<1>}	H(C[6]C[6]2)	112.8680	0.000	1	117.4243	12.069	4	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HN)(C[6]C[6]H)(H)	C[6](C[6]C[6]HO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HN)(C[6]C[6]H)(H){1|C<4>,1|O<2>,3|H<1>}	C[6](C[6]C[6]HO)(C[6]C[6]H)(H){1|C<4>,1|N<3>,3|H<1>}	H(C[6]C[6]2)	119.6015	2.435	2	117.4243	12.069	4	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HN)(C[6]C[6]H)(H)	C[6](C[6]C[6]HO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HN)(C[6]C[6]H)(H){1|C<4>,2|H<1>,2|O<2>}	C[6](C[6]C[6]HO)(C[6]C[6]H)(H){1|Br<1>,1|C<4>,1|N<2>,2|H<1>}	H(C[6]C[6]2)	117.6260	0.000	1	117.4243	12.069	4	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HN)(C[6]C[6]H)(H)	C[6](C[6]C[6]N[5]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HN)(C[6]C[6]H)(H){1|C<3>,1|N<3>,2|H<1>}	C[6](C[6]C[6]N[5]H)(C[6]C[6]H)(H){1|N<2>,1|N<4>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	118.4840	0.372	2	118.4840	0.138	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HO)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]FF)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HO)(C[6]C[6]H)(H){1|O<2>,2|C<4>,2|F<1>}	C[6](C[6]C[5,6]FF)(C[6]C[6]H)(H){1|H<1>,2|C<4>,2|O<2>}	H(C[6]C[6]2)	118.0990	0.000	1	118.0990	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HO)(C[6]C[6]H)(H)	C[6](C[6]C[5a]O[6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HO)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<2>,2|H<1>}	C[6](C[6]C[5a]O[6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|N<2>,1|O<2>}	H(C[6]C[6]2)	118.9850	0.000	1	118.9850	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HO)(C[6]C[6]H)(H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HO)(C[6]C[6]H)(H){2|C<4>,3|H<1>}	C[6](C[6]C[6]CH)(C[6]C[6]H)(H){1|C<4>,1|O<2>,3|H<1>}	H(C[6]C[6]2)	117.8380	0.000	1	117.8380	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HO)(C[6]C[6]H)(H)	C[6](C[6]C[6]CN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HO)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]CN)(C[6]C[6]H)(H){1|C<3>,1|O<2>,2|H<1>}	H(C[6]C[6]2)	118.1375	0.156	2	118.1375	0.024	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HO)(C[6]C[6]H)(H)	C[6](C[6]C[6]CO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HO)(C[6]C[6]H)(H){1|H<1>,2|C<4>,2|O<2>}	C[6](C[6]C[6]CO)(C[6]C[6]H)(H){1|C<4>,2|H<1>,2|O<2>}	H(C[6]C[6]2)	118.2700	0.000	1	118.4170	0.098	3	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HO)(C[6]C[6]H)(H)	C[6](C[6]C[6]CO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HO)(C[6]C[6]H)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[6]C[6]CO)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<2>,2|H<1>}	H(C[6]C[6]2)	118.4905	0.404	2	118.4170	0.098	3	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HO)(C[6]C[6]H)(H)	C[6](C[6]C[6]ClH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HO)(C[6]C[6]H)(H){1|Cl<1>,1|C<4>,1|O<2>,2|H<1>}	C[6](C[6]C[6]ClH)(C[6]C[6]H)(H){1|Cl<1>,1|C<4>,1|O<2>,2|H<1>}	H(C[6]C[6]2)	118.2710	0.000	1	118.7740	0.506	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HO)(C[6]C[6]H)(H)	C[6](C[6]C[6]ClH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HO)(C[6]C[6]H)(H){1|Cl<1>,1|C<4>,1|O<2>,2|H<1>}	C[6](C[6]C[6]ClH)(C[6]C[6]H)(H){1|H<1>,2|C<4>,2|O<2>}	H(C[6]C[6]2)	119.2770	0.000	1	118.7740	0.506	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HO)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HO)(C[6]C[6]H)(H){1|C<4>,1|O<2>,3|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<4>,1|N<3>,1|O<2>,2|H<1>}	H(C[6]C[6]2)	122.8570	0.000	1	119.1367	3.404	6	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HO)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HO)(C[6]C[6]H)(H){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<2>,2|H<1>}	H(C[6]C[6]2)	118.6610	0.000	1	119.1367	3.404	6	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HO)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HO)(C[6]C[6]H)(H){1|N<3>,2|C<4>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<4>,1|O<2>,3|H<1>}	H(C[6]C[6]2)	118.1875	0.414	2	119.1367	3.404	6	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HO)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HO)(C[6]C[6]H)(H){2|C<4>,3|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<2>,2|H<1>}	H(C[6]C[6]2)	118.6530	0.000	1	119.1367	3.404	6	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HO)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HO)(C[6]C[6]H)(H){2|C<4>,3|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<4>,1|O<2>,3|H<1>}	H(C[6]C[6]2)	118.2740	0.000	1	119.1367	3.404	6	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HO)(C[6]C[6]H)(H)	C[6](C[6]C[6]HN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HO)(C[6]C[6]H)(H){1|Br<1>,1|C<4>,1|N<2>,2|H<1>}	C[6](C[6]C[6]HN)(C[6]C[6]H)(H){1|C<4>,1|O<1>,1|O<2>,2|H<1>}	H(C[6]C[6]2)	118.7620	0.000	1	119.5917	1.091	4	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HO)(C[6]C[6]H)(H)	C[6](C[6]C[6]HN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HO)(C[6]C[6]H)(H){1|Br<1>,1|C<4>,1|N<2>,2|H<1>}	C[6](C[6]C[6]HN)(C[6]C[6]H)(H){1|C<4>,2|H<1>,2|O<2>}	H(C[6]C[6]2)	120.5790	0.000	1	119.5917	1.091	4	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HO)(C[6]C[6]H)(H)	C[6](C[6]C[6]HN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HO)(C[6]C[6]H)(H){1|C<4>,1|N<3>,3|H<1>}	C[6](C[6]C[6]HN)(C[6]C[6]H)(H){1|C<4>,1|O<2>,3|H<1>}	H(C[6]C[6]2)	119.5130	1.264	2	119.5917	1.091	4	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HO)(C[6]C[6]H)(H)	C[6](C[6]C[6]HO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HO)(C[6]C[6]H)(H){1|C<4>,1|O<2>,3|H<1>}	C[6](C[6]C[6]HO)(C[6]C[6]H)(H){1|C<4>,2|H<1>,2|O<2>}	H(C[6]C[6]2)	118.1520	0.000	1	118.8712	0.654	12	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HO)(C[6]C[6]H)(H)	C[6](C[6]C[6]HO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HO)(C[6]C[6]H)(H){1|C<4>,2|H<1>,2|O<2>}	C[6](C[6]C[6]HO)(C[6]C[6]H)(H){1|C<4>,1|O<2>,3|H<1>}	H(C[6]C[6]2)	118.7870	0.000	1	118.8712	0.654	12	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HO)(C[6]C[6]H)(H)	C[6](C[6]C[6]HO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HO)(C[6]C[6]H)(H){1|C<4>,2|H<1>,2|O<2>}	C[6](C[6]C[6]HO)(C[6]C[6]H)(H){1|C<4>,2|H<1>,2|O<2>}	H(C[6]C[6]2)	119.1210	0.863	4	118.8712	0.654	12	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HO)(C[6]C[6]H)(H)	C[6](C[6]C[6]HO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HO)(C[6]C[6]H)(H){1|C<4>,2|H<1>,2|O<2>}	C[6](C[6]C[6]HO)(C[6]C[6]H)(H){1|H<1>,2|C<4>,2|O<2>}	H(C[6]C[6]2)	118.8220	0.150	3	118.8712	0.654	12	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HO)(C[6]C[6]H)(H)	C[6](C[6]C[6]HO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HO)(C[6]C[6]H)(H){1|H<1>,2|C<4>,2|O<2>}	C[6](C[6]C[6]HO)(C[6]C[6]H)(H){1|C<4>,2|H<1>,2|O<2>}	H(C[6]C[6]2)	118.8550	1.438	3	118.8712	0.654	12	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HO)(C[6]C[6]H)(H)	C[6](C[6]C[6]N[5]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HO)(C[6]C[6]H)(H){1|C<4>,1|N<3>,1|O<2>,2|H<1>}	C[6](C[6]C[6]N[5]H)(C[6]C[6]H)(H){1|C<4>,1|O<2>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	118.3330	0.000	1	118.3330	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HO)(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6]C)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HO)(C[6]C[6]H)(H){1|C<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6a]C[6]C)(C[6]C[6]H)(H){1|C<4>,2|C<3>,2|H<1>,2|O<2>}	H(C[6]C[6]2)	118.6850	0.000	1	118.6850	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HO)(C[6]C[6]H)(H)	C[6](C[6]C[6a]O[6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HO)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<2>,2|H<1>}	C[6](C[6]C[6a]O[6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<2>,2|C<3>}	H(C[6]C[6]2)	119.3180	0.000	1	119.3180	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HO)(C[6]C[6]H)(H)	C[6](C[6]N[5a]C[6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HO)(C[6]C[6]H)(H){1|C<4>,1|N<3>,1|O<2>,2|H<1>}	C[6](C[6]N[5a]C[6]H)(C[6]C[6]H)(H){1|C<4>,1|N<3>,1|O<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	118.1570	0.000	1	118.1570	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HO)(C[6]C[6]H)(H)	C[6](C[6]N[5a]O[6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HO)(C[6]C[6]H)(H){1|C<4>,1|N<3>,1|O<2>,2|H<1>}	C[6](C[6]N[5a]O[6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|N<2>,1|O<2>}	H(C[6]C[6]2)	119.3590	0.000	1	119.3590	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HO)(C[6]C[6]H)(H)	C[6](C[6]N[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HO)(C[6]C[6]H)(H){1|C<4>,1|N<3>,3|H<1>}	C[6](C[6]N[6]HH)(C[6]C[6]H)(H){1|C<4>,1|H<1>,2|O<2>}	H(C[6]C[6]2)	118.9390	0.096	2	118.9390	0.009	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HO)(C[6]C[6]H)(H)	C[6](C[6]O[6]CH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HO)(C[6]C[6]H)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[6]O[6]CH)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	116.6720	1.690	3	116.6720	2.858	3	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HO)(C[6]C[6]H)(H)	C[6](C[6]O[6]HO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HO)(C[6]C[6]H)(H){1|C<4>,2|H<1>,2|O<2>}	C[6](C[6]O[6]HO)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.1960	0.000	1	119.1143	0.005	3	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HO)(C[6]C[6]H)(H)	C[6](C[6]O[6]HO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HO)(C[6]C[6]H)(H){2|O<2>,3|H<1>}	C[6](C[6]O[6]HO)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.0735	0.022	2	119.1143	0.005	3	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HO)(C[6]C[6]H)(H)	C[6](C[6]O[6]HS)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HO)(C[6]C[6]H)(H){1|C<4>,1|O<2>,1|S<2>,2|H<1>}	C[6](C[6]O[6]HS)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	118.8610	0.191	2	118.8610	0.036	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HS)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HS)(C[6]C[6]H)(H){1|Br<1>,1|C<3>,1|C<4>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<4>,1|S<4>,3|H<1>}	H(C[6]C[6]2)	121.9240	0.660	2	119.9395	2.667	11	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HS)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HS)(C[6]C[6]H)(H){1|C<3>,1|C<4>,3|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<4>,1|S<4>,3|H<1>}	H(C[6]C[6]2)	118.2860	0.000	1	119.9395	2.667	11	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HS)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HS)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<4>,1|S<4>,3|H<1>}	H(C[6]C[6]2)	119.6795	1.533	6	119.9395	2.667	11	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HS)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HS)(C[6]C[6]H)(H){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<4>,1|S<2>,3|H<1>}	H(C[6]C[6]2)	120.8240	0.000	1	119.9395	2.667	11	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HS)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HS)(C[6]C[6]H)(H){2|C<4>,3|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<4>,1|O<2>,1|S<4>,2|H<1>}	H(C[6]C[6]2)	118.3000	0.000	1	119.9395	2.667	11	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HS)(C[6]C[6]H)(H)	C[6](C[6]N[6]CH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HS)(C[6]C[6]H)(H){1|N<3>,2|C<4>,2|H<1>}	C[6](C[6]N[6]CH)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|S<3>,1|S<4>}	H(C[6]C[6]2)	119.2815	0.350	2	119.2815	0.123	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HW)(C[6]C[6]H)(H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HW)(C[6]C[6]H)(H){1|C<3>,1|C<4>,2|H<1>}	C[6](C[6]C[6]CH)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<1>,1|W<7>}	H(C[6]C[6]2)	116.8770	0.000	1	117.5050	0.789	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HW)(C[6]C[6]H)(H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HW)(C[6]C[6]H)(H){2|C<4>,2|H<1>}	C[6](C[6]C[6]CH)(C[6]C[6]H)(H){1|C<4>,1|W<7>,3|H<1>}	H(C[6]C[6]2)	118.1330	0.000	1	117.5050	0.789	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HW)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HW)(C[6]C[6]H)(H){1|C<3>,3|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,1|W<7>}	H(C[6]C[6]2)	119.1200	0.000	1	118.8725	0.123	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]HW)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]HW)(C[6]C[6]H)(H){1|C<4>,3|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|W<7>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.6250	0.000	1	118.8725	0.123	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]IrH)(C[6]C[6]H)(H)	C[6](C[6]C[6]IrH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]IrH)(C[6]C[6]H)(H){1|C<4>,2|H<1>}	C[6](C[6]C[6]IrH)(C[6]C[6]H)(H){1|C<4>,2|H<1>}	H(C[6]C[6]2)	122.7310	0.440	4	122.7310	0.193	4	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[5]H)(C[6]C[6]H)(H)	C[6](C[6]C[6]HN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[5]H)(C[6]C[6]H)(H){1|N<2>,1|N<4>,2|C<3>,2|H<1>}	C[6](C[6]C[6]HN)(C[6]C[6]H)(H){1|C<3>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	118.0740	0.376	2	118.0740	0.142	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[5]H)(C[6]C[6]H)(H)	C[6](C[6]C[6]HO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[5]H)(C[6]C[6]H)(H){1|C<4>,1|O<2>,2|C<3>,3|H<1>}	C[6](C[6]C[6]HO)(C[6]C[6]H)(H){1|C<4>,1|N<3>,1|O<2>,2|H<1>}	H(C[6]C[6]2)	118.5320	0.000	1	118.5320	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[5]H)(C[6]C[6]H)(H)	C[6](C[6]O[6]CH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[5]H)(C[6]C[6]H)(H){1|O<2>,2|C<3>,2|C<4>,2|H<1>}	C[6](C[6]O[6]CH)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.1660	0.520	2	119.1660	0.271	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]2H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6]C)(C[6]C[6]H)(H){2|C<4>,2|H<1>,3|C<3>}	C[6](C[6]C[6]2H)(C[6]C[6]H)(H){1|C<3>,1|O<1>,2|N<3>,3|C<4>}	H(C[6]C[6]2)	120.8590	0.000	1	120.8590	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6]2H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6]H)(C[6]C[6]H)(H){1|C<4>,2|H<1>,3|C<3>}	C[6](C[6]C[6]2H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<1>,2|H<1>,2|N<2>}	H(C[6]C[6]2)	122.1290	0.000	1	122.1290	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6]H)(C[6]C[6]H)(H){1|Br<1>,1|C<4>,2|C<3>,3|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<4>,1|N<3>,3|H<1>}	H(C[6]C[6]2)	118.7450	0.000	1	118.7450	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]N[6]H)(C[6]C[6]H)(H)	C[6](C[6]N[5a]C[6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6]H)(C[6]C[6]H)(H){1|C<3>,1|N<3>,2|C<4>,2|H<1>}	C[6](C[6]N[5a]C[6]H)(C[6]C[6]H)(H){2|C<3>,2|H<1>,2|N<3>}	H(C[6]C[6]2)	117.8505	0.199	2	117.8505	0.039	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Re2)(C[6]C[6]H)(H)	C[6](C[6]C[6]ReH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Re2)(C[6]C[6]H)(H){1|Re<7>,1|C<4>,2|H<1>}	C[6](C[6]C[6]ReH)(C[6]C[6]H)(H){3|Re<6>,1|C<3>}	H(C[6]C[6]2)	118.5660	0.000	1	118.5660	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]ReH)(C[6]C[6]H)(H)	C[6](C[6]C[6]Re2)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]ReH)(C[6]C[6]H)(H){3|Re<6>,1|C<3>}	C[6](C[6]C[6]Re2)(C[6]C[6]H)(H){1|Re<7>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.8550	0.000	1	119.8550	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]SiH)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]SiH)(C[6]C[6]H)(H){1|C<3>,3|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|Si<4>,1|C<3>,2|H<1>}	H(C[6]C[6]2)	117.9142	0.105	4	117.9142	0.011	4	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]YbC)(C[6]C[6]H)(H)	C[6](C[6]C[6]YbH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]YbC)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<2>}	C[6](C[6]C[6]YbH)(C[6]C[6]H)(H){3|C<4>}	H(C[6]C[6]2)	119.1080	0.000	1	119.1080	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]YbH)(C[6]C[6]H)(H)	C[6](C[6]C[6]YbC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]YbH)(C[6]C[6]H)(H){3|C<4>}	C[6](C[6]C[6]YbC)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<2>}	H(C[6]C[6]2)	120.7900	0.000	1	120.7900	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6]2)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]2)(C[6]C[6]H)(H){1|C<4>,4|C<3>,5|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.2580	0.000	1	118.2580	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]C)(C[6]C[6]H)(H){1|C<4>,2|C<3>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.1850	0.000	1	118.1850	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6]C)(C[6]C[6]H)(H)	C[6](C[6]C[6]HO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]C)(C[6]C[6]H)(H){1|C<4>,2|C<3>,2|H<1>,2|O<2>}	C[6](C[6]C[6]HO)(C[6]C[6]H)(H){1|C<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	117.3740	0.000	1	117.3740	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]H)(C[6]C[6]H)(H){1|C<4>,1|O<2>,2|C<3>,3|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<2>,2|H<1>}	H(C[6]C[6]2)	117.9350	0.000	1	117.8595	0.011	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]H)(C[6]C[6]H)(H){1|C<4>,2|H<1>,3|C<3>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){2|C<3>,3|H<1>}	H(C[6]C[6]2)	117.7840	0.000	1	117.8595	0.011	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]H)(C[6]C[6]H)(H){1|H<1>,5|C<3>}	C[6](C[6]C[6a]C[6]H)(C[6]C[6]H)(H){1|H<1>,5|C<3>}	H(C[6]C[6]2)	117.8025	0.296	2	117.8025	0.088	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6]O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]H)(C[6]C[6]H)(H){1|H<1>,1|O<2>,4|C<3>}	C[6](C[6]C[6a]C[6]O)(C[6]C[6]H)(H){2|H<1>,4|C<3>}	H(C[6]C[6]2)	118.2505	0.163	4	118.2505	0.026	4	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6]H)(C[6]C[6]H)(H)	C[6](C[6]N[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]H)(C[6]C[6]H)(H){1|N<3>,2|C<3>,4|H<1>}	C[6](C[6]N[6]HH)(C[6]C[6]H)(H){1|C<4>,1|H<1>,2|C<3>}	H(C[6]C[6]2)	118.2550	0.000	1	118.2550	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6]N)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]N)(C[6]C[6]H)(H){1|C<4>,2|C<3>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	118.2160	0.000	1	118.2160	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6]Ni)(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6]Ni)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]Ni)(C[6]C[6]H)(H){1|Ni<5>,1|C<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6a]C[6]Ni)(C[6]C[6]H)(H){1|Ni<5>,1|C<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	120.2665	0.499	2	120.2665	0.249	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6]O)(C[6]C[6]H)(H)	C[6](C[6]C[6]CO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]O)(C[6]C[6]H)(H){1|C<2>,1|H<1>,1|O<2>,3|C<3>}	C[6](C[6]C[6]CO)(C[6]C[6]H)(H){1|H<1>,1|O<2>,2|C<3>}	H(C[6]C[6]2)	121.1040	0.519	2	121.8430	5.540	6	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6]O)(C[6]C[6]H)(H)	C[6](C[6]C[6]CO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]O)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<2>,3|C<3>}	C[6](C[6]C[6]CO)(C[6]C[6]H)(H){1|H<1>,1|O<2>,2|C<3>}	H(C[6]C[6]2)	122.2125	2.932	4	121.8430	5.540	6	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6]O)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]O)(C[6]C[6]H)(H){1|C<4>,1|O<2>,2|C<3>,3|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<1>,2|C<4>}	H(C[6]C[6]2)	117.2940	0.000	1	117.7935	0.499	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6]O)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]O)(C[6]C[6]H)(H){1|C<4>,3|C<3>,3|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|O<2>,2|C<4>}	H(C[6]C[6]2)	118.2930	0.000	1	117.7935	0.499	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6]O)(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]O)(C[6]C[6]H)(H){2|H<1>,4|C<3>}	C[6](C[6]C[6a]C[6]H)(C[6]C[6]H)(H){1|H<1>,1|O<2>,4|C<3>}	H(C[6]C[6]2)	117.9270	0.174	4	117.9270	0.030	4	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6]O)(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6]O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]O)(C[6]C[6]H)(H){1|H<1>,1|O<2>,4|C<3>}	C[6](C[6]C[6a]C[6]O)(C[6]C[6]H)(H){1|H<1>,1|O<2>,4|C<3>}	H(C[6]C[6]2)	118.0462	0.983	44	118.0462	0.967	44	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6]Pd)(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6]Pd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]Pd)(C[6]C[6]H)(H){1|Pd<4>,1|C<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6a]C[6]Pd)(C[6]C[6]H)(H){1|Pd<5>,1|C<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.2900	0.000	1	119.0980	0.083	6	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6]Pd)(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6]Pd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]Pd)(C[6]C[6]H)(H){1|Pd<5>,1|C<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6a]C[6]Pd)(C[6]C[6]H)(H){1|Pd<4>,1|C<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.2230	0.000	1	119.0980	0.083	6	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6]Pd)(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6]Pd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]Pd)(C[6]C[6]H)(H){1|Pd<5>,1|C<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6a]C[6]Pd)(C[6]C[6]H)(H){1|Pd<5>,1|C<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	119.2185	0.040	2	119.0980	0.083	6	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]C[6]Pd)(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6]Pd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]Pd)(C[6]C[6]H)(H){1|Pd<6>,1|C<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6a]C[6]Pd)(C[6]C[6]H)(H){1|Pd<6>,1|C<4>,1|H<1>,3|C<3>}	H(C[6]C[6]2)	118.8190	0.420	2	119.0980	0.083	6	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]N[6]H)(C[6]C[6]H)(H)	C[6](C[6]O[6]CO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]N[6]H)(C[6]C[6]H)(H){2|O<2>,4|C<3>}	C[6](C[6]O[6]CO)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.6900	0.000	1	121.6900	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]O[6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]O[6]H)(C[6]C[6]H)(H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<2>,2|H<1>}	H(C[6]C[6]2)	118.5930	0.000	1	118.5930	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6a]O[6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6]HO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6a]O[6]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<2>,2|C<3>}	C[6](C[6]C[6]HO)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<2>,2|H<1>}	H(C[6]C[6]2)	118.6400	0.000	1	118.6400	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[3,6]C[6a]H)(C[6]C[6]H)(H)	C[6](C[6]C[3,6]C[6a]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[3,6]C[6a]H)(C[6]C[6]H)(H){1|H<1>,2|C<4>,3|C<3>}	C[6](C[6]C[3,6]C[6a]H)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,4|C<3>}	H(C[6]C[6]2)	118.8830	0.000	1	118.8830	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]HH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,2|H<1>}	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	118.0260	0.000	1	118.0260	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5,6]HO)(C[6]C[6]H)(H)	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5,6]HO)(C[6]C[6]H)(H){1|C<3>,1|C<4>,2|H<1>}	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(H){1|C<3>,1|N<3>,1|O<2>,2|H<1>}	H(C[6]C[6]2)	117.8520	0.000	1	117.8520	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5a,6]CH)(C[6]C[6]H)(H)	C[6](C[6]N[5a,6]CH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5a,6]CH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]N[5a,6]CH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	122.4985	2.314	2	122.4985	5.356	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5a,6]CH)(C[6]C[6]H)(H)	C[6](C[6]N[5a,6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5a,6]CH)(C[6]C[6]H)(H){1|C<3>,1|N<3>,2|H<1>}	C[6](C[6]N[5a,6]HH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	118.9260	0.000	1	118.9260	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5a,6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]CH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5a,6]HH)(C[6]C[6]H)(H){1|C<4>,1|H<1>,2|C<3>}	C[6](C[6]C[5a,6]CH)(C[6]C[6]H)(H){1|C<3>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	117.9550	0.000	1	117.9550	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5a,6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]C[6a]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5a,6]HH)(C[6]C[6]H)(H){1|H<1>,3|C<3>}	C[6](C[6]C[5a,6]C[6a]H)(C[6]C[6]H)(H){1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	117.7050	0.000	1	117.7050	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5a,6]HH)(C[6]C[6]H)(H)	C[6](C[6]N[5a,6]CH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5a,6]HH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]N[5a,6]CH)(C[6]C[6]H)(H){1|C<3>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	117.4980	0.000	1	117.4980	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5a,6]HO)(C[6]C[6]H)(H)	C[6](C[6]C[5a,6]HO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5a,6]HO)(C[6]C[6]H)(H){1|H<1>,1|O<2>,2|C<3>}	C[6](C[6]C[5a,6]HO)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>,1|O<2>}	H(C[6]C[6]2)	122.7620	0.000	1	122.7620	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5a]C[6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5a]C[6]H)(C[6]C[6]H)(H){1|C<4>,1|N<3>,2|C<3>,2|H<1>}	C[6](C[6]C[6]CH)(C[6]C[6]H)(H){1|C<3>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	118.5235	0.351	2	118.5235	0.124	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5a]C[6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6]HO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5a]C[6]H)(C[6]C[6]H)(H){1|C<4>,1|N<3>,1|O<2>,2|C<3>,2|H<1>}	C[6](C[6]C[6]HO)(C[6]C[6]H)(H){1|C<4>,1|N<3>,1|O<2>,2|H<1>}	H(C[6]C[6]2)	118.6210	0.000	1	118.6210	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5a]C[6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6]N[6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5a]C[6]H)(C[6]C[6]H)(H){2|C<3>,2|H<1>,2|N<3>}	C[6](C[6]C[6]N[6]H)(C[6]C[6]H)(H){1|C<3>,1|N<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.5180	0.204	2	118.5180	0.041	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[5a]O[6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6]HO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[5a]O[6]H)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|N<2>,1|O<2>}	C[6](C[6]C[6]HO)(C[6]C[6]H)(H){1|C<4>,1|N<3>,1|O<2>,2|H<1>}	H(C[6]C[6]2)	118.8950	0.000	1	118.8950	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]HH)(C[6]C[6]H)(H)	C[6](C[6]B[6,6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]HH)(C[6]C[6]H)(H){1|B<4>,1|C<4>,3|H<1>}	C[6](C[6]B[6,6]HH)(C[6]C[6]H)(H){1|C<4>,1|N<4>,1|O<2>,2|H<1>}	H(C[6]C[6]2)	117.6787	0.616	4	117.6787	0.379	4	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]HH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,2|H<1>}	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H){1|C<4>,1|N<3>,1|O<2>,2|H<1>}	H(C[6]C[6]2)	119.0783	1.416	3	119.7070	2.918	4	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6,6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6,6]HH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,2|H<1>}	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(H){1|C<4>,1|N<3>,3|H<1>}	H(C[6]C[6]2)	121.5930	0.000	1	119.7070	2.918	4	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]CH)(C[6]C[6]H)(H)	C[6](C[6]C[4]C[6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]CH)(C[6]C[6]H)(H){1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[4]C[6]H)(C[6]C[6]H)(H){1|H<1>,1|N<3>,1|O<1>,2|C<3>,2|C<4>}	H(C[6]C[6]2)	119.9360	0.000	1	119.9360	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]CH)(C[6]C[6]H)(H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]CH)(C[6]C[6]H)(H){1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[6]CH)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,1|O<1>}	H(C[6]C[6]2)	118.4575	0.745	4	118.5652	0.475	5	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]CH)(C[6]C[6]H)(H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]CH)(C[6]C[6]H)(H){1|Mn<6>,1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]CH)(C[6]C[6]H)(H){1|H<1>,1|N<3>,2|C<4>}	H(C[6]C[6]2)	118.9960	0.000	1	118.5652	0.475	5	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]CH)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]CH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|N<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	117.7630	0.000	1	117.7310	0.190	5	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]CH)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]CH)(C[6]C[6]H)(H){1|C<4>,1|N<3>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<4>,1|N<3>,3|H<1>}	H(C[6]C[6]2)	117.2630	0.000	1	117.7310	0.190	5	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]CH)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]CH)(C[6]C[6]H)(H){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|N<4>,2|H<1>}	H(C[6]C[6]2)	117.6015	0.153	2	117.7310	0.190	5	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]CH)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]CH)(C[6]C[6]H)(H){2|C<4>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|N<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.4260	0.000	1	117.7310	0.190	5	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]CH)(C[6]C[6]H)(H)	C[6](C[6]C[6]HS)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]CH)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|S<3>,1|S<4>}	C[6](C[6]C[6]HS)(C[6]C[6]H)(H){1|N<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	117.1000	0.216	2	117.1000	0.047	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]CH)(C[6]C[6]H)(H)	C[6](C[6]O[6]CC)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]CH)(C[6]C[6]H)(H){1|C<4>,1|O<2>,2|C<3>}	C[6](C[6]O[6]CC)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	121.8050	0.000	1	121.8050	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]CH)(C[6]C[6]H)(H)	C[6](C[6]O[6]CH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]CH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|O<2>}	C[6](C[6]O[6]CH)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	118.9480	0.000	1	118.9480	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]CH)(C[6]C[6]H)(H)	C[6](C[6]S[6]CH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]CH)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|S<3>,1|S<4>}	C[6](C[6]S[6]CH)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,1|O<1>}	H(C[6]C[6]2)	116.4610	0.000	1	116.4610	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]CH)(C[6]C[6]H)(H)	C[6](C[6]S[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]CH)(C[6]C[6]H)(H){1|C<3>,1|S<3>,2|H<1>}	C[6](C[6]S[6]HH)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,1|O<1>}	H(C[6]C[6]2)	116.5820	0.000	1	116.7470	0.054	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]CH)(C[6]C[6]H)(H)	C[6](C[6]S[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]CH)(C[6]C[6]H)(H){1|S<3>,1|S<4>,2|H<1>}	C[6](C[6]S[6]HH)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,1|O<1>}	H(C[6]C[6]2)	116.9120	0.000	1	116.7470	0.054	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]HH)(C[6]C[6]H)(H)	C[6](C[6]B[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]HH)(C[6]C[6]H)(H){1|B<3>,1|C<4>,2|H<1>}	C[6](C[6]B[6]HH)(C[6]C[6]H)(H){2|H<1>,2|N<3>}	H(C[6]C[6]2)	120.9265	0.977	2	120.9265	0.954	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6]FH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]HH)(C[6]C[6]H)(H){1|C<4>,1|F<1>,1|H<1>,1|S<4>}	C[6](C[6]C[6]FH)(C[6]C[6]H)(H){1|N<3>,4|H<1>}	H(C[6]C[6]2)	118.1620	0.000	1	118.1620	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]HH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<3>,1|N<3>,3|H<1>}	H(C[6]C[6]2)	117.0050	0.000	1	118.7950	2.312	6	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]HH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|N<3>,4|H<1>}	H(C[6]C[6]2)	118.7715	1.104	2	118.7950	2.312	6	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]HH)(C[6]C[6]H)(H){1|C<4>,1|S<4>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<4>,1|N<3>,3|H<1>}	H(C[6]C[6]2)	119.4073	1.734	3	118.7950	2.312	6	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6]HO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]HH)(C[6]C[6]H)(H){1|C<4>,1|H<1>,2|O<2>}	C[6](C[6]C[6]HO)(C[6]C[6]H)(H){1|C<4>,1|N<3>,3|H<1>}	H(C[6]C[6]2)	118.8270	0.126	2	118.8270	0.016	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6a]C[6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]HH)(C[6]C[6]H)(H){1|C<4>,1|H<1>,2|C<3>}	C[6](C[6]C[6a]C[6]H)(C[6]C[6]H)(H){1|N<3>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	118.4300	0.000	1	118.4300	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]HH)(C[6]C[6]H)(H)	C[6](C[6]N[6]HN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]HH)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>,1|N<3>}	C[6](C[6]N[6]HN)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	H(C[6]C[6]2)	118.1350	0.000	1	118.0950	0.003	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]HH)(C[6]C[6]H)(H)	C[6](C[6]N[6]HN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]HH)(C[6]C[6]H)(H){1|C<3>,1|H<1>,2|N<3>}	C[6](C[6]N[6]HN)(C[6]C[6]H)(H){1|C<3>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	118.0550	0.000	1	118.0950	0.003	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]HH)(C[6]C[6]H)(H)	C[6](C[6]O[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]HH)(C[6]C[6]H)(H){1|Pt<4>,1|O<2>,3|H<1>}	C[6](C[6]O[6]HH)(C[6]C[6]H)(H){1|N<4>,2|H<1>}	H(C[6]C[6]2)	119.5890	0.843	2	119.5890	0.710	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]HN)(C[6]C[6]H)(H)	C[6](C[6]N[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]HN)(C[6]C[6]H)(H){1|C<3>,1|N<3>,2|H<1>}	C[6](C[6]N[6]HH)(C[6]C[6]H)(H){1|C<3>,1|H<1>,2|N<3>}	H(C[6]C[6]2)	118.8980	0.000	1	119.3550	0.418	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]HN)(C[6]C[6]H)(H)	C[6](C[6]N[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]HN)(C[6]C[6]H)(H){1|N<3>,2|H<1>}	C[6](C[6]N[6]HH)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<2>,1|N<3>}	H(C[6]C[6]2)	119.8120	0.000	1	119.3550	0.418	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]HN)(C[6]C[6]H)(H)	C[6](C[6]O[6]CH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6]HN)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|O<2>}	C[6](C[6]O[6]CH)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	H(C[6]C[6]2)	119.5690	0.000	1	119.5690	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6a]C[6]H)(C[6]C[6]H)(H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]N[6a]C[6]H)(C[6]C[6]H)(H){1|F<1>,2|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[6]CH)(C[6]C[6]H)(H){1|C<4>,1|N<3>,1|O<2>,2|H<1>}	H(C[6]C[6]2)	119.0050	0.000	1	119.0050	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]O[6]CC)(C[6]C[6]H)(H)	C[6](C[6]N[6]CH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]O[6]CC)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]N[6]CH)(C[6]C[6]H)(H){1|C<4>,1|O<2>,2|C<3>}	H(C[6]C[6]2)	124.0720	0.000	1	124.0720	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]O[6]CH)(C[6]C[6]H)(H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]O[6]CH)(C[6]C[6]H)(H){1|H<1>,2|C<4>}	C[6](C[6]C[6]CH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|O<2>,2|H<1>}	H(C[6]C[6]2)	118.6620	0.000	1	118.6620	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]O[6]CH)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]O[6]CH)(C[6]C[6]H)(H){1|C<4>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|O<2>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	123.2490	0.000	1	123.2490	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]O[6]CH)(C[6]C[6]H)(H)	C[6](C[6]C[6]HO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]O[6]CH)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<2>}	C[6](C[6]C[6]HO)(C[6]C[6]H)(H){1|O<2>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	122.0820	2.298	3	122.0820	5.283	3	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]O[6]CH)(C[6]C[6]H)(H)	C[6](C[6]C[6]N[5]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]O[6]CH)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]C[6]N[5]H)(C[6]C[6]H)(H){1|O<2>,2|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.7490	0.378	2	118.7490	0.143	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]O[6]CH)(C[6]C[6]H)(H)	C[6](C[6]N[6]CH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]O[6]CH)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]N[6]CH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.0630	0.000	1	119.0630	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]O[6]CH)(C[6]C[6]H)(H)	C[6](C[6]N[6]HN)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]O[6]CH)(C[6]C[6]H)(H){1|H<1>,2|N<3>}	C[6](C[6]N[6]HN)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	118.5370	0.000	1	118.5370	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]O[6]CO)(C[6]C[6]H)(H)	C[6](C[6]C[6a]N[6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]O[6]CO)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6a]N[6]H)(C[6]C[6]H)(H){2|O<2>,4|C<3>}	H(C[6]C[6]2)	121.4270	0.000	1	121.4270	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]O[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]O[6]HH)(C[6]C[6]H)(H){1|C<4>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(H){1|C<3>,1|O<2>,3|H<1>}	H(C[6]C[6]2)	119.1625	0.426	2	119.1625	0.182	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]O[6]HH)(C[6]C[6]H)(H)	C[6](C[6]N[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]O[6]HH)(C[6]C[6]H)(H){1|N<4>,2|H<1>}	C[6](C[6]N[6]HH)(C[6]C[6]H)(H){1|Pt<4>,1|O<2>,3|H<1>}	H(C[6]C[6]2)	118.9895	0.303	2	118.9895	0.092	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]O[6]HO)(C[6]C[6]H)(H)	C[6](C[6]C[6]HO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]O[6]HO)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<2>}	C[6](C[6]C[6]HO)(C[6]C[6]H)(H){1|C<4>,2|H<1>,2|O<2>}	H(C[6]C[6]2)	119.0900	0.000	1	119.0097	0.034	3	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]O[6]HO)(C[6]C[6]H)(H)	C[6](C[6]C[6]HO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]O[6]HO)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<2>}	C[6](C[6]C[6]HO)(C[6]C[6]H)(H){2|O<2>,3|H<1>}	H(C[6]C[6]2)	118.9695	0.243	2	119.0097	0.034	3	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]O[6]HS)(C[6]C[6]H)(H)	C[6](C[6]C[6]HO)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]O[6]HS)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|O<2>}	C[6](C[6]C[6]HO)(C[6]C[6]H)(H){1|C<4>,1|O<2>,1|S<2>,2|H<1>}	H(C[6]C[6]2)	119.4365	0.064	2	119.4365	0.004	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]S[6]CH)(C[6]C[6]H)(H)	C[6](C[6]N[6]CH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]S[6]CH)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,1|O<1>}	C[6](C[6]N[6]CH)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|S<3>,1|S<4>}	H(C[6]C[6]2)	118.1160	0.000	1	118.1160	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]S[6]HH)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]CH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]S[6]HH)(C[6]C[6]H)(H){1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6,6]CH)(C[6]C[6]H)(H){1|S<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	117.1740	0.000	1	117.1740	0.000	1	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]S[6]HH)(C[6]C[6]H)(H)	C[6](C[6]N[6]CH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]S[6]HH)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,1|O<1>}	C[6](C[6]N[6]CH)(C[6]C[6]H)(H){1|C<3>,1|S<3>,2|H<1>}	H(C[6]C[6]2)	117.2120	0.000	1	116.9550	0.132	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]S[6]HH)(C[6]C[6]H)(H)	C[6](C[6]N[6]CH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]S[6]HH)(C[6]C[6]H)(H){1|C<4>,1|H<1>,1|N<3>,1|O<1>}	C[6](C[6]N[6]CH)(C[6]C[6]H)(H){1|S<3>,1|S<4>,2|H<1>}	H(C[6]C[6]2)	116.6980	0.000	1	116.9550	0.132	2	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]S[6]HH)(C[6]C[6]H)(H)	C[6](C[6]S[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]S[6]HH)(C[6]C[6]H)(H){1|Ru<6>,1|S<3>,2|H<1>}	C[6](C[6]S[6]HH)(C[6]C[6]H)(H){1|Ru<6>,1|S<3>,2|H<1>}	H(C[6]C[6]2)	115.6860	0.447	2	118.4315	10.423	4	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]S[6]HH)(C[6]C[6]H)(H)	C[6](C[6]S[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]S[6]HH)(C[6]C[6]H)(H){1|S<2>,1|W<6>,2|H<1>}	C[6](C[6]S[6]HH)(C[6]C[6]H)(H){1|S<3>,2|H<1>}	H(C[6]C[6]2)	120.4990	0.000	1	118.4315	10.423	4	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]S[6]HH)(C[6]C[6]H)(H)	C[6](C[6]S[6]HH)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]S[6]HH)(C[6]C[6]H)(H){1|S<3>,2|H<1>}	C[6](C[6]S[6]HH)(C[6]C[6]H)(H){1|S<2>,1|W<6>,2|H<1>}	H(C[6]C[6]2)	121.8550	0.000	1	118.4315	10.423	4	118.7474	3.160	926	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:I-1:	C[6]-3:	C[6](C[6]C[6]CC)(C[6]C[6]I)(H)	C[6](C[6]C[3,6]C[6]O)(C[6]C[6]H)(I)	H(C[6]C[6]2)	C[6](C[6]C[6]CC)(C[6]C[6]I)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[6]C[3,6]C[6]O)(C[6]C[6]H)(I){1|C<3>,2|H<1>,5|C<4>}	H(C[6]C[6]2)	117.9510	0.079	2	117.9510	0.006	2	118.5141	0.573	7	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:I-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]I)(H)	C[6](C[6]C[6]ClH)(C[6]C[6]H)(I)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]I)(H){1|Cl<1>,1|C<4>,3|H<1>}	C[6](C[6]C[6]ClH)(C[6]C[6]H)(I){1|C<4>,1|O<2>,3|H<1>}	H(C[6]C[6]2)	119.2140	0.000	1	119.2140	0.000	1	118.5141	0.573	7	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:I-1:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]I)(H)	C[6](C[6]C[6]HO)(C[6]C[6]H)(I)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]I)(H){1|C<4>,2|H<1>,2|O<2>}	C[6](C[6]C[6]HO)(C[6]C[6]H)(I){2|C<4>,3|H<1>}	H(C[6]C[6]2)	118.6000	0.000	1	118.6000	0.000	1	118.5141	0.573	7	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:I-1:	C[6]-3:	C[6](C[6]C[6]HO)(C[6]C[6]I)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(I)	H(C[6]C[6]2)	C[6](C[6]C[6]HO)(C[6]C[6]I)(H){1|C<4>,1|N<3>,3|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(I){1|C<4>,1|N<3>,1|O<2>,2|H<1>}	H(C[6]C[6]2)	117.5520	0.000	1	117.5520	0.000	1	118.5141	0.573	7	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:I-1:	C[6]-3:	C[6](C[6]C[6]HO)(C[6]C[6]I)(H)	C[6](C[6]C[6]HO)(C[6]C[6]H)(I)	H(C[6]C[6]2)	C[6](C[6]C[6]HO)(C[6]C[6]I)(H){1|C<4>,2|H<1>,2|O<2>}	C[6](C[6]C[6]HO)(C[6]C[6]H)(I){1|C<4>,2|H<1>,2|O<2>}	H(C[6]C[6]2)	119.1655	0.725	2	119.1655	0.525	2	118.5141	0.573	7	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:O-1:	C[6]-3:	C[6](C[6]C[6,6]HH)(C[6]C[6]O)(H)	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(O)	H(C[6]C[6]2)	C[6](C[6]C[6,6]HH)(C[6]C[6]O)(H){1|C<3>,1|C<4>,3|H<1>}	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(O){2|C<4>,2|H<1>}	H(C[6]C[6]2)	102.0440	0.000	1	102.0440	0.000	1	102.0440	0.000	1	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	P[6]-4:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6,6a]CC)(C[6]P[6]Br)(H)	C[6](P[6]C[6,6a]C[6a]Pd)(C[6]C[6]H)(Br)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]CC)(C[6]P[6]Br)(H){1|Pd<4>,3|C<3>}	C[6](P[6]C[6,6a]C[6a]Pd)(C[6]C[6]H)(Br){2|C<4>,4|C<3>}	H(C[6]C[6]2)	117.3720	0.000	1	117.3720	0.000	1	116.5503	0.629	4	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	P[6]-4:C[6]-3:Br-1:	C[6]-3:	C[6](C[6]C[6,6a]CC)(C[6]P[6]Br)(H)	C[6](P[6]C[6,6a]C[6a]Pt)(C[6]C[6]H)(Br)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]CC)(C[6]P[6]Br)(H){1|Pt<4>,3|C<3>}	C[6](P[6]C[6,6a]C[6a]Pt)(C[6]C[6]H)(Br){2|C<4>,4|C<3>}	H(C[6]C[6]2)	116.2763	0.703	3	116.2763	0.494	3	116.5503	0.629	4	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	P[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]CC)(C[6]P[6]H)(H)	C[6](P[6]C[6,6a]C[6a]O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]CC)(C[6]P[6]H)(H){1|O<1>,3|C<3>}	C[6](P[6]C[6,6a]C[6a]O)(C[6]C[6]H)(H){2|C<4>,4|C<3>}	H(C[6]C[6]2)	115.2990	0.000	1	115.2990	0.000	1	115.9993	1.321	4	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	P[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]CC)(C[6]P[6]H)(H)	C[6](P[6]C[6,6a]C[6a]Pd)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]CC)(C[6]P[6]H)(H){1|Pd<4>,3|C<3>}	C[6](P[6]C[6,6a]C[6a]Pd)(C[6]C[6]H)(H){2|C<4>,4|C<3>}	H(C[6]C[6]2)	117.2740	0.000	1	117.2740	0.000	1	115.9993	1.321	4	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	P[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6a]CC)(C[6]P[6]H)(H)	C[6](P[6]C[6,6a]C[6a]Pt)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]CC)(C[6]P[6]H)(H){1|Pt<4>,3|C<3>}	C[6](P[6]C[6,6a]C[6a]Pt)(C[6]C[6]H)(H){2|C<4>,4|C<3>}	H(C[6]C[6]2)	115.7120	1.297	2	115.7120	1.682	2	115.9993	1.321	4	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	C[6]-4:C[6]-3:H-1:	Si[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]CH)(C[6]Si[6]H)(H)	C[6](Si[6]C[6a]C[6]O)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6]CH)(C[6]Si[6]H)(H){1|H<1>,1|O<2>,2|C<3>}	C[6](Si[6]C[6a]C[6]O)(C[6]C[6]H)(H){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	116.2735	0.612	2	116.2735	0.374	2	116.2735	0.374	2	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	P[6]-4:C[6]-3:H-1:	C[6,6]-4:C[6]-3:H-1:	C[6]-3:	C[6](P[6]C[6,6a]C[6a]O)(C[6]C[6,6]H)(H)	C[6](C[6,6]C[6,6a]C[6]2)(C[6]P[6]H)(H)	H(C[6]C[6]P[6])	C[6](P[6]C[6,6a]C[6a]O)(C[6]C[6,6]H)(H){2|C<4>,4|C<3>}	C[6](C[6,6]C[6,6a]C[6]2)(C[6]P[6]H)(H){1|O<1>,2|C<4>,3|C<3>,4|H<1>}	H(C[6]C[6]P[6])	118.1210	0.000	1	118.1210	0.000	1	118.1210	0.000	1	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	P[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](P[6]C[6,6a]C[6a]O)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]CC)(C[6]P[6]H)(H)	H(C[6]C[6]P[6])	C[6](P[6]C[6,6a]C[6a]O)(C[6]C[6]H)(H){2|C<4>,4|C<3>}	C[6](C[6]C[6,6a]CC)(C[6]P[6]H)(H){1|O<1>,3|C<3>}	H(C[6]C[6]P[6])	118.4210	0.000	1	118.4210	0.000	1	119.2413	0.456	4	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	P[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](P[6]C[6,6a]C[6a]Pd)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]CC)(C[6]P[6]H)(H)	H(C[6]C[6]P[6])	C[6](P[6]C[6,6a]C[6a]Pd)(C[6]C[6]H)(H){2|C<4>,4|C<3>}	C[6](C[6]C[6,6a]CC)(C[6]P[6]H)(H){1|Pd<4>,3|C<3>}	H(C[6]C[6]P[6])	119.6780	0.000	1	119.6780	0.000	1	119.2413	0.456	4	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	P[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](P[6]C[6,6a]C[6a]Pt)(C[6]C[6]H)(H)	C[6](C[6]C[6,6a]CC)(C[6]P[6]H)(H)	H(C[6]C[6]P[6])	C[6](P[6]C[6,6a]C[6a]Pt)(C[6]C[6]H)(H){2|C<4>,4|C<3>}	C[6](C[6]C[6,6a]CC)(C[6]P[6]H)(H){1|Pt<4>,3|C<3>}	H(C[6]C[6]P[6])	119.4330	0.656	2	119.4330	0.431	2	119.2413	0.456	4	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:1:	3:	Si[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:H-1:	C[6]-3:	C[6](Si[6]C[6a]C[6]O)(C[6]C[6]H)(H)	C[6](C[6]C[6]CH)(C[6]Si[6]H)(H)	H(C[6]Si[6]C[6])	C[6](Si[6]C[6a]C[6]O)(C[6]C[6]H)(H){1|C<4>,2|H<1>,3|C<3>}	C[6](C[6]C[6]CH)(C[6]Si[6]H)(H){1|H<1>,1|O<2>,2|C<3>}	H(C[6]Si[6]C[6])	119.1560	0.530	2	119.1560	0.281	2	119.1560	0.281	2	118.8439	3.225	1394	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:2:	3:	C[4,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:O-2:	C[6]-3:	C[6](C[4,6]C[4,5,6,6]C[4]H)(C[6]C[6]O)(H)	C[6](C[6]C[6,6]HH)(C[6]C[4,6]H)(OC)	H(C[6]C[4,6]C[6])	C[6](C[4,6]C[4,5,6,6]C[4]H)(C[6]C[6]O)(H){1|C<3>,1|C<4>,2|N<3>,3|H<1>}	C[6](C[6]C[6,6]HH)(C[6]C[4,6]H)(OC){2|H<1>,3|C<4>}	H(C[6]C[4,6]C[6])	119.5790	0.000	1	119.5790	0.000	1	119.5790	0.000	1	118.9445	7.320	37	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:2:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-2:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]C)(H)	C[6](C[6]C[6a]C[6]H)(C[6]C[5,6]H)(CN)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]C)(H){1|C<4>,1|N<3>,2|C<3>,3|H<1>}	C[6](C[6]C[6a]C[6]H)(C[6]C[5,6]H)(CN){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[5,6]C[6])	119.2380	0.000	1	119.2380	0.000	1	119.2380	0.000	1	118.9445	7.320	37	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:2:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:O-2:	C[6]-3:	C[6](C[5,6]C[5,6,6]C[5]H)(C[6]C[6]O)(H)	C[6](C[6]C[6,6]HO)(C[6]C[5,6]H)(OC)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6,6]C[5]H)(C[6]C[6]O)(H){1|N<3>,1|O<2>,2|C<4>,4|H<1>}	C[6](C[6]C[6,6]HO)(C[6]C[5,6]H)(OC){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[5,6]C[6])	118.2840	0.000	1	118.2840	0.000	1	120.4767	2.519	4	118.9445	7.320	37	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:2:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:O-2:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]O)(H)	C[6](C[6]C[5,6]CH)(C[6]C[5,6]H)(OC)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]O)(H){1|C<4>,1|O<2>,2|H<1>,3|C<3>}	C[6](C[6]C[5,6]CH)(C[6]C[5,6]H)(OC){1|C<4>,2|C<3>,2|H<1>}	H(C[6]C[5,6]C[6])	120.7705	0.008	2	120.7705	0.000	2	120.4767	2.519	4	118.9445	7.320	37	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:2:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:O-2:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]O)(H)	C[6](C[6]C[5,6]CO)(C[6]C[5,6]H)(OC)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]O)(H){1|H<1>,1|O<1>,1|O<2>,4|C<4>}	C[6](C[6]C[5,6]CO)(C[6]C[5,6]H)(OC){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[5,6]C[6])	122.0820	0.000	1	122.0820	0.000	1	120.4767	2.519	4	118.9445	7.320	37	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:2:	3:	C[6]-4:C[6]-3:H-1:	C[5,6]-4:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[5]O[6]C)(C[6]C[5,6]O)(H)	C[6](C[5,6]C[5,5]C[5]C[6])(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[5]O[6]C)(C[6]C[5,6]O)(H){1|H<1>,1|O<2>,2|C<3>,2|C<4>}	C[6](C[5,6]C[5,5]C[5]C[6])(C[6]C[6]H)(OC){1|C<3>,1|H<1>,1|O<1>,2|O<2>,5|C<4>}	H(C[6]C[6]2)	122.3150	0.047	2	122.3150	0.002	2	122.3150	0.002	2	118.9445	7.320	37	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:2:	3:	C[6]-4:C[6]-3:H-1:	C[6,6]-4:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6,6]HH)(C[6]C[6,6]C)(H)	C[6](C[6,6]N[6,6]N[6]H)(C[6]C[6]H)(CN)	H(C[6]C[6]2)	C[6](C[6]C[6,6]HH)(C[6]C[6,6]C)(H){1|C<3>,2|H<1>,2|N<3>}	C[6](C[6,6]N[6,6]N[6]H)(C[6]C[6]H)(CN){2|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	119.3190	0.000	1	119.3190	0.000	1	119.3190	0.000	1	118.9445	7.320	37	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:2:	3:	C[6]-4:C[6]-3:H-1:	C[6,6]-4:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6,6]HH)(C[6]C[6,6]O)(H)	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6,6]HH)(C[6]C[6,6]O)(H){1|C<3>,1|H<1>,3|C<4>}	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(OC){1|C<3>,1|C<4>,1|O<1>,4|H<1>}	H(C[6]C[6]2)	118.7660	0.000	1	118.4815	0.162	2	118.4815	0.162	2	118.9445	7.320	37	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:2:	3:	C[6]-4:C[6]-3:H-1:	C[6,6]-4:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6,6]HH)(C[6]C[6,6]O)(H)	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6,6]HH)(C[6]C[6,6]O)(H){5|C<4>}	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]H)(OC){1|O<2>,3|C<4>,4|H<1>}	H(C[6]C[6]2)	118.1970	0.000	1	118.4815	0.162	2	118.4815	0.162	2	118.9445	7.320	37	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:2:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[5,6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[5,6]BH)(C[6]C[6]H)(CN)	H(C[6]C[6]2)	C[6](C[6]C[5,6]HH)(C[6]C[6]C)(H){1|B<4>,1|H<1>,2|C<3>}	C[6](C[6]C[5,6]BH)(C[6]C[6]H)(CN){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	121.7180	0.000	1	121.7180	0.000	1	118.4644	3.264	13	118.9445	7.320	37	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:2:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]BH)(C[6]C[6]C)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(CN)	H(C[6]C[6]2)	C[6](C[6]C[6]BH)(C[6]C[6]C)(H){1|C<2>,1|C<3>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(CN){1|B<4>,1|C<3>,2|H<1>}	H(C[6]C[6]2)	117.9740	3.489	2	117.9740	12.172	2	118.4644	3.264	13	118.9445	7.320	37	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:2:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6]BH)(C[6]C[6]H)(CN)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){1|B<4>,1|C<2>,1|C<3>,1|H<1>}	C[6](C[6]C[6]BH)(C[6]C[6]H)(CN){1|C<3>,3|H<1>}	H(C[6]C[6]2)	117.4455	1.638	2	117.4455	2.684	2	118.4644	3.264	13	118.9445	7.320	37	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:2:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(CC)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(CC){1|C<4>,4|H<1>}	H(C[6]C[6]2)	120.1840	0.000	1	120.1840	0.000	1	118.4644	3.264	13	118.9445	7.320	37	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:2:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]HO)(C[6]C[6]C)(H)	C[6](C[6]C[6]HO)(C[6]C[6]H)(CC)	H(C[6]C[6]2)	C[6](C[6]C[6]HO)(C[6]C[6]C)(H){1|C<4>,2|H<1>,2|O<2>}	C[6](C[6]C[6]HO)(C[6]C[6]H)(CC){1|C<4>,2|H<1>,2|O<2>}	H(C[6]C[6]2)	118.5660	1.047	2	118.5660	1.095	2	118.4644	3.264	13	118.9445	7.320	37	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:2:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-2:	C[6]-3:	C[6](C[6]C[6]OO)(C[6]C[6]C)(H)	C[6](C[6]C[6]OO)(C[6]C[6]H)(CC)	H(C[6]C[6]2)	C[6](C[6]C[6]OO)(C[6]C[6]C)(H){1|C<2>,1|C<3>,2|O<2>}	C[6](C[6]C[6]OO)(C[6]C[6]H)(CC){1|C<3>,1|H<1>,2|O<2>}	H(C[6]C[6]2)	117.4783	0.079	4	117.4783	0.006	4	118.4644	3.264	13	118.9445	7.320	37	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:2:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-2:	C[6]-3:	C[6](C[6]N[6]CC)(C[6]C[6]C)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(CC)	H(C[6]C[6]2)	C[6](C[6]N[6]CC)(C[6]C[6]C)(H){1|C<4>,1|O<1>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(CC){1|N<3>,4|C<4>}	H(C[6]C[6]2)	120.2510	0.000	1	120.2510	0.000	1	118.4644	3.264	13	118.9445	7.320	37	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:2:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:N-2:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]N)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(NN)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]N)(H){1|C<4>,1|N<3>,3|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(NN){1|C<4>,4|H<1>}	H(C[6]C[6]2)	106.1620	0.000	1	106.1620	0.000	1	106.1620	0.000	1	118.9445	7.320	37	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:2:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[5,6]HO)(C[6]C[6]O)(H)	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[5,6]HO)(C[6]C[6]O)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(OC){1|C<3>,1|C<4>,1|O<2>,2|H<1>}	H(C[6]C[6]2)	120.6150	0.000	1	120.6150	0.000	1	119.4259	1.300	12	118.9445	7.320	37	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:2:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[5,6]HO)(C[6]C[6]O)(H)	C[6](C[6]C[5,6]HO)(C[6]C[6]H)(OSi)	H(C[6]C[6]2)	C[6](C[6]C[5,6]HO)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|O<2>,2|H<1>}	C[6](C[6]C[5,6]HO)(C[6]C[6]H)(OSi){1|C<3>,1|C<4>,1|O<2>,2|H<1>}	H(C[6]C[6]2)	120.3790	0.000	1	120.3790	0.000	1	119.4259	1.300	12	118.9445	7.320	37	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:2:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6,6]HH)(C[6]C[6]O)(H)	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(OSi)	H(C[6]C[6]2)	C[6](C[6]C[6,6]HH)(C[6]C[6]O)(H){1|C<3>,1|C<4>,3|H<1>}	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(OSi){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.0710	0.000	1	118.0710	0.000	1	119.4259	1.300	12	118.9445	7.320	37	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:2:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6,6a]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[6,6a]C[6]C)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]C[6]H)(C[6]C[6]O)(H){1|C<2>,1|C<4>,5|C<3>}	C[6](C[6]C[6,6a]C[6]C)(C[6]C[6]H)(OC){1|C<4>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	120.9040	0.000	1	120.9040	0.000	1	119.4259	1.300	12	118.9445	7.320	37	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:2:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]CH)(C[6]C[6]O)(H)	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6]CH)(C[6]C[6]O)(H){1|C<4>,4|H<1>}	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(OC){1|C<3>,1|H<1>,3|C<4>}	H(C[6]C[6]2)	118.7790	0.000	1	118.7790	0.000	1	119.4259	1.300	12	118.9445	7.320	37	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:2:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]CH)(C[6]C[6]O)(H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(OH)	H(C[6]C[6]2)	C[6](C[6]C[6]CH)(C[6]C[6]O)(H){1|C<1>,1|C<3>,1|H<1>,1|O<2>}	C[6](C[6]C[6]CH)(C[6]C[6]H)(OH){1|C<1>,1|C<3>,2|H<1>}	H(C[6]C[6]2)	118.5130	0.000	1	118.5130	0.000	1	119.4259	1.300	12	118.9445	7.320	37	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:2:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]CH)(C[6]C[6]O)(H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(OSi)	H(C[6]C[6]2)	C[6](C[6]C[6]CH)(C[6]C[6]O)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[6]CH)(C[6]C[6]H)(OSi){2|H<1>,3|C<4>}	H(C[6]C[6]2)	117.4350	0.000	1	117.4350	0.000	1	119.4259	1.300	12	118.9445	7.320	37	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:2:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6]HO)(C[6]C[6]O)(H)	C[6](C[6]C[6]HO)(C[6]C[6]H)(OSi)	H(C[6]C[6]2)	C[6](C[6]C[6]HO)(C[6]C[6]O)(H){1|C<3>,1|C<4>,1|O<2>,2|H<1>}	C[6](C[6]C[6]HO)(C[6]C[6]H)(OSi){1|C<4>,1|O<2>,3|H<1>}	H(C[6]C[6]2)	118.4700	0.000	1	118.4700	0.000	1	119.4259	1.300	12	118.9445	7.320	37	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:2:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6a]C[6]H)(C[6]C[6]O)(H)	C[6](C[6]O[6]CH)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]H)(C[6]C[6]O)(H){1|C<4>,1|O<2>,2|C<3>,3|H<1>}	C[6](C[6]O[6]CH)(C[6]C[6]H)(OC){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.6400	0.000	1	119.6400	0.000	1	119.4259	1.300	12	118.9445	7.320	37	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:2:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:O-2:	C[6]-3:	C[6](C[6]C[6a]O[6]H)(C[6]C[6]O)(H)	C[6](C[6]C[5]N[6]H)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]C[6a]O[6]H)(C[6]C[6]O)(H){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[5]N[6]H)(C[6]C[6]H)(OC){1|C<3>,2|C<4>,2|H<1>,2|O<2>}	H(C[6]C[6]2)	120.5760	0.000	1	120.5760	0.000	1	119.4259	1.300	12	118.9445	7.320	37	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:2:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:O-2:	C[6]-3:	C[6](C[6]O[6]HH)(C[6]C[6]O)(H)	C[6](C[6]N[6]CH)(C[6]C[6]H)(OC)	H(C[6]C[6]2)	C[6](C[6]O[6]HH)(C[6]C[6]O)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]N[6]CH)(C[6]C[6]H)(OC){1|C<4>,1|O<2>,2|H<1>}	H(C[6]C[6]2)	119.8645	0.268	2	119.8645	0.072	2	119.4259	1.300	12	118.9445	7.320	37	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	B[6]-4:C[6]-3:H-1:	P[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](B[6]C[6a]2C[6])(C[6]P[6]C)(H)	C[6](P[6]C[6a]2C[6])(C[6]B[6]H)(CCC)	H(C[6]B[6]C[6])	C[6](B[6]C[6a]2C[6])(C[6]P[6]C)(H){1|C<4>,2|H<1>,6|C<3>}	C[6](P[6]C[6a]2C[6])(C[6]B[6]H)(CCC){1|H<1>,2|C<4>,6|C<3>}	H(C[6]B[6]C[6])	114.6650	0.000	1	114.6650	0.000	1	114.6650	0.000	1	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	B[6]-4:C[6]-3:H-1:	P[6]-4:C[6a]-3:C[6]-3:	C[6]-3:	C[6](B[6]C[6a]2C[6])(C[6]C[6a]P[6])(H)	C[6](P[6]C[6a]C[6]H)(C[6a]C[6a]2)(C[6]B[6]H)	H(C[6]B[6]C[6])	C[6](B[6]C[6a]2C[6])(C[6]C[6a]P[6])(H){1|C<4>,3|H<1>,7|C<3>}	C[6](P[6]C[6a]C[6]H)(C[6a]C[6a]2)(C[6]B[6]H){1|C<4>,4|H<1>,6|C<3>}	H(C[6]B[6]C[6])	114.8490	0.000	1	114.8490	0.000	1	114.8490	0.000	1	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[3,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[3,6]C[3,5,6]N[3,5]H)(C[6]C[6]C)(H)	C[6](C[6]C[6a]C[6]H)(C[6]C[3,6]H)(COO)	H(C[6]C[3,6]C[6])	C[6](C[3,6]C[3,5,6]N[3,5]H)(C[6]C[6]C)(H){1|C<4>,1|H<1>,1|S<4>,2|C<3>}	C[6](C[6]C[6a]C[6]H)(C[6]C[3,6]H)(COO){1|C<4>,1|N<3>,2|C<3>,3|H<1>}	H(C[6]C[3,6]C[6])	119.2210	0.000	1	119.2210	0.000	1	119.0635	0.050	2	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[3,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[3,6]C[3,6]O[3]H)(C[6]C[6]C)(H)	C[6](C[6]C[6a]C[6]H)(C[6]C[3,6]H)(COO)	H(C[6]C[3,6]C[6])	C[6](C[3,6]C[3,6]O[3]H)(C[6]C[6]C)(H){1|C<4>,1|H<1>,2|C<3>}	C[6](C[6]C[6a]C[6]H)(C[6]C[3,6]H)(COO){1|C<4>,1|O<2>,2|C<3>,3|H<1>}	H(C[6]C[3,6]C[6])	118.9060	0.000	1	118.9060	0.000	1	119.0635	0.050	2	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[4,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[4,6]C[4,5,6]C[4,6a]H)(C[6]C[6]C)(H)	C[6](C[6]C[5,6]HH)(C[6]C[4,6]H)(CCO)	H(C[6]C[4,6]C[6])	C[6](C[4,6]C[4,5,6]C[4,6a]H)(C[6]C[6]C)(H){1|C<4>,1|O<2>,2|C<3>,2|H<1>}	C[6](C[6]C[5,6]HH)(C[6]C[4,6]H)(CCO){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[4,6]C[6])	117.6530	0.000	1	117.6530	0.000	1	117.6530	0.000	1	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[5,6]-4:C[6]-3:H-1:	C[3x6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]C)(C[6]C[3x6]C[6])(H)	C[6](C[3x6]C[6,6]3)(C[6]C[5,6]H)(C[6]C[6]H)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]C)(C[6]C[3x6]C[6])(H){1|C<3>,3|H<1>,6|C<4>}	C[6](C[3x6]C[6,6]3)(C[6]C[5,6]H)(C[6]C[6]H){6|C<4>,7|H<1>}	H(C[6]C[5,6]C[6])	118.5310	0.000	1	118.5310	0.000	1	118.5310	0.000	1	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[5,6]-4:C[6]-3:H-1:	C[4,6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[4,6]C)(H)	C[6](C[4,6]C[4,6]C[4]H)(C[6]C[5,6]H)(CHO)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[4,6]C)(H){4|C<4>,4|H<1>}	C[6](C[4,6]C[4,6]C[4]H)(C[6]C[5,6]H)(CHO){1|O<2>,2|H<1>,4|C<4>}	H(C[6]C[5,6]C[6])	117.2820	0.000	1	117.2820	0.000	1	117.3220	0.048	3	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[5,6]-4:C[6]-3:H-1:	C[4,6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[4,6]C)(H)	C[6](C[4,6]C[4,6]C[4]O)(C[6]C[5,6]H)(COS)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[4,6]C)(H){1|O<2>,3|H<1>,4|C<4>}	C[6](C[4,6]C[4,6]C[4]O)(C[6]C[5,6]H)(COS){1|O<2>,2|H<1>,4|C<4>}	H(C[6]C[5,6]C[6])	117.3420	0.305	2	117.3420	0.093	2	117.3220	0.048	3	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[5,6]-4:C[6]-3:H-1:	C[5,6,6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[5,6]C[5,5,6]C[5]H)(C[6]C[5,6,6]C)(H)	C[6](C[5,6,6]C[5,6,6]C[6]O[5])(C[6]C[5,6]H)(CCH)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,5,6]C[5]H)(C[6]C[5,6,6]C)(H){1|O<1>,2|O<2>,4|C<4>}	C[6](C[5,6,6]C[5,6,6]C[6]O[5])(C[6]C[5,6]H)(CCH){2|C<3>,3|H<1>,4|C<4>}	H(C[6]C[5,6]C[6])	118.9180	0.055	2	118.9180	0.003	2	118.9180	0.003	2	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[5,6]-4:C[6]-3:H-1:	C[5,6,6]-4:C[6]-3:C[5]-3:	C[6]-3:	C[6](C[5,6]C[5,6,6]C[5,6a]H)(C[6]C[5,6,6]C[5])(H)	C[6](C[5,6,6]C[5,6,6]C[5,6]C[5])(C[6]C[5,6]H)(C[5]C[5]2)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6,6]C[5,6a]H)(C[6]C[5,6,6]C[5])(H){4|C<3>,5|C<4>}	C[6](C[5,6,6]C[5,6,6]C[5,6]C[5])(C[6]C[5,6]H)(C[5]C[5]2){1|C<4>,7|C<3>,8|H<1>}	H(C[6]C[5,6]C[6])	116.7530	0.000	2	116.7530	0.000	2	116.7530	0.000	2	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[5,6]-4:C[6]-3:H-1:	C[5,6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[5,6]C[5,5,6]C[5,6a]H)(C[6]C[5,6]C)(H)	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[5,6]H)(COO)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,5,6]C[5,6a]H)(C[6]C[5,6]C)(H){2|C<3>,2|H<1>,3|C<4>}	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[5,6]H)(COO){2|C<3>,2|C<4>,4|H<1>}	H(C[6]C[5,6]C[6])	118.9220	0.000	1	118.9220	0.000	1	119.6690	1.116	2	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[5,6]-4:C[6]-3:H-1:	C[5,6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[5,6]C[5,6]O[5]H)(C[6]C[5,6]C)(H)	C[6](C[5,6]C[5,6a]C[5]C[6])(C[6]C[5,6]H)(COO)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]O[5]H)(C[6]C[5,6]C)(H){1|H<1>,1|O<2>,2|C<3>,2|C<4>}	C[6](C[5,6]C[5,6a]C[5]C[6])(C[6]C[5,6]H)(COO){1|C<4>,1|N<3>,1|O<1>,1|O<2>,2|C<3>,3|H<1>}	H(C[6]C[5,6]C[6])	120.4160	0.000	1	120.4160	0.000	1	119.6690	1.116	2	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[5,6]-4:C[6]-3:H-1:	C[5,6]-4:C[6]-3:C[6a]-3:	C[6]-3:	C[6](C[5,6]C[6]O[5]2)(C[6]C[5,6]C[6a])(H)	C[6](C[5,6]C[6]O[5]2)(C[6]C[5,6]H)(C[6a]C[6a]2)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[6]O[5]2)(C[6]C[5,6]C[6a])(H){2|C<4>,2|O<2>,4|C<3>}	C[6](C[5,6]C[6]O[5]2)(C[6]C[5,6]H)(C[6a]C[6a]2){2|C<4>,2|O<2>,3|C<3>,3|H<1>}	H(C[6]C[5,6]C[6])	117.2020	0.327	2	117.2020	0.107	2	117.2020	0.107	2	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]C)(H)	C[6](C[6]C[6a]C[6]H)(C[6]C[5,6]H)(CHO)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]C)(H){2|C<3>,3|C<4>,3|H<1>}	C[6](C[6]C[6a]C[6]H)(C[6]C[5,6]H)(CHO){1|N<3>,2|C<3>,2|C<4>,2|H<1>}	H(C[6]C[5,6]C[6])	119.2980	0.000	1	119.2980	0.000	1	118.3013	0.745	3	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[5,6]C[5]2C[6])(C[6]C[6]C)(H)	C[6](C[6]C[6a]C[6]H)(C[6]C[5,6]H)(COO)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5]2C[6])(C[6]C[6]C)(H){1|O<1>,1|O<2>,2|C<3>,3|C<4>,3|H<1>}	C[6](C[6]C[6a]C[6]H)(C[6]C[5,6]H)(COO){2|C<4>,2|H<1>,3|C<3>}	H(C[6]C[5,6]C[6])	117.8030	0.000	2	117.8030	0.000	2	118.3013	0.745	3	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C[6a]-3:	C[6]-3:	C[6](C[5,6]C[5,6a]2C[6])(C[6]C[6a]C[6])(H)	C[6](C[6]C[5,6]HH)(C[6]C[5,6]H)(C[6a]C[6a]2)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6a]2C[6])(C[6]C[6a]C[6])(H){1|C<4>,4|H<1>,6|C<3>}	C[6](C[6]C[5,6]HH)(C[6]C[5,6]H)(C[6a]C[6a]2){1|C<4>,1|H<1>,7|C<3>}	H(C[6]C[5,6]C[6])	120.3530	0.000	1	120.3530	0.000	1	120.7105	0.256	2	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C[6a]-3:	C[6]-3:	C[6](C[5,6]C[5,6a]O[5,6]C)(C[6]C[6a]C[6])(H)	C[6](C[6]C[5,6]HH)(C[6]C[5,6]H)(C[6a]C[6a]2)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6a]O[5,6]C)(C[6]C[6a]C[6])(H){1|C<4>,2|H<1>,4|C<3>}	C[6](C[6]C[5,6]HH)(C[6]C[5,6]H)(C[6a]C[6a]2){1|C<4>,1|O<2>,3|H<1>,4|C<3>}	H(C[6]C[5,6]C[6])	121.0680	0.000	1	121.0680	0.000	1	120.7105	0.256	2	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:N-3:	C[6]-3:	C[6](C[5,6]C[5,5,6]O[5]C)(C[6]C[6]N)(H)	C[6](C[6]C[5,6]HH)(C[6]C[5,6]H)(NCH)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,5,6]O[5]C)(C[6]C[6]N)(H){1|C<4>,1|N<3>,2|H<1>,2|O<2>}	C[6](C[6]C[5,6]HH)(C[6]C[5,6]H)(NCH){1|H<1>,1|N<3>,1|O<2>,2|C<4>}	H(C[6]C[5,6]C[6])	119.0050	0.000	1	119.0050	0.000	1	119.0050	0.000	1	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6,6]C[5,5,6]C[6,6]H)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]HH)(C[6]C[6,6]H)(CCO)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,5,6]C[6,6]H)(C[6]C[6]C)(H){2|C<4>,2|N<3>,4|H<1>}	C[6](C[6]C[6,6]HH)(C[6]C[6,6]H)(CCO){2|H<1>,3|C<4>}	H(C[6]C[6,6]C[6])	118.5380	0.000	1	118.5380	0.000	1	118.1107	0.225	4	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]C)(H)	C[6](C[6]C[6a]C[6]H)(C[6]C[6,6]H)(CHO)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]C)(H){1|C<4>,1|N<3>,3|C<3>,3|H<1>}	C[6](C[6]C[6a]C[6]H)(C[6]C[6,6]H)(CHO){1|N<3>,2|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6,6]C[6])	118.3390	0.000	1	117.9683	0.215	3	118.1107	0.225	4	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]C)(H)	C[6](C[6]C[6a]C[6]H)(C[6]C[6,6]H)(CHO)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]C)(H){1|C<4>,1|O<2>,3|C<3>,3|H<1>}	C[6](C[6]C[6a]C[6]H)(C[6]C[6,6]H)(CHO){1|N<3>,2|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6,6]C[6])	118.1180	0.000	1	117.9683	0.215	3	118.1107	0.225	4	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]C)(H)	C[6](C[6]C[6a]C[6]H)(C[6]C[6,6]H)(CHO)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]C)(H){1|O<2>,2|C<3>,2|H<1>,3|C<4>}	C[6](C[6]C[6a]C[6]H)(C[6]C[6,6]H)(CHO){1|N<3>,2|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6,6]C[6])	117.4480	0.000	1	117.9683	0.215	3	118.1107	0.225	4	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C[6a]-3:	C[6]-3:	C[6](C[6,6]O[6,6]C[3]C[6])(C[6]C[6a]C[6])(H)	C[6](C[6]C[6,6]HH)(C[6]C[6,6]H)(C[6a]C[6a]2)	H(C[6]C[6,6]C[6])	C[6](C[6,6]O[6,6]C[3]C[6])(C[6]C[6a]C[6])(H){3|C<3>,3|C<4>,5|H<1>}	C[6](C[6]C[6,6]HH)(C[6]C[6,6]H)(C[6a]C[6a]2){1|O<2>,2|C<4>,3|C<3>,3|H<1>}	H(C[6]C[6,6]C[6])	117.7610	0.000	1	117.7610	0.000	1	117.7535	0.000	2	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C[6a]-3:	C[6]-3:	C[6](C[6,6]O[6,6]C[6a]C[6])(C[6]C[6a]C[6])(H)	C[6](C[6]C[6,6]HH)(C[6]C[6,6]H)(C[6a]C[6a]2)	H(C[6]C[6,6]C[6])	C[6](C[6,6]O[6,6]C[6a]C[6])(C[6]C[6a]C[6])(H){1|C<4>,4|H<1>,5|C<3>}	C[6](C[6]C[6,6]HH)(C[6]C[6,6]H)(C[6a]C[6a]2){1|C<4>,1|O<2>,3|H<1>,4|C<3>}	H(C[6]C[6,6]C[6])	117.7460	0.000	1	117.7460	0.000	1	117.7535	0.000	2	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:N-3:	C[6]-3:	C[6](C[6,6]C[6,6]N[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6,6]HH)(C[6]C[6,6]H)(NCH)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]N[6]H)(C[6]C[6]N)(H){1|C<4>,2|C<3>,2|H<1>,2|O<2>}	C[6](C[6]C[6,6]HH)(C[6]C[6,6]H)(NCH){1|C<3>,1|C<4>,1|N<3>,2|H<1>}	H(C[6]C[6,6]C[6])	118.8460	0.000	1	118.8460	0.000	1	118.9135	0.009	2	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:N-3:	C[6]-3:	C[6](C[6,6]C[6,6]O[6]H)(C[6]C[6]N)(H)	C[6](C[6]C[6,6]HH)(C[6]C[6,6]H)(NHS)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]O[6]H)(C[6]C[6]N)(H){1|C<3>,1|O<2>,2|C<4>,2|H<1>}	C[6](C[6]C[6,6]HH)(C[6]C[6,6]H)(NHS){1|C<3>,1|C<4>,1|O<2>,2|H<1>}	H(C[6]C[6,6]C[6])	118.9810	0.000	1	118.9810	0.000	1	118.9135	0.009	2	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[5,6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[5,6]C[6a]H)(C[6]C[5,6]C)(H)	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C[6a]H)(C[6]C[5,6]C)(H){1|C<4>,2|H<1>,4|C<3>}	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(COO){1|C<4>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	122.4790	0.000	1	122.4790	0.000	1	119.0173	2.705	7	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[5,6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[5,6]C[6a]O)(C[6]C[5,6]C)(H)	C[6](C[5,6]C[5,6a]C[5]C[6])(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C[6a]O)(C[6]C[5,6]C)(H){1|C<4>,6|C<3>}	C[6](C[5,6]C[5,6a]C[5]C[6])(C[6]C[6]H)(COO){1|C<4>,1|H<1>,1|N<3>,1|O<1>,1|O<2>,4|C<3>}	H(C[6]C[6]2)	117.6430	0.000	1	117.6430	0.000	1	119.0173	2.705	7	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[5,6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[5,6]HH)(C[6]C[5,6]C)(H)	C[6](C[5,6]C[5,5,6]N[5]H)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[5,6]HH)(C[6]C[5,6]C)(H){1|C<4>,2|H<1>,2|N<3>}	C[6](C[5,6]C[5,5,6]N[5]H)(C[6]C[6]H)(COO){2|C<3>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	118.0050	0.000	1	118.0050	0.000	1	119.0173	2.705	7	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[5,6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[5,6]HH)(C[6]C[5,6]C)(H)	C[6](C[5,6]C[5,5]C[5,6]H)(C[6]C[6]H)(CHO)	H(C[6]C[6]2)	C[6](C[6]C[5,6]HH)(C[6]C[5,6]C)(H){1|H<1>,4|C<4>}	C[6](C[5,6]C[5,5]C[5,6]H)(C[6]C[6]H)(CHO){4|C<4>,4|H<1>}	H(C[6]C[6]2)	119.2560	0.000	1	119.2560	0.000	1	119.0173	2.705	7	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[5,6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[5,6]HH)(C[6]C[5,6]C)(H)	C[6](C[5,6]C[5,6]O[5]H)(C[6]C[6]H)(CHO)	H(C[6]C[6]2)	C[6](C[6]C[5,6]HH)(C[6]C[5,6]C)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[5,6]C[5,6]O[5]H)(C[6]C[6]H)(CHO){2|C<4>,4|H<1>}	H(C[6]C[6]2)	118.8330	0.000	1	118.8330	0.000	1	119.0173	2.705	7	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[5,6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[5,6]HO)(C[6]C[5,6]C)(H)	C[6](C[5,6]C[5,5]C[5,6]H)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[5,6]HO)(C[6]C[5,6]C)(H){1|H<1>,4|C<4>}	C[6](C[5,6]C[5,5]C[5,6]H)(C[6]C[6]H)(COO){1|O<2>,3|H<1>,4|C<4>}	H(C[6]C[6]2)	119.0010	0.000	1	119.0010	0.000	1	119.0173	2.705	7	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[5,6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6]HH)(C[6]C[5,6]C)(H)	C[6](C[5,6]C[5,6,6]C[5]H)(C[6]C[6]H)(CHO)	H(C[6]C[6]2)	C[6](C[6]C[6,6]HH)(C[6]C[5,6]C)(H){2|H<1>,3|C<4>}	C[6](C[5,6]C[5,6,6]C[5]H)(C[6]C[6]H)(CHO){1|O<2>,3|C<4>,4|H<1>}	H(C[6]C[6]2)	117.9040	0.000	1	117.9040	0.000	1	119.0173	2.705	7	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[5]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6]HH)(C[6]C[5]C[6])(H)	C[6](C[6]C[6]HH)(C[5]C[5]2)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]HH)(C[6]C[5]C[6])(H){1|N<2>,2|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[6]HH)(C[5]C[5]2)(C[6]C[6]H){3|C<4>,7|H<1>}	H(C[6]C[6]2)	119.6240	0.071	2	119.6240	0.005	2	119.6240	0.005	2	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[3,6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[3,6]CH)(C[6]C[6]H)(CCC)	H(C[6]C[6]2)	C[6](C[6]C[3,6]HH)(C[6]C[6]C)(H){1|H<1>,4|C<4>}	C[6](C[6]C[3,6]CH)(C[6]C[6]H)(CCC){2|C<4>,3|H<1>}	H(C[6]C[6]2)	121.4140	0.000	1	121.4140	0.000	1	118.2680	1.351	94	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[3x6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[3x6]HH)(C[6]C[6]C)(H){2|H<1>,3|C<4>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(COO){1|C<4>,4|H<1>}	H(C[6]C[6]2)	118.1430	0.055	2	118.1430	0.003	2	118.2680	1.351	94	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[5,6]CH)(C[6]C[6]C)(H)	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[5,6]CH)(C[6]C[6]C)(H){1|C<3>,1|C<4>,3|H<1>}	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(COO){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	120.1060	0.000	1	120.1060	0.000	1	118.2680	1.351	94	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[5,6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[5,6]C[6a]H)(C[6]C[6]H)(CCH)	H(C[6]C[6]2)	C[6](C[6]C[5,6]HH)(C[6]C[6]C)(H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]C[5,6]C[6a]H)(C[6]C[6]H)(CCH){1|C<4>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	117.2240	0.000	1	117.2240	0.000	1	118.2680	1.351	94	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[5,6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(CCO)	H(C[6]C[6]2)	C[6](C[6]C[5,6]HH)(C[6]C[6]C)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(CCO){1|C<3>,1|C<4>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	117.5940	0.000	1	117.5940	0.000	1	118.2680	1.351	94	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[5,6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[5,6]HH)(C[6]C[6]C)(H){1|C<3>,1|C<4>,3|H<1>}	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(COO){1|C<3>,1|C<4>,3|H<1>}	H(C[6]C[6]2)	120.3820	0.000	1	120.3820	0.000	1	118.2680	1.351	94	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[5,6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[5,6]HH)(C[6]C[6]C)(H){1|C<4>,1|H<1>,3|C<3>}	C[6](C[6]C[6]CH)(C[6]C[6]H)(COO){1|C<4>,2|C<2>,2|H<1>}	H(C[6]C[6]2)	117.4410	0.000	1	117.4410	0.000	1	118.2680	1.351	94	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6]CH)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]C[6a]H)(C[6]C[6]H)(CHO)	H(C[6]C[6]2)	C[6](C[6]C[6,6]CH)(C[6]C[6]C)(H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6]C[6a]H)(C[6]C[6]H)(CHO){1|H<1>,1|N<3>,2|C<3>,3|C<4>}	H(C[6]C[6]2)	116.8110	0.000	1	116.8110	0.000	1	118.2680	1.351	94	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]CH)(C[6]C[6]H)(CHO)	H(C[6]C[6]2)	C[6](C[6]C[6,6]HH)(C[6]C[6]C)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[6,6]CH)(C[6]C[6]H)(CHO){2|H<1>,3|C<4>}	H(C[6]C[6]2)	117.8137	0.092	4	117.8137	0.008	4	118.2680	1.351	94	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]CH)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6,6]HH)(C[6]C[6]C)(H){1|C<3>,1|C<4>,1|O<2>,2|H<1>}	C[6](C[6]C[6,6]CH)(C[6]C[6]H)(COO){1|C<2>,1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	117.5610	0.000	1	117.8335	0.149	2	118.2680	1.351	94	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]CH)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6,6]HH)(C[6]C[6]C)(H){2|H<1>,3|C<4>}	C[6](C[6]C[6,6]CH)(C[6]C[6]H)(COO){2|H<1>,3|C<4>}	H(C[6]C[6]2)	118.1060	0.000	1	117.8335	0.149	2	118.2680	1.351	94	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]C[6a]H)(C[6]C[6]H)(CHO)	H(C[6]C[6]2)	C[6](C[6]C[6,6]HH)(C[6]C[6]C)(H){1|H<1>,2|C<3>,2|C<4>}	C[6](C[6]C[6,6]C[6a]H)(C[6]C[6]H)(CHO){2|C<3>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	117.8200	0.000	1	117.8200	0.000	1	118.2680	1.351	94	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6,6]HH)(C[6]C[6]C)(H)	C[6](C[6]N[6,6]HH)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6,6]HH)(C[6]C[6]C)(H){1|C<4>,1|N<4>,3|H<1>}	C[6](C[6]N[6,6]HH)(C[6]C[6]H)(COO){2|C<4>,3|H<1>}	H(C[6]C[6]2)	118.4250	0.000	1	118.4250	0.000	1	118.2680	1.351	94	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]CC)(C[6]C[6]C)(H)	C[6](C[6]C[3,6]C[6]O)(C[6]C[6]H)(CCO)	H(C[6]C[6]2)	C[6](C[6]C[6]CC)(C[6]C[6]C)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[6]C[3,6]C[6]O)(C[6]C[6]H)(CCO){2|C<3>,2|H<1>,4|C<4>}	H(C[6]C[6]2)	117.1150	0.000	1	117.1150	0.000	1	118.2680	1.351	94	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]CH)(C[6]C[6]C)(H)	C[6](C[6]C[6a]C[6]H)(C[6]C[6]H)(CHO)	H(C[6]C[6]2)	C[6](C[6]C[6]CH)(C[6]C[6]C)(H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]C[6a]C[6]H)(C[6]C[6]H)(CHO){1|C<4>,1|N<3>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	117.1890	0.000	1	117.1890	0.000	1	118.2680	1.351	94	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]CH)(C[6]C[6]C)(H)	C[6](C[6]O[6]CH)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]CH)(C[6]C[6]C)(H){1|C<4>,1|H<1>,1|O<1>,1|O<2>}	C[6](C[6]O[6]CH)(C[6]C[6]H)(COO){1|H<1>,2|C<3>}	H(C[6]C[6]2)	121.9420	0.000	1	121.9420	0.000	1	118.2680	1.351	94	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]CH)(C[6]C[6]C)(H)	C[6](C[6]O[6]HO)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]CH)(C[6]C[6]C)(H){1|H<1>,1|O<1>,2|O<2>}	C[6](C[6]O[6]HO)(C[6]C[6]H)(COO){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	119.2770	0.000	1	119.2770	0.000	1	118.2680	1.351	94	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[5,6]CH)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]C[5,6]CH)(C[6]C[6]H)(COO){1|C<4>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	118.2100	0.395	5	118.2100	0.156	5	118.2680	1.351	94	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[5,6]C[6a]H)(C[6]C[6]H)(CHO)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]C[5,6]C[6a]H)(C[6]C[6]H)(CHO){1|C<4>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	117.7590	0.407	4	117.7590	0.165	4	118.2680	1.351	94	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[5,6]C[6a]H)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]C[5,6]C[6a]H)(C[6]C[6]H)(COO){1|C<4>,2|H<1>,4|C<3>}	H(C[6]C[6]2)	118.2075	0.172	2	118.2075	0.030	2	118.2680	1.351	94	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(CC[6a]O)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){1|C<4>,4|H<1>}	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(CC[6a]O){1|C<4>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	118.1485	0.306	2	118.1485	0.094	2	118.2680	1.351	94	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[5a]C[6]H)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){1|C<3>,1|C<4>,3|H<1>}	C[6](C[6]C[5a]C[6]H)(C[6]C[6]H)(COO){1|C<4>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	117.9400	0.294	2	117.9400	0.087	2	118.2680	1.351	94	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(CC[6a]O)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){1|C<2>,1|C<3>,1|H<1>,2|C<4>}	C[6](C[6]C[6]CH)(C[6]C[6]H)(CC[6a]O){1|C<4>,4|H<1>}	H(C[6]C[6]2)	117.8560	0.000	1	117.2027	0.320	3	118.2680	1.351	94	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(CC[6a]O)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){2|C<4>,3|H<1>}	C[6](C[6]C[6]CH)(C[6]C[6]H)(CC[6a]O){1|C<4>,4|H<1>}	H(C[6]C[6]2)	116.8760	0.000	2	117.2027	0.320	3	118.2680	1.351	94	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]C[6]CH)(C[6]C[6]H)(COO){1|C<4>,2|C<2>,2|H<1>}	H(C[6]C[6]2)	118.0210	0.000	1	118.0210	0.000	1	118.2680	1.351	94	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6]CO)(C[6]C[6]H)(CC[6a]O)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[6]C[6]CO)(C[6]C[6]H)(CC[6a]O){1|C<4>,4|H<1>}	H(C[6]C[6]2)	117.7550	0.000	1	117.7550	0.000	1	118.2680	1.351	94	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(CCH){1|C<4>,4|H<1>}	H(C[6]C[6]2)	117.6543	0.231	3	117.6543	0.053	3	118.2680	1.351	94	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(CCP)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(CCP){1|C<4>,4|H<1>}	H(C[6]C[6]2)	118.0477	0.461	3	118.0477	0.213	3	118.2680	1.351	94	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(CC[3]O)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(CC[3]O){1|C<4>,4|H<1>}	H(C[6]C[6]2)	119.7890	0.000	1	119.7890	0.000	1	118.2680	1.351	94	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){1|C<3>,1|C<4>,3|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(CHN){1|C<4>,4|H<1>}	H(C[6]C[6]2)	117.9790	0.107	2	117.9790	0.012	2	118.2680	1.351	94	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(CNO)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(CNO){1|C<4>,4|H<1>}	H(C[6]C[6]2)	119.1630	0.229	2	119.1630	0.052	2	118.2680	1.351	94	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(CNS)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(CNS){1|C<4>,4|H<1>}	H(C[6]C[6]2)	118.1570	2.710	2	118.1570	7.342	2	118.2680	1.351	94	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){1|C<3>,1|C<4>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(COO){1|C<3>,2|C<2>,2|H<1>}	H(C[6]C[6]2)	117.7960	0.000	1	117.7443	0.048	3	118.2680	1.351	94	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){1|C<3>,1|C<4>,3|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(COO){1|C<4>,2|C<2>,2|H<1>}	H(C[6]C[6]2)	117.9320	0.000	1	117.7443	0.048	3	118.2680	1.351	94	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){1|C<4>,2|C<2>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(COO){1|C<3>,1|C<4>,3|H<1>}	H(C[6]C[6]2)	117.5050	0.000	1	117.7443	0.048	3	118.2680	1.351	94	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6]HN)(C[6]C[6]H)(CP[6]C)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){1|C<4>,1|N<2>,3|H<1>}	C[6](C[6]C[6]HN)(C[6]C[6]H)(CP[6]C){1|C<4>,4|H<1>}	H(C[6]C[6]2)	118.2520	0.000	1	118.2520	0.000	1	118.2680	1.351	94	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6]HO)(C[6]C[6]H)(CCC)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){1|C<4>,1|O<2>,3|H<1>}	C[6](C[6]C[6]HO)(C[6]C[6]H)(CCC){1|C<4>,1|O<2>,3|H<1>}	H(C[6]C[6]2)	117.6940	0.000	1	117.6940	0.000	1	118.2680	1.351	94	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6]HO)(C[6]C[6]H)(CHO)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[6]C[6]HO)(C[6]C[6]H)(CHO){1|C<4>,4|H<1>}	H(C[6]C[6]2)	118.1170	0.000	1	118.1170	0.000	1	118.2680	1.351	94	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6]HO)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){1|C<4>,1|O<2>,3|H<1>}	C[6](C[6]C[6]HO)(C[6]C[6]H)(COO){1|C<4>,1|O<2>,3|H<1>}	H(C[6]C[6]2)	116.0550	0.000	1	116.0550	0.000	1	118.2680	1.351	94	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6a]C[6]H)(C[6]C[6]H)(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){1|C<3>,1|C<4>,3|H<1>}	C[6](C[6]C[6a]C[6]H)(C[6]C[6]H)(CCH){2|C<3>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	119.1010	0.000	1	119.1010	0.000	1	118.2680	1.351	94	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6a]C[6]H)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]C[6a]C[6]H)(C[6]C[6]H)(COO){1|C<4>,1|N<3>,2|C<3>,3|H<1>}	H(C[6]C[6]2)	117.8380	0.115	5	117.8307	0.011	6	118.2680	1.351	94	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6a]C[6]H)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]C[6a]C[6]H)(C[6]C[6]H)(COO){1|C<4>,2|C<2>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	117.7940	0.000	1	117.8307	0.011	6	118.2680	1.351	94	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6a]N[6]H)(C[6]C[6]H)(CC[6a]O)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){1|C<3>,1|N<3>,3|H<1>}	C[6](C[6]C[6a]N[6]H)(C[6]C[6]H)(CC[6a]O){1|C<4>,1|S<4>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	118.1100	0.000	1	118.1100	0.000	1	118.2680	1.351	94	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6a]O[6]H)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){1|C<4>,1|H<1>,1|O<2>,2|C<3>}	C[6](C[6]C[6a]O[6]H)(C[6]C[6]H)(COO){1|C<4>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	118.1350	0.266	2	118.1350	0.071	2	118.2680	1.351	94	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]N[6]HH)(C[6]C[6]H)(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){1|N<3>,4|H<1>}	C[6](C[6]N[6]HH)(C[6]C[6]H)(CCH){1|C<4>,1|S<4>,2|H<1>}	H(C[6]C[6]2)	117.6100	0.000	1	117.6100	0.000	1	118.2680	1.351	94	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]HN)(C[6]C[6]C)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]HN)(C[6]C[6]C)(H){1|Br<1>,1|C<4>,3|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(COO){1|C<4>,1|N<2>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	121.2810	0.000	1	121.2810	0.000	1	118.2680	1.351	94	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]HO)(C[6]C[6]C)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(CC[6a]O)	H(C[6]C[6]2)	C[6](C[6]C[6]HO)(C[6]C[6]C)(H){1|C<4>,1|O<2>,3|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(CC[6a]O){1|C<4>,2|H<1>,2|O<2>}	H(C[6]C[6]2)	118.5150	0.000	1	118.5150	0.000	1	118.2680	1.351	94	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]HO)(C[6]C[6]C)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]HO)(C[6]C[6]C)(H){1|C<4>,1|N<3>,3|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(COO){1|C<4>,1|N<4>,1|O<2>,2|H<1>}	H(C[6]C[6]2)	117.6525	0.781	4	117.7208	0.481	5	118.2680	1.351	94	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]HO)(C[6]C[6]C)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]C[6]HO)(C[6]C[6]C)(H){1|C<4>,1|O<2>,3|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(COO){1|C<4>,2|H<1>,2|O<2>}	H(C[6]C[6]2)	117.9940	0.000	1	117.7208	0.481	5	118.2680	1.351	94	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]HO)(C[6]C[6]C)(H)	C[6](C[6]C[6]HO)(C[6]C[6]H)(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]HO)(C[6]C[6]C)(H){1|C<4>,2|H<1>,2|O<2>}	C[6](C[6]C[6]HO)(C[6]C[6]H)(CCH){1|C<4>,2|H<1>,2|O<2>}	H(C[6]C[6]2)	118.1250	0.218	2	117.6513	0.697	3	118.2680	1.351	94	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]HO)(C[6]C[6]C)(H)	C[6](C[6]C[6]HO)(C[6]C[6]H)(CCH)	H(C[6]C[6]2)	C[6](C[6]C[6]HO)(C[6]C[6]C)(H){1|H<1>,2|C<4>,2|O<2>}	C[6](C[6]C[6]HO)(C[6]C[6]H)(CCH){1|C<4>,1|O<2>,3|H<1>}	H(C[6]C[6]2)	116.7040	0.000	1	117.6513	0.697	3	118.2680	1.351	94	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]HO)(C[6]C[6]C)(H)	C[6](C[6]C[6]HO)(C[6]C[6]H)(CHO)	H(C[6]C[6]2)	C[6](C[6]C[6]HO)(C[6]C[6]C)(H){1|C<4>,2|H<1>,2|O<2>}	C[6](C[6]C[6]HO)(C[6]C[6]H)(CHO){1|C<4>,2|H<1>,2|O<2>}	H(C[6]C[6]2)	120.2790	0.000	1	120.2790	0.000	1	118.2680	1.351	94	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6]RhH)(C[6]C[6]C)(H)	C[6](C[6]C[6]RhH)(C[6]C[6]H)(CC[6a]N)	H(C[6]C[6]2)	C[6](C[6]C[6]RhH)(C[6]C[6]C)(H){1|C<4>,2|H<1>}	C[6](C[6]C[6]RhH)(C[6]C[6]H)(CC[6a]N){1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.5920	0.000	1	119.5920	0.000	1	118.2680	1.351	94	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]C[6a]C[6]H)(C[6]C[6]C)(H)	C[6](C[6]O[6]HH)(C[6]C[6]H)(CC[6a]O)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]H)(C[6]C[6]C)(H){1|O<2>,2|C<3>,4|H<1>}	C[6](C[6]O[6]HH)(C[6]C[6]H)(CC[6a]O){1|C<3>,1|C<4>,1|H<1>}	H(C[6]C[6]2)	118.4930	0.000	1	118.4930	0.000	1	118.2680	1.351	94	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]N[5,6]C[6a]H)(C[6]C[6]C)(H)	C[6](C[6]C[5,6]CH)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]N[5,6]C[6a]H)(C[6]C[6]C)(H){1|H<1>,2|C<3>,3|C<4>}	C[6](C[6]C[5,6]CH)(C[6]C[6]H)(COO){1|C<3>,1|N<3>,1|O<2>,2|H<1>}	H(C[6]C[6]2)	117.5810	0.000	1	117.5810	0.000	1	118.2680	1.351	94	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]N[5a,6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[5a,6]HN)(C[6]C[6]H)(COO)	H(C[6]C[6]2)	C[6](C[6]N[5a,6]HH)(C[6]C[6]C)(H){1|H<1>,1|N<3>,2|C<3>}	C[6](C[6]C[5a,6]HN)(C[6]C[6]H)(COO){1|C<3>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	117.8260	0.000	1	117.8260	0.000	1	118.2680	1.351	94	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]O[6]CH)(C[6]C[6]C)(H)	C[6](C[6]N[6]CH)(C[6]C[6]H)(CHN)	H(C[6]C[6]2)	C[6](C[6]O[6]CH)(C[6]C[6]C)(H){1|C<4>,1|H<1>,1|N<3>}	C[6](C[6]N[6]CH)(C[6]C[6]H)(CHN){1|C<3>,1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.0360	0.000	1	119.0360	0.000	1	118.2680	1.351	94	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]O[6]HH)(C[6]C[6]C)(H)	C[6](C[6]N[6]HH)(C[6]C[6]H)(CCC)	H(C[6]C[6]2)	C[6](C[6]O[6]HH)(C[6]C[6]C)(H){1|N<3>,2|H<1>}	C[6](C[6]N[6]HH)(C[6]C[6]H)(CCC){1|C<3>,1|O<2>,2|H<1>}	H(C[6]C[6]2)	120.6664	0.833	5	120.6664	0.694	5	118.2680	1.351	94	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-3:	C[6]-3:	C[6](C[6]S[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(CC[6a]O)	H(C[6]C[6]2)	C[6](C[6]S[6]HH)(C[6]C[6]C)(H){1|C<4>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(CC[6a]O){1|C<3>,1|S<2>,3|H<1>}	H(C[6]C[6]2)	116.7720	0.000	1	116.7720	0.000	1	118.2680	1.351	94	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]2)(H)	C[6](C[6]C[5,6]C[6]O)(C[6]C[6]H)(C[6]C[6]O)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]2)(H){1|O<1>,1|O<2>,2|H<1>,3|C<4>}	C[6](C[6]C[5,6]C[6]O)(C[6]C[6]H)(C[6]C[6]O){1|O<2>,4|H<1>,6|C<4>}	H(C[6]C[6]2)	117.2780	0.000	1	117.2780	0.000	1	117.2780	0.000	1	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[5,6]HH)(C[6]C[6]N)(H)	C[6](C[6]C[5,6]CH)(C[6]C[6]H)(NCC)	H(C[6]C[6]2)	C[6](C[6]C[5,6]HH)(C[6]C[6]N)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]CH)(C[6]C[6]H)(NCC){1|C<3>,1|C<4>,3|H<1>}	H(C[6]C[6]2)	119.3750	0.000	1	119.3750	0.000	1	119.0982	0.321	6	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[5,6]HH)(C[6]C[6]N)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(NC[5]O)	H(C[6]C[6]2)	C[6](C[6]C[5,6]HH)(C[6]C[6]N)(H){1|C<4>,2|H<1>,2|O<2>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(NC[5]O){1|C<4>,4|H<1>}	H(C[6]C[6]2)	119.4740	0.000	1	119.4740	0.000	1	119.0982	0.321	6	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]N)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(NCC)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]N)(H){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(NCC){1|C<4>,4|H<1>}	H(C[6]C[6]2)	118.7150	0.000	1	118.7150	0.000	1	119.0982	0.321	6	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]N)(H)	C[6](C[6]C[6a]C[6]F)(C[6]C[6]H)(NCH)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]N)(H){1|C<3>,1|C<4>,1|F<1>,2|H<1>}	C[6](C[6]C[6a]C[6]F)(C[6]C[6]H)(NCH){1|C<4>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	118.3400	0.000	1	118.3400	0.000	1	119.0982	0.321	6	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]N)(H)	C[6](C[6]C[6a]C[6]H)(C[6]C[6]H)(NOO)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]N)(H){1|C<3>,1|C<4>,3|H<1>}	C[6](C[6]C[6a]C[6]H)(C[6]C[6]H)(NOO){1|C<4>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	118.8190	0.000	1	118.8190	0.000	1	119.0982	0.321	6	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:N-3:	C[6]-3:	C[6](C[6]C[6]HO)(C[6]C[6]N)(H)	C[6](C[6]O[6]HO)(C[6]C[6]H)(NOO)	H(C[6]C[6]2)	C[6](C[6]C[6]HO)(C[6]C[6]N)(H){1|C<4>,2|H<1>,2|O<2>}	C[6](C[6]O[6]HO)(C[6]C[6]H)(NOO){1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.8660	0.000	1	119.8660	0.000	1	119.0982	0.321	6	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[6]-4:C[6]-3:H-1:	N[6]-4:C[6]-3:O-3:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]N[6]O)(H)	C[6](N[6]C[6]Li2)(C[6]C[6]H)(OLiC)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]N[6]O)(H){1|Li<3>,1|Li<4>,1|C<4>,2|H<1>}	C[6](N[6]C[6]Li2)(C[6]C[6]H)(OLiC){1|C<4>,4|H<1>}	H(C[6]C[6]2)	119.9600	0.023	2	119.9330	0.002	3	119.9330	0.002	3	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[6]-4:C[6]-3:H-1:	N[6]-4:C[6]-3:O-3:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]N[6]O)(H)	C[6](N[6]C[6]Li2)(C[6]C[6]H)(OLiC)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]N[6]O)(H){1|Li<3>,1|Li<5>,1|C<4>,2|H<1>}	C[6](N[6]C[6]Li2)(C[6]C[6]H)(OLiC){1|C<4>,4|H<1>}	H(C[6]C[6]2)	119.8790	0.000	1	119.9330	0.002	3	119.9330	0.002	3	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[6]-4:C[6]-3:H-1:	P-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]P)(H)	C[6](PC[6a]2Cu)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]P)(H){1|C<3>,2|H<1>}	C[6](PC[6a]2Cu)(C[6]C[6]H)2{1|C<3>,3|H<1>}	H(C[6]C[6]2)	119.5810	0.000	1	119.5810	0.000	1	119.3917	0.059	6	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[6]-4:C[6]-3:H-1:	P-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]TiN)(C[6]C[6]P)(H)	C[6](PC[6a]2Pt)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]TiN)(C[6]C[6]P)(H){1|C<3>,2|H<1>}	C[6](PC[6a]2Pt)(C[6]C[6]H)2{1|Ti<10>,1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.2663	0.269	3	119.2663	0.072	3	119.3917	0.059	6	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[6]-4:C[6]-3:H-1:	P-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6]TiN)(C[6]C[6]P)(H)	C[6](PC[6a]2Rh)(C[6]C[6]H)2	H(C[6]C[6]2)	C[6](C[6]C[6]TiN)(C[6]C[6]P)(H){1|C<3>,2|H<1>}	C[6](PC[6a]2Rh)(C[6]C[6]H)2{1|Ti<8>,1|C<3>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	119.4850	0.225	2	119.4850	0.051	2	119.3917	0.059	6	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:3:	3:	C[6]-4:C[6]-3:H-1:	P[6]-4:C[6]-3:C[6]-3:	C[6]-3:	C[6](C[6]C[6,6a]CC)(C[6]C[6]P[6])(H)	C[6](P[6]C[6,6a]C[6a]O)(C[6]C[6]P[6])(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]CC)(C[6]C[6]P[6])(H){1|O<1>,1|P<4>,4|C<3>}	C[6](P[6]C[6,6a]C[6a]O)(C[6]C[6]P[6])(C[6]C[6]H){1|H<1>,1|O<1>,3|C<4>,6|C<3>}	H(C[6]C[6]2)	114.7670	0.438	2	114.7670	0.192	2	114.7670	0.192	2	118.3493	1.686	152	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	B[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:P-4:	C[6]-3:	C[6](B[6]C[6a]2C[6])(C[6]C[6]P)(H)	C[6](C[6]C[6,6]HH)(C[6]B[6]H)(PC3)	H(C[6]B[6]C[6])	C[6](B[6]C[6a]2C[6])(C[6]C[6]P)(H){1|C<4>,4|C<3>,4|H<1>}	C[6](C[6]C[6,6]HH)(C[6]B[6]H)(PC3){2|C<3>,3|C<4>}	H(C[6]B[6]C[6])	117.1350	0.000	1	117.1350	0.000	1	117.1350	0.000	1	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[3,6]-4:C[6]-3:H-1:	C[6,6]-4:C[6]-3:S-4:	C[6]-3:	C[6](C[3,6]C[3,6,6]C[3,6]C[6a])(C[6]C[6,6]S)(H)	C[6](C[6,6]C[6,6a]C[6,6]H)(C[6]C[3,6]H)(SC[6a]OO)	H(C[6]C[3,6]C[6])	C[6](C[3,6]C[3,6,6]C[3,6]C[6a])(C[6]C[6,6]S)(H){1|C<4>,3|H<1>,4|C<3>}	C[6](C[6,6]C[6,6a]C[6,6]H)(C[6]C[3,6]H)(SC[6a]OO){2|C<4>,2|H<1>,3|C<3>}	H(C[6]C[3,6]C[6])	119.1830	0.000	1	119.1830	0.000	1	119.1830	0.000	1	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[3,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[3,6]C[3,5,6]C[3,5]H)(C[6]C[6]C)(H)	C[6](C[6]C[5,6]CH)(C[6]C[3,6]H)(CH3)	H(C[6]C[3,6]C[6])	C[6](C[3,6]C[3,5,6]C[3,5]H)(C[6]C[6]C)(H){1|O<2>,2|C<4>,3|H<1>}	C[6](C[6]C[5,6]CH)(C[6]C[3,6]H)(CH3){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[3,6]C[6])	119.8860	0.000	1	119.8860	0.000	1	119.8860	0.000	1	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[3,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:S-4:	C[6]-3:	C[6](C[3,6]C[3,6]C[3]S)(C[6]C[6]S)(H)	C[6](C[6]C[6a]C[6]H)(C[6]C[3,6]H)(SC[6a]OO)	H(C[6]C[3,6]C[6])	C[6](C[3,6]C[3,6]C[3]S)(C[6]C[6]S)(H){1|C<4>,2|C<3>,3|H<1>}	C[6](C[6]C[6a]C[6]H)(C[6]C[3,6]H)(SC[6a]OO){1|S<4>,2|C<3>,2|C<4>,2|H<1>}	H(C[6]C[3,6]C[6])	119.0880	0.000	1	119.0880	0.000	1	119.0880	0.000	1	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[4,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[4,6]C[4,5,6]C[4]H)(C[6]C[6]C)(H)	C[6](C[6]C[5,6]CH)(C[6]C[4,6]H)(CH3)	H(C[6]C[4,6]C[6])	C[6](C[4,6]C[4,5,6]C[4]H)(C[6]C[6]C)(H){1|O<1>,2|H<1>,3|C<4>}	C[6](C[6]C[5,6]CH)(C[6]C[4,6]H)(CH3){1|C<4>,2|C<3>,2|H<1>}	H(C[6]C[4,6]C[6])	118.9020	0.000	1	118.9020	0.000	1	118.1220	0.305	4	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[4,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[4,6]C[4,6,6]B[4]H)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]HH)(C[6]C[4,6]H)(CH3)	H(C[6]C[4,6]C[6])	C[6](C[4,6]C[4,6,6]B[4]H)(C[6]C[6]C)(H){1|N<4>,2|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[6,6]HH)(C[6]C[4,6]H)(CH3){1|B<4>,2|C<4>,2|H<1>}	H(C[6]C[4,6]C[6])	117.8620	0.226	3	117.8620	0.051	3	118.1220	0.305	4	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[5,5,6]-4:C[6]-3:H-1:	C[5,6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[5,5,6]C[3x5]C[5,6]O[5])(C[6]C[5,6]C)(H)	C[6](C[5,6]C[5]2C[6])(C[6]C[5,5,6]H)(CH3)	H(C[6]C[5,5,6]C[6])	C[6](C[5,5,6]C[3x5]C[5,6]O[5])(C[6]C[5,6]C)(H){1|C<3>,1|H<1>,2|O<2>,5|C<4>}	C[6](C[5,6]C[5]2C[6])(C[6]C[5,5,6]H)(CH3){1|O<2>,5|C<4>,5|H<1>}	H(C[6]C[5,5,6]C[6])	117.4660	0.000	1	117.4660	0.000	1	117.4660	0.000	1	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[5,5,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[5,5,6]C[5,5,6,6]C[5,5,6]H)(C[6]C[6]C)(H)	C[6](C[6]C[5,6,6]HO)(C[6]C[5,5,6]H)(CH3)	H(C[6]C[5,5,6]C[6])	C[6](C[5,5,6]C[5,5,6,6]C[5,5,6]H)(C[6]C[6]C)(H){1|H<1>,2|O<2>,5|C<4>}	C[6](C[6]C[5,6,6]HO)(C[6]C[5,5,6]H)(CH3){1|H<1>,4|C<4>}	H(C[6]C[5,5,6]C[6])	118.6700	0.000	1	118.6700	0.000	1	118.6700	0.000	1	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[5,6]-4:C[6]-3:H-1:	C[3,6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[3,6]C)(H)	C[6](C[3,6]C[3,6]C[3]H)(C[6]C[5,6]H)(CH3)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[3,6]C)(H){1|C<3>,1|N<3>,1|O<1>,2|C<4>,2|H<1>}	C[6](C[3,6]C[3,6]C[3]H)(C[6]C[5,6]H)(CH3){1|C<3>,1|C<4>,2|H<1>,2|O<2>}	H(C[6]C[5,6]C[6])	117.3250	0.000	1	117.3250	0.000	1	117.3250	0.000	1	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[5,6]-4:C[6]-3:H-1:	C[5,5,6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[5,6]C[5,6,6]O[5]H)(C[6]C[5,5,6]C)(H)	C[6](C[5,5,6]C[5,6,6]C[5,5]O[5])(C[6]C[5,6]H)(CH3)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6,6]O[5]H)(C[6]C[5,5,6]C)(H){1|H<1>,1|O<2>,4|C<4>}	C[6](C[5,5,6]C[5,6,6]C[5,5]O[5])(C[6]C[5,6]H)(CH3){2|C<3>,2|H<1>,2|O<2>,3|C<4>}	H(C[6]C[5,6]C[6])	119.0830	0.000	1	119.0830	0.000	1	119.0830	0.000	1	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[5,6]-4:C[6]-3:H-1:	C[5,6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[5,6]O[5,6]C[5]O)(C[6]C[5,6]C)(H)	C[6](C[5,6]C[5,5,6]C[5]H)(C[6]C[5,6]H)(CH3)	H(C[6]C[5,6]C[6])	C[6](C[5,6]O[5,6]C[5]O)(C[6]C[5,6]C)(H){1|C<3>,1|H<1>,3|C<4>}	C[6](C[5,6]C[5,5,6]C[5]H)(C[6]C[5,6]H)(CH3){1|C<3>,2|H<1>,2|O<2>,3|C<4>}	H(C[6]C[5,6]C[6])	119.6515	0.030	2	119.6515	0.001	2	119.6515	0.001	2	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[5,6]-4:C[6]-3:H-1:	C[6,6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[5,6]C[5,6]N[5]H)(C[6]C[6,6]C)(H)	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[5,6]H)(CH3)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6]N[5]H)(C[6]C[6,6]C)(H){2|C<3>,2|C<4>,3|H<1>}	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[5,6]H)(CH3){1|C<3>,1|N<3>,2|C<4>,4|H<1>}	H(C[6]C[5,6]C[6])	116.6050	0.000	1	116.6050	0.000	1	116.6050	0.000	1	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[5,6]C[5,6,6]C[5,5]H)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]CH)(C[6]C[5,6]H)(CH3)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6,6]C[5,5]H)(C[6]C[6]C)(H){2|C<3>,2|H<1>,4|C<4>}	C[6](C[6]C[6,6]CH)(C[6]C[5,6]H)(CH3){2|H<1>,3|C<4>}	H(C[6]C[5,6]C[6])	124.0420	0.000	1	124.0420	0.000	1	118.8886	9.420	7	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[5,6]C[5,6,6]C[5]H)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]HH)(C[6]C[5,6]H)(CH3)	H(C[6]C[5,6]C[6])	C[6](C[5,6]C[5,6,6]C[5]H)(C[6]C[6]C)(H){1|O<2>,2|C<4>,5|H<1>}	C[6](C[6]C[6,6]HH)(C[6]C[5,6]H)(CH3){1|H<1>,2|C<3>,2|C<4>}	H(C[6]C[5,6]C[6])	120.2080	0.000	1	120.2080	0.000	1	118.8886	9.420	7	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[5,6]N[5,6]C[5]H)(C[6]C[6]C)(H)	C[6](C[6]C[5,6]HH)(C[6]C[5,6]H)(CH3)	H(C[6]C[5,6]C[6])	C[6](C[5,6]N[5,6]C[5]H)(C[6]C[6]C)(H){1|N<3>,2|C<4>,4|H<1>}	C[6](C[6]C[5,6]HH)(C[6]C[5,6]H)(CH3){1|H<1>,1|N<3>,3|C<4>}	H(C[6]C[5,6]C[6])	115.9690	0.000	3	115.9690	0.000	3	118.8886	9.420	7	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[5,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[5,6]O[5,6]C[5]H)(C[6]C[6]C)(H)	C[6](C[6]C[5,6]HH)(C[6]C[5,6]H)(CH3)	H(C[6]C[5,6]C[6])	C[6](C[5,6]O[5,6]C[5]H)(C[6]C[6]C)(H){2|C<4>,4|H<1>}	C[6](C[6]C[5,6]HH)(C[6]C[5,6]H)(CH3){1|O<2>,2|C<4>,2|H<1>}	H(C[6]C[5,6]C[6])	120.0315	0.187	2	120.0315	0.035	2	118.8886	9.420	7	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6,6]-4:C[6]-3:H-1:	C[5,6,6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6,6]C[3x6]C[6]O)(C[6]C[5,6,6]C)(H)	C[6](C[5,6,6]C[5,6,6]C[5,6a]C[6])(C[6]C[6,6]H)(CH3)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[3x6]C[6]O)(C[6]C[5,6,6]C)(H){1|N<3>,2|C<4>,2|H<1>,3|C<3>}	C[6](C[5,6,6]C[5,6,6]C[5,6a]C[6])(C[6]C[6,6]H)(CH3){1|N<2>,1|O<2>,2|C<3>,2|H<1>,3|C<4>}	H(C[6]C[6,6]C[6])	116.6850	0.137	2	116.6850	0.019	2	116.6850	0.019	2	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6,6]-4:C[6]-3:H-1:	C[5,6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[5,6]C)(H)	C[6](C[5,6]C[5,5]C[5,6]H)(C[6]C[6,6]H)(CH3)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[5,6]C)(H){4|C<4>,4|H<1>}	C[6](C[5,6]C[5,5]C[5,6]H)(C[6]C[6,6]H)(CH3){1|C<3>,2|H<1>,5|C<4>}	H(C[6]C[6,6]C[6])	117.3410	0.000	1	117.3410	0.000	1	117.4555	0.026	2	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6,6]-4:C[6]-3:H-1:	C[5,6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[5,6]C)(H)	C[6](C[5,6]C[5,6]2H)(C[6]C[6,6]H)(CH3)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[5,6]C)(H){4|C<4>,4|H<1>}	C[6](C[5,6]C[5,6]2H)(C[6]C[6,6]H)(CH3){2|C<3>,2|H<1>,4|C<4>}	H(C[6]C[6,6]C[6])	117.5700	0.000	1	117.5700	0.000	1	117.4555	0.026	2	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6,6]-4:C[6]-3:H-1:	C[6,6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6,6]C)(H)	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6,6]H)(CH3)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6,6]C)(H){2|C<3>,2|C<4>,4|H<1>}	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6,6]H)(CH3){2|C<3>,2|C<4>,4|H<1>}	H(C[6]C[6,6]C[6])	117.5400	0.000	1	117.5400	0.000	1	117.5400	0.000	1	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6,6]C[3x6]C[6]H)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]CH)(C[6]C[6,6]H)(CH3)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[3x6]C[6]H)(C[6]C[6]C)(H){4|C<4>,4|H<1>}	C[6](C[6]C[6,6]CH)(C[6]C[6,6]H)(CH3){2|H<1>,3|C<4>}	H(C[6]C[6,6]C[6])	117.0220	0.000	1	117.0220	0.000	1	118.4248	1.711	24	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6,6]C[5,6,6]C[6,6]H)(C[6]C[6]C)(H)	C[6](C[6]C[5,6]CH)(C[6]C[6,6]H)(CH3)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6,6]C[6,6]H)(C[6]C[6]C)(H){2|C<3>,2|H<1>,4|C<4>}	C[6](C[6]C[5,6]CH)(C[6]C[6,6]H)(CH3){2|H<1>,3|C<4>}	H(C[6]C[6,6]C[6])	121.1850	0.000	1	121.1850	0.000	1	118.4248	1.711	24	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6,6]C[5,6,6]C[6]H)(C[6]C[6]C)(H)	C[6](C[6]C[5,6]CH)(C[6]C[6,6]H)(CH3)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[5,6,6]C[6]H)(C[6]C[6]C)(H){1|C<3>,3|H<1>,4|C<4>}	C[6](C[6]C[5,6]CH)(C[6]C[6,6]H)(CH3){2|H<1>,3|C<4>}	H(C[6]C[6,6]C[6])	120.6310	0.097	4	120.6310	0.009	4	118.4248	1.711	24	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]HH)(C[6]C[6,6]H)(CH3)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]C)(C[6]C[6]C)(H){1|B<4>,1|C<4>,6|H<1>}	C[6](C[6]C[6,6]HH)(C[6]C[6,6]H)(CH3){1|H<1>,4|C<4>}	H(C[6]C[6,6]C[6])	117.6020	0.182	2	117.6020	0.033	2	118.4248	1.711	24	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]C)(H)	C[6](C[6]C[3]C[6]O)(C[6]C[6,6]H)(CH3)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]C)(H){1|C<3>,1|O<2>,3|C<4>,3|H<1>}	C[6](C[6]C[3]C[6]O)(C[6]C[6,6]H)(CH3){1|C<3>,1|O<2>,2|H<1>,4|C<4>}	H(C[6]C[6,6]C[6])	117.0627	0.407	3	117.0627	0.165	3	118.4248	1.711	24	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]HH)(C[6]C[6,6]H)(CH3)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]C)(H){1|C<4>,2|C<3>,4|H<1>}	C[6](C[6]C[6,6]HH)(C[6]C[6,6]H)(CH3){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6,6]C[6])	118.0220	0.179	8	118.0220	0.032	8	118.4248	1.711	24	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]C)(H)	C[6](C[6]C[6a]C[6]H)(C[6]C[6,6]H)(CHHO)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]C)(H){2|C<4>,3|C<3>,3|H<1>}	C[6](C[6]C[6a]C[6]H)(C[6]C[6,6]H)(CHHO){1|N<3>,2|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6,6]C[6])	117.3730	0.000	1	117.3730	0.000	1	118.4248	1.711	24	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6,6]C[6,6a]C[6,6]N)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]HH)(C[6]C[6,6]H)(CH3)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]C[6,6]N)(C[6]C[6]C)(H){1|C<4>,1|O<1>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6]HH)(C[6]C[6,6]H)(CH3){1|C<4>,1|H<1>,1|N<3>,2|C<3>}	H(C[6]C[6,6]C[6])	118.8020	0.000	1	118.3808	0.119	4	118.4248	1.711	24	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6,6]C[6,6a]C[6,6]N)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]HH)(C[6]C[6,6]H)(CH3)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]C[6,6]N)(C[6]C[6]C)(H){1|C<4>,1|O<2>,2|C<3>,3|H<1>}	C[6](C[6]C[6,6]HH)(C[6]C[6,6]H)(CH3){1|C<3>,1|H<1>,1|N<3>,2|C<4>}	H(C[6]C[6,6]C[6])	118.0350	0.000	1	118.3808	0.119	4	118.4248	1.711	24	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6,6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6,6]C[6,6a]C[6,6]N)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]HH)(C[6]C[6,6]H)(CH3)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6a]C[6,6]N)(C[6]C[6]C)(H){1|O<2>,2|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[6,6]HH)(C[6]C[6,6]H)(CH3){1|C<3>,1|H<1>,1|N<3>,2|C<4>}	H(C[6]C[6,6]C[6])	118.3430	0.236	2	118.3808	0.119	4	118.4248	1.711	24	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	B[6]-4:C[6]-3:Si-4:	C[6]-3:	C[6](C[6]C[6]CH)(C[6]B[6]Si)(H)	C[6](B[6]C[6]N[6]Cl)(C[6]C[6]H)(SiC3)	H(C[6]C[6]2)	C[6](C[6]C[6]CH)(C[6]B[6]Si)(H){1|Cl<1>,1|C<3>,1|H<1>,1|N<3>}	C[6](B[6]C[6]N[6]Cl)(C[6]C[6]H)(SiC3){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	119.4740	0.000	1	119.4740	0.000	1	118.5530	0.921	3	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	B[6]-4:C[6]-3:Si-4:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]B[6]Si)(H)	C[6](B[6]C[6]N[5]2)(C[6]C[6]H)(SiC3)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]B[6]Si)(H){1|C<3>,1|H<1>,2|N<3>}	C[6](B[6]C[6]N[5]2)(C[6]C[6]H)(SiC3){3|H<1>,5|C<3>}	H(C[6]C[6]2)	118.0925	0.754	2	118.0925	0.569	2	118.5530	0.921	3	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[3x6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[3x6]HH)(C[6]C[3x6]C)(H)	C[6](C[3x6]C[5,4x6]C[6,6]H)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[3x6]HH)(C[6]C[3x6]C)(H){1|C<3>,1|H<1>,3|C<4>}	C[6](C[3x6]C[5,4x6]C[6,6]H)(C[6]C[6]H)(CH3){1|C<3>,3|H<1>,4|C<4>}	H(C[6]C[6]2)	118.6700	0.000	1	118.6700	0.000	1	118.6700	0.000	1	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[5,6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,5,6]C[3]H)(C[6]C[5,6]C)(H)	C[6](C[5,6]C[5,5,6]C[5]O)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5,5,6]C[3]H)(C[6]C[5,6]C)(H){1|C<3>,1|H<1>,2|O<2>,4|C<4>}	C[6](C[5,6]C[5,5,6]C[5]O)(C[6]C[6]H)(CH3){1|C<3>,1|O<1>,1|O<2>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.0450	0.000	1	118.0450	0.000	1	118.0648	0.581	11	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[5,6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,5,6]HH)(C[6]C[5,6]C)(H)	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[5,5,6]HH)(C[6]C[5,6]C)(H){1|H<1>,4|C<4>}	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(CCHH){4|C<4>,4|H<1>}	H(C[6]C[6]2)	118.6010	0.882	2	118.6010	0.779	2	118.0648	0.581	11	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[5,6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,5,6]HO)(C[6]C[5,6]C)(H)	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5,5,6]HO)(C[6]C[5,6]C)(H){1|C<3>,1|H<1>,3|C<4>}	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(CH3){1|H<1>,1|O<1>,1|O<2>,4|C<4>}	H(C[6]C[6]2)	118.0060	0.000	1	118.0060	0.000	1	118.0648	0.581	11	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[5,6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]CH)(C[6]C[5,6]C)(H)	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5,6]CH)(C[6]C[5,6]C)(H){1|C<3>,1|H<1>,1|O<2>,2|C<4>}	C[6](C[5,6]C[5,6]C[5]H)(C[6]C[6]H)(CH3){1|C<3>,3|C<4>,4|H<1>}	H(C[6]C[6]2)	118.0820	0.000	1	118.0820	0.000	1	118.0648	0.581	11	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[5,6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]HH)(C[6]C[5,6]C)(H)	C[6](C[5,6]C[5,6]O[5]C)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5,6]HH)(C[6]C[5,6]C)(H){1|C<2>,1|H<1>,1|O<2>,2|C<4>}	C[6](C[5,6]C[5,6]O[5]C)(C[6]C[6]H)(CH3){1|O<2>,2|C<4>,3|H<1>}	H(C[6]C[6]2)	117.9610	0.000	1	117.9610	0.000	1	118.0648	0.581	11	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[5,6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]HO)(C[6]C[5,6]C)(H)	C[6](C[5,6]O[5,6]C[5]H)(C[6]C[6]H)(CC[6]HH)	H(C[6]C[6]2)	C[6](C[6]C[5,6]HO)(C[6]C[5,6]C)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[5,6]O[5,6]C[5]H)(C[6]C[6]H)(CC[6]HH){1|O<2>,2|H<1>,3|C<4>}	H(C[6]C[6]2)	119.6440	0.000	1	119.6440	0.000	1	118.0648	0.581	11	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[5,6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6]HH)(C[6]C[5,6]C)(H)	C[6](C[5,6]C[5,6,6]C[5]H)(C[6]C[6]H)(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6,6]HH)(C[6]C[5,6]C)(H){2|H<1>,3|C<4>}	C[6](C[5,6]C[5,6,6]C[5]H)(C[6]C[6]H)(CHHO){1|O<2>,3|C<4>,4|H<1>}	H(C[6]C[6]2)	117.7950	0.000	1	117.7950	0.000	1	118.0648	0.581	11	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[5,6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6]HH)(C[6]C[5,6]C)(H)	C[6](C[5,6]C[6,6]C[5]O[5])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6]HH)(C[6]C[5,6]C)(H){1|H<1>,1|O<2>,3|C<4>}	C[6](C[5,6]C[6,6]C[5]O[5])(C[6]C[6]H)(CH3){1|O<2>,2|C<3>,3|C<4>,3|H<1>}	H(C[6]C[6]2)	116.9310	0.000	1	117.2160	0.162	2	118.0648	0.581	11	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[5,6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6]HH)(C[6]C[5,6]C)(H)	C[6](C[5,6]C[6,6]C[5]O[5])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6]HH)(C[6]C[5,6]C)(H){1|H<1>,1|O<2>,3|C<4>}	C[6](C[5,6]C[6,6]C[5]O[5])(C[6]C[6]H)(CH3){2|C<3>,3|C<4>,4|H<1>}	H(C[6]C[6]2)	117.5010	0.000	1	117.2160	0.162	2	118.0648	0.581	11	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[5,6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]HH)(C[6]C[5,6]C)(H)	C[6](C[5,6]C[5,6a]C[6,6a]C[5])(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]HH)(C[6]C[5,6]C)(H){1|C<4>,3|C<3>}	C[6](C[5,6]C[5,6a]C[6,6a]C[5])(C[6]C[6]H)(CH3){1|N<3>,3|H<1>,5|C<3>}	H(C[6]C[6]2)	117.5460	0.000	1	117.5460	0.000	1	118.0648	0.581	11	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6,6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6,6]HH)(C[6]C[6,6]C)(H)	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5,6,6]HH)(C[6]C[6,6]C)(H){1|H<1>,4|C<4>}	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(CH3){2|C<4>,6|H<1>}	H(C[6]C[6]2)	117.6055	0.282	2	117.6055	0.080	2	117.6685	0.366	4	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6,6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6]HH)(C[6]C[6,6]C)(H)	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6]HH)(C[6]C[6,6]C)(H){2|H<1>,3|C<4>}	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(CH3){1|N<3>,2|C<4>,5|H<1>}	H(C[6]C[6]2)	117.0240	0.000	1	117.0240	0.000	1	117.6685	0.366	4	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6,6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]O[6]H)(C[6]C[6,6]C)(H)	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]O[6]H)(C[6]C[6,6]C)(H){2|H<1>,4|C<4>}	C[6](C[6,6]C[6,6]C[6]H)(C[6]C[6]H)(CHHO){1|C<4>,1|O<2>,2|C<3>,4|H<1>}	H(C[6]C[6]2)	118.4390	0.000	1	118.4390	0.000	1	117.6685	0.366	4	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]B[6]HH)(C[6]C[6]C)(H)	C[6](C[6]P[6]HH)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]B[6]HH)(C[6]C[6]C)(H){1|P<4>,2|C<3>,2|H<1>}	C[6](C[6]P[6]HH)(C[6]C[6]H)(CH3){1|B<4>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	118.0480	1.069	2	117.2963	2.267	3	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]B[6]HH)(C[6]C[6]C)(H)	C[6](C[6]P[6]HH)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]B[6]HH)(C[6]C[6]C)(H){1|P<4>,2|C<3>,2|H<1>}	C[6](C[6]P[6]HH)(C[6]C[6]H)(CH3){1|B<4>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	115.7930	0.000	1	117.2963	2.267	3	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[3,3]C[6]H)(C[6]C[6]C)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[3,3]C[6]H)(C[6]C[6]C)(H){1|Pd<5>,1|C<2>,1|C<3>,2|C<1>,2|H<1>,3|C<4>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(CH3){1|Pd<5>,1|C<4>,1|C<6>,2|H<1>}	H(C[6]C[6]2)	116.6060	0.000	1	116.6060	0.000	1	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[3,6]CH)(C[6]C[6]C)(H)	C[6](C[6]C[6]BrH)(C[6]C[6]H)(CBrHH)	H(C[6]C[6]2)	C[6](C[6]C[3,6]CH)(C[6]C[6]C)(H){1|Br<1>,1|H<1>,3|C<4>}	C[6](C[6]C[6]BrH)(C[6]C[6]H)(CBrHH){2|C<4>,3|H<1>}	H(C[6]C[6]2)	116.5880	0.092	2	116.5880	0.008	2	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[3,6]CH)(C[6]C[6]C)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(CBrHH)	H(C[6]C[6]2)	C[6](C[6]C[3,6]CH)(C[6]C[6]C)(H){2|H<1>,3|C<4>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(CBrHH){2|C<4>,3|H<1>}	H(C[6]C[6]2)	117.5125	0.207	2	117.5125	0.043	2	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[3,6]CH)(C[6]C[6]C)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[3,6]CH)(C[6]C[6]C)(H){2|H<1>,3|C<4>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(CH3){2|C<4>,3|H<1>}	H(C[6]C[6]2)	116.1825	1.378	2	116.1825	1.899	2	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[3,6]CH)(C[6]C[6]C)(H)	C[6](C[6]C[6]HN)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[3,6]CH)(C[6]C[6]C)(H){1|H<1>,1|N<3>,3|C<4>}	C[6](C[6]C[6]HN)(C[6]C[6]H)(CH3){2|C<4>,3|H<1>}	H(C[6]C[6]2)	116.8410	0.000	1	116.8410	0.000	1	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[3,6]CH)(C[6]C[6]C)(H)	C[6](C[6]C[6]HO)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[3,6]CH)(C[6]C[6]C)(H){1|H<1>,1|O<2>,3|C<4>}	C[6](C[6]C[6]HO)(C[6]C[6]H)(CH3){2|C<4>,3|H<1>}	H(C[6]C[6]2)	116.8720	0.000	1	116.8720	0.000	1	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[3,6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[3,6]CH)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[3,6]HH)(C[6]C[6]C)(H){2|H<1>,3|C<4>}	C[6](C[6]C[3,6]CH)(C[6]C[6]H)(CH3){2|C<4>,3|H<1>}	H(C[6]C[6]2)	116.6410	0.000	1	116.6410	0.000	1	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[3,6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[3,6]HH)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[3,6]HH)(C[6]C[6]C)(H){1|N<3>,2|C<4>,2|H<1>}	C[6](C[6]C[3,6]HH)(C[6]C[6]H)(CH3){1|C<4>,1|N<3>,3|H<1>}	H(C[6]C[6]2)	117.2245	0.090	2	117.2245	0.008	2	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[3x6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[3x6]HH)(C[6]C[6]C)(H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(CCHH){1|C<3>,1|C<4>,3|H<1>}	H(C[6]C[6]2)	117.0915	0.040	2	117.0915	0.002	2	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6,6]HO)(C[6]C[6]C)(H)	C[6](C[6]C[5,6,6]HO)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5,6,6]HO)(C[6]C[6]C)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6,6]HO)(C[6]C[6]H)(CH3){1|O<2>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.7960	0.000	1	118.7960	0.000	1	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]CC)(C[6]C[6]C)(H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5,6]CC)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|O<2>,2|C<4>}	C[6](C[6]C[6]CH)(C[6]C[6]H)(CH3){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	116.5443	0.362	4	116.5443	0.131	4	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]CC)(C[6]C[6]C)(H)	C[6](C[6]C[6]HO)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5,6]CC)(C[6]C[6]C)(H){1|H<1>,2|C<4>,2|O<2>}	C[6](C[6]C[6]HO)(C[6]C[6]H)(CH3){2|H<1>,3|C<4>}	H(C[6]C[6]2)	116.5610	0.000	2	116.5610	0.000	2	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]CH)(C[6]C[6]C)(H)	C[6](C[6]C[5,6]CH)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5,6]CH)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|O<2>,2|C<4>}	C[6](C[6]C[5,6]CH)(C[6]C[6]H)(CH3){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	121.1310	0.178	4	120.5939	0.295	9	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]CH)(C[6]C[6]C)(H)	C[6](C[6]C[5,6]CH)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5,6]CH)(C[6]C[6]C)(H){1|H<1>,2|C<3>,2|C<4>}	C[6](C[6]C[5,6]CH)(C[6]C[6]H)(CH3){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	120.1642	0.219	5	120.5939	0.295	9	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]CH)(C[6]C[6]C)(H)	C[6](C[6]C[5,6]CH)(C[6]C[6]H)(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[5,6]CH)(C[6]C[6]C)(H){1|H<1>,2|C<3>,2|C<4>}	C[6](C[6]C[5,6]CH)(C[6]C[6]H)(CHHO){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	120.9150	0.311	2	120.9150	0.097	2	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]CH)(C[6]C[6]C)(H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5,6]CH)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|O<2>,2|C<4>}	C[6](C[6]C[6]CH)(C[6]C[6]H)(CH3){2|C<4>,3|H<1>}	H(C[6]C[6]2)	116.9000	0.243	2	116.9000	0.059	2	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]CH)(C[6]C[6]C)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5,6]CH)(C[6]C[6]C)(H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(CH3){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	117.0760	0.000	1	117.0760	0.000	1	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]C[6a]H)(C[6]C[6]C)(H)	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C[6a]H)(C[6]C[6]C)(H){1|C<4>,3|C<3>,3|H<1>}	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(CH3){1|C<4>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	117.4420	0.256	2	117.4420	0.066	2	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[5,6]CH)(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[5,6]HH)(C[6]C[6]C)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]CH)(C[6]C[6]H)(CCHH){1|C<3>,1|C<4>,3|H<1>}	H(C[6]C[6]2)	119.5200	0.000	1	119.5200	0.000	1	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[5,6]CH)(C[6]C[6]H)(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[5,6]HH)(C[6]C[6]C)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]CH)(C[6]C[6]H)(CHHO){1|C<3>,1|C<4>,3|H<1>}	H(C[6]C[6]2)	118.2700	0.000	1	118.2700	0.000	1	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(CC[6a]HH)	H(C[6]C[6]2)	C[6](C[6]C[5,6]HH)(C[6]C[6]C)(H){2|H<1>,3|C<4>}	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(CC[6a]HH){2|C<4>,3|H<1>}	H(C[6]C[6]2)	117.1800	0.000	1	117.1800	0.000	1	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5,6]HH)(C[6]C[6]C)(H){1|Fe<10>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(CH3){1|Fe<10>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	126.2320	0.000	1	126.2320	0.000	1	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[5,6]HN)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5,6]HH)(C[6]C[6]C)(H){1|C<3>,1|C<4>,1|N<3>,2|H<1>}	C[6](C[6]C[5,6]HN)(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,3|H<1>}	H(C[6]C[6]2)	120.1760	0.000	1	120.1760	0.000	1	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5,6]HH)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|O<2>,2|C<4>}	C[6](C[6]C[6]CH)(C[6]C[6]H)(CH3){2|H<1>,3|C<4>}	H(C[6]C[6]2)	117.8230	0.000	2	117.7810	0.002	4	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5,6]HH)(C[6]C[6]C)(H){1|H<1>,1|O<2>,3|C<4>}	C[6](C[6]C[6]CH)(C[6]C[6]H)(CH3){2|H<1>,3|C<4>}	H(C[6]C[6]2)	117.7390	0.000	2	117.7810	0.002	4	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]HN)(C[6]C[6]C)(H)	C[6](C[6]C[5,6]CH)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5,6]HN)(C[6]C[6]C)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[5,6]CH)(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	119.7690	0.000	1	119.7690	0.000	1	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]HO)(C[6]C[6]C)(H)	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5,6]HO)(C[6]C[6]C)(H){1|C<4>,2|C<3>,2|H<1>}	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(CH3){1|O<2>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	117.6790	0.000	1	117.6790	0.000	1	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5,6]HO)(C[6]C[6]C)(H)	C[6](C[6]C[5,6]HO)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5,6]HO)(C[6]C[6]C)(H){1|C<4>,2|H<1>,2|O<2>}	C[6](C[6]C[5,6]HO)(C[6]C[6]H)(CH3){1|C<4>,2|H<1>,2|O<2>}	H(C[6]C[6]2)	123.3930	0.000	1	123.3930	0.000	1	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5a]C[6]H)(C[6]C[6]C)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6]H)(C[6]C[6]C)(H){1|C<4>,1|N<3>,2|C<3>,3|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(CH3){1|C<4>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	117.5470	0.000	1	117.4003	0.041	3	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5a]C[6]H)(C[6]C[6]C)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6]H)(C[6]C[6]C)(H){1|C<4>,3|C<3>,3|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(CH3){1|C<3>,1|H<1>,3|C<4>}	H(C[6]C[6]2)	117.4860	0.000	1	117.4003	0.041	3	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[5a]C[6]H)(C[6]C[6]C)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[5a]C[6]H)(C[6]C[6]C)(H){1|N<3>,2|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,3|H<1>}	H(C[6]C[6]2)	117.1680	0.000	1	117.4003	0.041	3	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6]CH)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6,6]CH)(C[6]C[6]C)(H){1|C<3>,1|C<4>,2|H<1>}	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(CCHH){1|C<4>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	117.4240	0.000	1	117.4240	0.000	1	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6]CH)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6]CH)(C[6]C[6]C)(H){1|C<3>,1|C<4>,2|H<1>}	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(CH3){1|C<4>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	117.2965	0.400	2	117.2965	0.160	2	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6]CH)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]HO)(C[6]C[6]H)(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6,6]CH)(C[6]C[6]C)(H){1|H<1>,2|C<4>,2|O<2>}	C[6](C[6]C[6,6]HO)(C[6]C[6]H)(CHHO){2|H<1>,3|C<4>}	H(C[6]C[6]2)	117.3700	0.223	2	117.3700	0.050	2	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[3x6]HH)(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6,6]HH)(C[6]C[6]C)(H){1|C<3>,1|C<4>,3|H<1>}	C[6](C[6]C[3x6]HH)(C[6]C[6]H)(CCHH){1|C<4>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	117.3400	0.000	1	117.3400	0.000	1	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]CC)(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6,6]HH)(C[6]C[6]C)(H){1|H<1>,4|C<4>}	C[6](C[6]C[6,6]CC)(C[6]C[6]H)(CCHH){2|C<4>,3|H<1>}	H(C[6]C[6]2)	117.2040	0.000	1	117.2040	0.000	1	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]CH)(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6,6]HH)(C[6]C[6]C)(H){2|H<1>,3|C<4>}	C[6](C[6]C[6,6]CH)(C[6]C[6]H)(CCHH){2|H<1>,3|C<4>}	H(C[6]C[6]2)	117.8160	0.000	1	117.8160	0.000	1	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]CH)(C[6]C[6]H)(CC[6]HH)	H(C[6]C[6]2)	C[6](C[6]C[6,6]HH)(C[6]C[6]C)(H){1|N<2>,2|C<4>,2|H<1>}	C[6](C[6]C[6,6]CH)(C[6]C[6]H)(CC[6]HH){2|H<1>,3|C<4>}	H(C[6]C[6]2)	117.3220	0.000	1	117.3220	0.000	1	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]CH)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6]HH)(C[6]C[6]C)(H){2|H<1>,3|C<4>}	C[6](C[6]C[6,6]CH)(C[6]C[6]H)(CH3){2|H<1>,3|C<4>}	H(C[6]C[6]2)	118.0834	1.071	5	118.0834	1.147	5	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6]HH)(C[6]C[6]C)(H){2|C<4>,3|H<1>}	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,3|H<1>}	H(C[6]C[6]2)	117.5666	0.336	5	117.6889	0.103	8	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6]HH)(C[6]C[6]C)(H){2|C<4>,3|H<1>}	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(CH3){2|C<4>,3|H<1>}	H(C[6]C[6]2)	118.0470	0.000	1	117.6889	0.103	8	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6]HH)(C[6]C[6]C)(H){2|C<4>,3|H<1>}	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(CH3){2|H<1>,3|C<4>}	H(C[6]C[6]2)	117.6850	0.000	1	117.6889	0.103	8	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6]HH)(C[6]C[6]C)(H){2|H<1>,3|C<4>}	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(CH3){2|C<4>,3|H<1>}	H(C[6]C[6]2)	117.9460	0.000	1	117.6889	0.103	8	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6]HH)(C[6]C[6]C)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(CH3){1|C<4>,4|H<1>}	H(C[6]C[6]2)	117.5995	0.322	2	117.5995	0.104	2	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6]HH)(C[6]C[6]C)(H)	C[6](C[6]N[6,6]HH)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6]HH)(C[6]C[6]C)(H){1|C<3>,1|N<3>,3|H<1>}	C[6](C[6]N[6,6]HH)(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	118.5520	0.000	1	118.5520	0.000	1	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6]HH)(C[6]C[6]C)(H)	C[6](C[6]S[6]HH)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6]HH)(C[6]C[6]C)(H){1|S<2>,2|C<3>,2|H<1>}	C[6](C[6]S[6]HH)(C[6]C[6]H)(CH3){1|C<4>,2|H<1>}	H(C[6]C[6]2)	115.8930	0.000	1	115.8930	0.000	1	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6]HO)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]HO)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6,6]HO)(C[6]C[6]C)(H){1|C<3>,1|C<4>,1|H<1>,2|O<2>}	C[6](C[6]C[6,6]HO)(C[6]C[6]H)(CH3){1|H<1>,2|C<4>,2|O<2>}	H(C[6]C[6]2)	117.1250	0.000	1	117.1250	0.000	1	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]CC)(C[6]C[6]C)(H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]CC)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|O<2>,2|C<4>}	C[6](C[6]C[6]CH)(C[6]C[6]H)(CH3){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	116.5420	0.000	1	116.5420	0.000	1	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]CC)(C[6]C[6]C)(H)	C[6](C[6]C[6a]C[6]Pd)(C[6]C[6]H)(CCCH)	H(C[6]C[6]2)	C[6](C[6]C[6]CC)(C[6]C[6]C)(H){1|Pd<5>,1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6a]C[6]Pd)(C[6]C[6]H)(CCCH){2|C<3>,4|C<4>}	H(C[6]C[6]2)	117.4600	0.000	1	117.4600	0.000	1	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]CH)(C[6]C[6]C)(H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]CH)(C[6]C[6]C)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[6]CH)(C[6]C[6]H)(CH3){1|C<4>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	126.0250	0.000	1	126.0250	0.000	1	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]CH)(C[6]C[6]C)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]CH)(C[6]C[6]C)(H){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(CC3){2|C<4>,3|H<1>}	H(C[6]C[6]2)	116.8270	0.000	1	116.8270	0.000	1	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]CH)(C[6]C[6]C)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]CH)(C[6]C[6]C)(H){1|C<4>,1|N<3>,3|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(CH3){2|C<4>,3|H<1>}	H(C[6]C[6]2)	116.5490	0.000	1	117.0240	0.451	2	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]CH)(C[6]C[6]C)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]CH)(C[6]C[6]C)(H){1|Pd<5>,2|C<4>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(CH3){1|Pd<5>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	117.4990	0.000	1	117.0240	0.451	2	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]CH)(C[6]C[6]C)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]CH)(C[6]C[6]C)(H){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(CHHO){2|C<4>,3|H<1>}	H(C[6]C[6]2)	117.9670	0.000	1	117.9670	0.000	1	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]CH)(C[6]C[6]C)(H)	C[6](C[6]C[6]HN)(C[6]C[6]H)(CCCH)	H(C[6]C[6]2)	C[6](C[6]C[6]CH)(C[6]C[6]C)(H){1|C<3>,1|C<4>,1|N<3>,2|H<1>}	C[6](C[6]C[6]HN)(C[6]C[6]H)(CCCH){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	116.9780	0.375	2	116.9780	0.140	2	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]CH)(C[6]C[6]C)(H)	C[6](C[6]C[6]HN)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]CH)(C[6]C[6]C)(H){1|C<3>,1|C<4>,1|N<3>,2|H<1>}	C[6](C[6]C[6]HN)(C[6]C[6]H)(CH3){1|N<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	116.7470	0.076	2	116.7470	0.006	2	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]CH)(C[6]C[6]C)(H)	C[6](C[6]C[6a]C[6]Ir)(C[6]C[6]H)(CCCH)	H(C[6]C[6]2)	C[6](C[6]C[6]CH)(C[6]C[6]C)(H){1|Ir<9>,1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6a]C[6]Ir)(C[6]C[6]H)(CCCH){1|H<1>,2|C<3>,3|C<4>}	H(C[6]C[6]2)	117.7390	0.000	1	117.7390	0.000	1	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]CH)(C[6]C[6]C)(H)	C[6](C[6]S[6]HH)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]CH)(C[6]C[6]C)(H){1|C<3>,2|H<1>,2|S<2>}	C[6](C[6]S[6]HH)(C[6]C[6]H)(CH3){1|H<1>,2|C<4>}	H(C[6]C[6]2)	116.6190	0.000	1	116.6190	0.000	1	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(CClHH)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){1|C<4>,4|H<1>}	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(CClHH){1|N<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	117.0855	0.568	2	117.0855	0.322	2	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6]CC)(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[6]CC)(C[6]C[6]H)(CCHH){2|C<4>,3|H<1>}	H(C[6]C[6]2)	117.3350	0.000	1	117.3350	0.000	1	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(CBHH)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){1|C<3>,1|C<4>,3|H<1>}	C[6](C[6]C[6]CH)(C[6]C[6]H)(CBHH){1|C<4>,4|H<1>}	H(C[6]C[6]2)	117.1290	0.000	1	117.2635	0.036	2	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(CBHH)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){2|C<4>,3|H<1>}	C[6](C[6]C[6]CH)(C[6]C[6]H)(CBHH){1|C<4>,4|H<1>}	H(C[6]C[6]2)	117.3980	0.000	1	117.2635	0.036	2	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[6]CH)(C[6]C[6]H)(CCHH){1|C<3>,1|C<4>,3|H<1>}	H(C[6]C[6]2)	116.5310	0.000	1	117.4565	0.655	4	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){1|C<4>,1|H<1>,2|C<3>}	C[6](C[6]C[6]CH)(C[6]C[6]H)(CCHH){2|C<3>,2|H<1>}	H(C[6]C[6]2)	118.1235	0.228	2	117.4565	0.655	4	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){2|C<4>,3|H<1>}	C[6](C[6]C[6]CH)(C[6]C[6]H)(CCHH){1|C<4>,4|H<1>}	H(C[6]C[6]2)	117.0480	0.000	1	117.4565	0.655	4	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){1|Br<1>,2|C<4>,2|H<1>}	C[6](C[6]C[6]CH)(C[6]C[6]H)(CH3){2|H<1>,3|C<4>}	H(C[6]C[6]2)	117.7120	0.000	1	117.6264	0.548	7	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){1|C<3>,1|C<4>,3|H<1>}	C[6](C[6]C[6]CH)(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	118.9770	0.000	1	117.6264	0.548	7	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){1|C<3>,1|C<4>,3|H<1>}	C[6](C[6]C[6]CH)(C[6]C[6]H)(CH3){2|H<1>,3|C<4>}	H(C[6]C[6]2)	117.6845	0.409	2	117.6264	0.548	7	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[6]CH)(C[6]C[6]H)(CH3){2|H<1>,3|C<4>}	H(C[6]C[6]2)	117.5100	0.000	1	117.6264	0.548	7	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){1|H<1>,2|C<2>,2|C<4>}	C[6](C[6]C[6]CH)(C[6]C[6]H)(CH3){1|C<4>,2|C<2>,2|H<1>}	H(C[6]C[6]2)	117.2550	0.000	1	117.6264	0.548	7	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){2|C<4>,3|H<1>}	C[6](C[6]C[6]CH)(C[6]C[6]H)(CH3){1|C<4>,4|H<1>}	H(C[6]C[6]2)	116.5620	0.000	1	117.6264	0.548	7	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6]CO)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){1|C<3>,1|H<1>,1|O<2>,2|C<4>}	C[6](C[6]C[6]CO)(C[6]C[6]H)(CH3){1|C<4>,4|H<1>}	H(C[6]C[6]2)	117.2010	0.000	1	117.2010	0.000	1	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(CCCH)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){1|C<3>,1|C<4>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(CCCH){1|C<3>,3|H<1>}	H(C[6]C[6]2)	117.7020	0.000	1	117.7792	0.018	4	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(CCCH)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(CCCH){1|C<4>,4|H<1>}	H(C[6]C[6]2)	117.8050	0.153	3	117.7792	0.018	4	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){1|C<3>,1|C<4>,3|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(CCHH){1|C<3>,1|C<4>,3|H<1>}	H(C[6]C[6]2)	117.6795	0.043	2	118.0100	0.566	12	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){1|C<3>,3|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(CCHH){1|C<3>,3|H<1>}	H(C[6]C[6]2)	118.3113	0.484	3	118.0100	0.566	12	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(CCHH){1|C<4>,4|H<1>}	H(C[6]C[6]2)	118.0323	1.012	6	118.0100	0.566	12	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){2|C<4>,3|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(CCHH){1|C<4>,4|H<1>}	H(C[6]C[6]2)	117.6330	0.000	1	118.0100	0.566	12	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(CCHN)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){1|C<3>,3|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(CCHN){1|C<3>,3|H<1>}	H(C[6]C[6]2)	125.6050	0.000	1	121.8290	28.516	2	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(CCHN)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(CCHN){1|C<4>,4|H<1>}	H(C[6]C[6]2)	118.0530	0.000	1	121.8290	28.516	2	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(CCHO)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){1|C<3>,1|C<4>,3|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(CCHO){1|C<4>,4|H<1>}	H(C[6]C[6]2)	117.6050	0.000	1	117.8440	0.114	2	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(CCHO)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){2|C<4>,3|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(CCHO){1|C<4>,4|H<1>}	H(C[6]C[6]2)	118.0830	0.000	1	117.8440	0.114	2	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(CC[6]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){1|C<4>,1|O<1>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(CC[6]HH){2|C<3>,3|H<1>}	H(C[6]C[6]2)	117.7040	0.000	1	117.7040	0.000	1	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(CC[6]HN)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(CC[6]HN){1|C<4>,4|H<1>}	H(C[6]C[6]2)	118.0990	0.000	1	118.0990	0.000	1	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(CC[6]HO)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(CC[6]HO){1|C<4>,4|H<1>}	H(C[6]C[6]2)	117.6920	0.130	2	117.6920	0.017	2	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(CC[6a]CH)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){1|C<3>,3|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(CC[6a]CH){1|C<3>,3|H<1>}	H(C[6]C[6]2)	118.0910	0.000	1	118.0910	0.000	1	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){1|C<3>,1|C<4>,1|N<3>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(CH3){1|C<4>,4|H<1>}	H(C[6]C[6]2)	121.6810	0.000	1	118.5313	1.864	11	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){1|C<3>,1|C<4>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(CH3){1|C<3>,3|H<1>}	H(C[6]C[6]2)	117.7330	0.000	1	118.5313	1.864	11	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){1|C<3>,1|C<4>,3|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,3|H<1>}	H(C[6]C[6]2)	117.8730	0.000	1	118.5313	1.864	11	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){1|C<3>,1|C<4>,3|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(CH3){1|C<4>,4|H<1>}	H(C[6]C[6]2)	120.3960	0.000	1	118.5313	1.864	11	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){1|C<3>,1|C<4>,3|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(CH3){2|C<4>,3|H<1>}	H(C[6]C[6]2)	118.0150	0.000	1	118.5313	1.864	11	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){1|C<3>,2|C<4>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(CH3){1|C<4>,4|H<1>}	H(C[6]C[6]2)	117.5630	0.000	1	118.5313	1.864	11	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(CH3){1|C<4>,4|H<1>}	H(C[6]C[6]2)	118.2890	0.000	1	118.5313	1.864	11	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){2|C<4>,3|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(CH3){1|C<4>,4|H<1>}	H(C[6]C[6]2)	118.0735	0.830	4	118.5313	1.864	11	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){1|C<3>,1|C<4>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(CHHN){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	118.0610	0.000	1	118.0803	0.005	3	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){1|C<3>,3|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(CHHN){1|C<3>,3|H<1>}	H(C[6]C[6]2)	118.1610	0.000	1	118.0803	0.005	3	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){2|C<4>,3|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(CHHN){1|C<4>,4|H<1>}	H(C[6]C[6]2)	118.0190	0.000	1	118.0803	0.005	3	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){2|C<4>,3|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(CHHP){1|C<4>,4|H<1>}	H(C[6]C[6]2)	117.7780	0.000	1	117.7780	0.000	1	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(CN[5]HH)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){1|C<3>,1|C<4>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(CN[5]HH){1|C<3>,3|H<1>}	H(C[6]C[6]2)	119.3600	0.000	1	119.3600	0.000	1	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(CN[6]CH)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(CN[6]CH){1|C<4>,4|H<1>}	H(C[6]C[6]2)	117.4740	0.000	1	117.4740	0.000	1	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(CRuCC)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(CRuCC){1|C<4>,4|H<1>}	H(C[6]C[6]2)	117.4760	0.000	1	117.4760	0.000	1	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(CRuCH)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(CRuCH){1|C<4>,4|H<1>}	H(C[6]C[6]2)	117.5020	0.000	1	117.5020	0.000	1	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6]HN)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){1|N<3>,2|C<4>,2|H<1>}	C[6](C[6]C[6]HN)(C[6]C[6]H)(CH3){1|C<4>,4|H<1>}	H(C[6]C[6]2)	117.3740	0.000	1	117.3740	0.000	1	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6]HO)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){1|C<3>,1|C<4>,1|O<2>,2|H<1>}	C[6](C[6]C[6]HO)(C[6]C[6]H)(CH3){2|C<4>,3|H<1>}	H(C[6]C[6]2)	117.5110	0.000	1	118.6827	1.030	3	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6]HO)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){1|O<2>,2|C<4>,2|H<1>}	C[6](C[6]C[6]HO)(C[6]C[6]H)(CH3){1|C<4>,4|H<1>}	H(C[6]C[6]2)	119.2685	0.019	2	118.6827	1.030	3	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6]HS)(C[6]C[6]H)(CHHN)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){1|C<4>,1|S<4>,3|H<1>}	C[6](C[6]C[6]HS)(C[6]C[6]H)(CHHN){1|C<4>,4|H<1>}	H(C[6]C[6]2)	117.0930	0.000	1	117.0930	0.000	1	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6a]C[6]H)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){2|C<3>,3|H<1>}	C[6](C[6]C[6a]C[6]H)(C[6]C[6]H)(CH3){1|C<4>,2|H<1>,3|C<3>}	H(C[6]C[6]2)	117.5950	0.157	3	117.5950	0.025	3	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6a]N[6]H)(C[6]C[6]H)(CClHH)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){1|C<3>,1|N<3>,3|H<1>}	C[6](C[6]C[6a]N[6]H)(C[6]C[6]H)(CClHH){1|C<4>,1|S<4>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	117.7880	0.000	1	117.7880	0.000	1	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]N[6]CH)(C[6]C[6]H)(CClHH)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){1|C<4>,1|N<3>,3|H<1>}	C[6](C[6]N[6]CH)(C[6]C[6]H)(CClHH){1|C<4>,1|S<4>,2|H<1>}	H(C[6]C[6]2)	117.8460	0.000	1	117.8460	0.000	1	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]HN)(C[6]C[6]C)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]HN)(C[6]C[6]C)(H){1|C<4>,1|N<3>,3|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	117.5140	0.095	3	117.5733	0.020	4	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]HN)(C[6]C[6]C)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]HN)(C[6]C[6]C)(H){1|C<4>,4|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(CH3){1|C<4>,1|N<3>,3|H<1>}	H(C[6]C[6]2)	117.7510	0.000	1	117.5733	0.020	4	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]HO)(C[6]C[6]C)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]HO)(C[6]C[6]C)(H){2|C<4>,3|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|O<2>,2|H<1>}	H(C[6]C[6]2)	118.0510	0.000	1	118.0510	0.000	1	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]HO)(C[6]C[6]C)(H)	C[6](C[6]C[6]HO)(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]HO)(C[6]C[6]C)(H){1|C<4>,1|O<2>,3|H<1>}	C[6](C[6]C[6]HO)(C[6]C[6]H)(CCHH){1|C<4>,1|O<2>,3|H<1>}	H(C[6]C[6]2)	117.6730	0.000	1	117.6730	0.000	1	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]HO)(C[6]C[6]C)(H)	C[6](C[6]C[6]HO)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]HO)(C[6]C[6]C)(H){1|C<3>,1|C<4>,1|O<2>,2|H<1>}	C[6](C[6]C[6]HO)(C[6]C[6]H)(CH3){1|C<4>,1|O<2>,3|H<1>}	H(C[6]C[6]2)	120.3430	1.592	4	120.3430	2.534	4	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]HO)(C[6]C[6]C)(H)	C[6](C[6]C[6]HO)(C[6]C[6]H)(CHHO)	H(C[6]C[6]2)	C[6](C[6]C[6]HO)(C[6]C[6]C)(H){1|C<4>,2|H<1>,2|O<2>}	C[6](C[6]C[6]HO)(C[6]C[6]H)(CHHO){1|C<4>,2|H<1>,2|O<2>}	H(C[6]C[6]2)	118.5220	0.000	1	118.5220	0.000	1	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]HO)(C[6]C[6]C)(H)	C[6](C[6]O[6]HH)(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]HO)(C[6]C[6]C)(H){1|C<3>,1|O<2>,3|H<1>}	C[6](C[6]O[6]HH)(C[6]C[6]H)(CCHH){1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	119.9250	0.000	1	119.9250	0.000	1	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]HP)(C[6]C[6]C)(H)	C[6](C[6]C[6]PdC)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]HP)(C[6]C[6]C)(H){1|Pd<5>,2|C<4>,2|H<1>}	C[6](C[6]C[6]PdC)(C[6]C[6]H)(CH3){1|C<4>,1|P<4>,2|H<1>}	H(C[6]C[6]2)	119.6600	0.000	1	119.6600	0.000	1	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]MoC)(C[6]C[6]C)(H)	C[6](C[6]C[6]MoP)(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6]MoC)(C[6]C[6]C)(H){1|C<4>,1|H<1>,1|P<4>}	C[6](C[6]C[6]MoP)(C[6]C[6]H)(CC3){3|C<4>}	H(C[6]C[6]2)	123.0623	2.860	4	123.0623	8.178	4	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[5]H)(C[6]C[6]C)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]N[5]H)(C[6]C[6]C)(H){1|N<3>,3|C<4>,3|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	116.7650	0.000	1	116.7650	0.000	1	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[6]H)(C[6]C[6]C)(H)	C[6](C[6]C[6]2H)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6]H)(C[6]C[6]C)(H){2|C<4>,2|H<1>,3|C<3>}	C[6](C[6]C[6]2H)(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|O<1>,2|H<1>,2|N<3>}	H(C[6]C[6]2)	122.2925	1.463	2	122.2925	2.140	2	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]N[6]Ru)(C[6]C[6]C)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]N[6]Ru)(C[6]C[6]C)(H){1|Ru<8>,1|C<3>,1|C<4>,1|N<3>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(CH3){1|Ru<9>,1|C<3>,1|N<4>,2|H<1>}	H(C[6]C[6]2)	119.9160	0.000	1	119.9160	0.000	1	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]O[6]H)(C[6]C[6]C)(H)	C[6](C[6]O[6]CH)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6]O[6]H)(C[6]C[6]C)(H){1|O<2>,2|H<1>,3|C<4>}	C[6](C[6]O[6]CH)(C[6]C[6]H)(CH3){1|C<4>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	121.5297	0.085	3	121.5297	0.007	3	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]SiH)(C[6]C[6]C)(H)	C[6](C[6]C[6]SiH)(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6]SiH)(C[6]C[6]C)(H){1|Si<4>,1|C<3>,1|C<4>,1|H<1>}	C[6](C[6]C[6]SiH)(C[6]C[6]H)(CCHH){1|Si<4>,1|C<3>,2|H<1>}	H(C[6]C[6]2)	117.6336	0.156	5	117.6336	0.024	5	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6a]C[6]H)(C[6]C[6]C)(H)	C[6](C[6]C[6]CH)(C[6]C[6]H)(CSiHH)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]H)(C[6]C[6]C)(H){2|C<4>,2|H<1>,3|C<3>}	C[6](C[6]C[6]CH)(C[6]C[6]H)(CSiHH){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	117.1880	0.000	1	117.1880	0.000	1	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6a]C[6]H)(C[6]C[6]C)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(CC3)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]H)(C[6]C[6]C)(H){1|C<4>,2|C<2>,2|C<3>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(CC3){1|C<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	125.1365	1.412	2	125.1365	1.994	2	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6a]C[6]H)(C[6]C[6]C)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(CC[6]HH)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]H)(C[6]C[6]C)(H){1|C<4>,1|O<1>,2|C<3>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(CC[6]HH){2|C<3>,3|H<1>}	H(C[6]C[6]2)	118.3710	0.000	1	118.6000	0.105	2	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6a]C[6]H)(C[6]C[6]C)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(CC[6]HH)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]H)(C[6]C[6]C)(H){1|C<4>,1|O<2>,2|C<3>,3|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(CC[6]HH){1|C<3>,1|C<4>,3|H<1>}	H(C[6]C[6]2)	118.8290	0.000	1	118.6000	0.105	2	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6a]C[6]H)(C[6]C[6]C)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]H)(C[6]C[6]C)(H){1|C<4>,3|C<3>,3|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,3|H<1>}	H(C[6]C[6]2)	119.9810	2.308	2	118.7293	3.865	4	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6a]C[6]H)(C[6]C[6]C)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]C[6a]C[6]H)(C[6]C[6]C)(H){1|C<4>,3|C<3>,3|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(CH3){1|C<4>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	117.4775	0.012	2	118.7293	3.865	4	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6a]O[6]H)(C[6]C[6]C)(H)	C[6](C[6]O[6]CH)(C[6]C[6]H)(CC[3]CH)	H(C[6]C[6]2)	C[6](C[6]C[6a]O[6]H)(C[6]C[6]C)(H){1|C<4>,1|H<1>,1|O<2>,2|C<3>}	C[6](C[6]O[6]CH)(C[6]C[6]H)(CC[3]CH){1|C<3>,1|H<1>,1|O<2>}	H(C[6]C[6]2)	118.4730	0.000	1	118.4730	0.000	1	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6,6]CH)(C[6]C[6]C)(H)	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6,6]CH)(C[6]C[6]C)(H){1|C<3>,1|C<4>,2|H<1>}	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(CH3){1|N<3>,2|C<4>,2|H<1>}	H(C[6]C[6]2)	118.7230	0.000	1	118.7230	0.000	1	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]CH)(C[6]C[6]C)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]CH)(C[6]C[6]C)(H){1|C<4>,1|S<4>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	117.3515	0.175	2	117.3515	0.031	2	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]CH)(C[6]C[6]C)(H)	C[6](C[6]N[6]CH)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]N[6]CH)(C[6]C[6]C)(H){1|C<4>,1|N<3>,2|H<1>}	C[6](C[6]N[6]CH)(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	117.7220	0.000	1	117.7220	0.000	1	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(CC[5]HH)	H(C[6]C[6]2)	C[6](C[6]N[6]HH)(C[6]C[6]C)(H){1|C<4>,1|S<4>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(CC[5]HH){1|N<3>,4|H<1>}	H(C[6]C[6]2)	118.1250	0.000	1	118.1250	0.000	1	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]N[6]HH)(C[6]C[6]C)(H)	C[6](C[6]N[6]HH)(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]N[6]HH)(C[6]C[6]C)(H){1|C<3>,1|N<3>,2|H<1>}	C[6](C[6]N[6]HH)(C[6]C[6]H)(CCHH){1|C<3>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	122.5405	1.841	2	122.5405	3.388	2	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]O[6]CC)(C[6]C[6]C)(H)	C[6](C[6]O[6]HH)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]O[6]CC)(C[6]C[6]C)(H){1|O<2>,2|H<1>}	C[6](C[6]O[6]HH)(C[6]C[6]H)(CH3){1|C<3>,1|C<4>,1|O<2>}	H(C[6]C[6]2)	120.9650	0.000	1	120.9650	0.000	1	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]O[6]CH)(C[6]C[6]C)(H)	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]O[6]CH)(C[6]C[6]C)(H){1|C<4>,2|H<1>}	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(CH3){1|C<4>,1|H<1>,1|O<2>,2|C<3>}	H(C[6]C[6]2)	118.6500	0.000	1	118.6500	0.000	1	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]O[6]HH)(C[6]C[6]C)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]O[6]HH)(C[6]C[6]C)(H){1|C<4>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(CH3){1|C<3>,1|O<2>,3|H<1>}	H(C[6]C[6]2)	118.2295	0.052	2	118.2295	0.003	2	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]O[6]HO)(C[6]C[6]C)(H)	C[6](C[6]C[6]HO)(C[6]C[6]H)(CC[6a]HO)	H(C[6]C[6]2)	C[6](C[6]O[6]HO)(C[6]C[6]C)(H){1|C<4>,1|H<1>,1|O<2>}	C[6](C[6]C[6]HO)(C[6]C[6]H)(CC[6a]HO){1|C<4>,2|H<1>,2|O<2>}	H(C[6]C[6]2)	118.6100	0.000	1	118.6100	0.000	1	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]P[6,6]HH)(C[6]C[6]C)(H)	C[6](C[6]P[6,6]HH)(C[6]C[6]H)(CH3)	H(C[6]C[6]2)	C[6](C[6]P[6,6]HH)(C[6]C[6]C)(H){1|C<4>,1|P<4>,1|W<6>,2|H<1>}	C[6](C[6]P[6,6]HH)(C[6]C[6]H)(CH3){1|C<4>,1|P<4>,1|W<6>,2|H<1>}	H(C[6]C[6]2)	113.5740	0.000	1	113.5740	0.000	1	118.3568	3.911	218	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:P-4:	C[6]-3:	C[6](C[6]N[6]HH)(C[6]C[6]P)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(PCOO)	H(C[6]C[6]2)	C[6](C[6]N[6]HH)(C[6]C[6]P)(H){1|C<3>,1|C<4>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(PCOO){1|N<3>,4|H<1>}	H(C[6]C[6]2)	117.9600	0.000	1	117.9600	0.000	1	117.9600	0.000	1	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:S-4:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]S)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(SC[6a]OO)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]S)(H){1|C<3>,1|C<4>,1|S<4>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(SC[6a]OO){2|C<4>,3|H<1>}	H(C[6]C[6]2)	118.7270	0.000	1	118.9170	0.072	2	118.9170	0.072	2	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:S-4:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]S)(H)	C[6](C[6]C[6]HH)(C[6]C[6]H)(SC[6a]OO)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]S)(H){1|C<3>,1|C<4>,2|H<1>}	C[6](C[6]C[6]HH)(C[6]C[6]H)(SC[6a]OO){1|C<3>,1|C<4>,2|H<1>}	H(C[6]C[6]2)	119.1070	0.000	1	118.9170	0.072	2	118.9170	0.072	2	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:Si-4:	C[6]-3:	C[6](C[6]C[5,6]C[6a]H)(C[6]C[6]Si)(H)	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(SiC3)	H(C[6]C[6]2)	C[6](C[6]C[5,6]C[6a]H)(C[6]C[6]Si)(H){2|C<4>,2|H<1>,3|C<3>}	C[6](C[6]C[5,6]HH)(C[6]C[6]H)(SiC3){1|C<4>,2|C<3>,2|H<1>}	H(C[6]C[6]2)	118.4000	0.000	1	118.4000	0.000	1	117.2520	1.004	3	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-3:Si-4:	C[6]-3:	C[6](C[6]C[6,6]CH)(C[6]C[6]Si)(H)	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(SiC3)	H(C[6]C[6]2)	C[6](C[6]C[6,6]CH)(C[6]C[6]Si)(H){2|C<4>,3|H<1>}	C[6](C[6]C[6,6]HH)(C[6]C[6]H)(SiC3){1|H<1>,4|C<4>}	H(C[6]C[6]2)	116.6780	0.174	2	116.6780	0.030	2	117.2520	1.004	3	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	N[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]N[6]C)(H)	C[6](N[6]C[6]RuB)(C[6]C[6]H)(CHHP)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]N[6]C)(H){1|Ru<7>,1|B<5>,1|C<3>,1|H<1>}	C[6](N[6]C[6]RuB)(C[6]C[6]H)(CHHP){1|C<3>,1|N<3>,2|H<1>}	H(C[6]C[6]2)	118.3230	0.000	1	118.3230	0.000	1	118.3230	0.000	1	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:3:4:	3:	C[6]-4:C[6]-3:H-1:	P[6]-4:C[6]-3:C-4:	C[6]-3:	C[6](C[6]C[6,6a]CC)(C[6]P[6]C)(H)	C[6](P[6]C[6,6a]C[6a]O)(C[6]C[6]H)(CCHH)	H(C[6]C[6]2)	C[6](C[6]C[6,6a]CC)(C[6]P[6]C)(H){1|O<1>,3|C<3>}	C[6](P[6]C[6,6a]C[6a]O)(C[6]C[6]H)(CCHH){2|C<4>,4|C<3>}	H(C[6]C[6]2)	114.6090	0.000	1	114.6090	0.000	1	114.6090	0.000	1	118.3191	3.395	296	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:4:3:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]C)(H)	C[6](C[6]N[6]HH)(CC[5,6]HH)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]C)(H){1|N<3>,4|H<1>}	C[6](C[6]N[6]HH)(CC[5,6]HH)(C[6]C[6]H){1|C<4>,1|S<4>,2|H<1>}	H(C[6]C[6]2)	117.9030	0.000	1	117.9030	0.000	1	117.9030	0.000	1	117.4605	0.232	8	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:4:3:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[5,6]HH)(C[6]C[6]2)(H)	C[6](C[6]C[6,6]O[6]H)(C[6]C[5,6]CH)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[5,6]HH)(C[6]C[6]2)(H){1|C<3>,1|O<2>,2|H<1>,4|C<4>}	C[6](C[6]C[6,6]O[6]H)(C[6]C[5,6]CH)(C[6]C[6]H){1|C<3>,1|O<2>,2|H<1>,4|C<4>}	H(C[6]C[6]2)	117.3340	0.000	1	117.3340	0.000	1	117.3973	0.234	7	117.4605	0.232	8	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:4:3:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]2)(H)	C[6](C[6]C[6]2C)(C[6]C[6]HH)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]2)(H){2|C<3>,2|C<4>,4|H<1>}	C[6](C[6]C[6]2C)(C[6]C[6]HH)(C[6]C[6]H){1|C<4>,2|N<3>,2|O<1>,4|H<1>}	H(C[6]C[6]2)	117.9650	0.000	1	117.9650	0.000	1	117.3973	0.234	7	117.4605	0.232	8	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:4:3:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6]HH)(C[6]C[6]2)(H)	C[6](C[6]C[6]2H)(C[6]C[6]CH)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]HH)(C[6]C[6]2)(H){4|C<4>,4|H<1>}	C[6](C[6]C[6]2H)(C[6]C[6]CH)(C[6]C[6]H){1|O<2>,3|C<4>,7|H<1>}	H(C[6]C[6]2)	117.1635	0.474	4	117.1635	0.224	4	117.3973	0.234	7	117.4605	0.232	8	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	4:3:1:	4:4:3:	3:	C[6]-4:C[6]-3:H-1:	C[6]-4:C[6]-4:C[6]-3:	C[6]-3:	C[6](C[6]C[6]HO)(C[6]C[6]2)(H)	C[6](C[6]C[5,6]C[6,6]H)(C[6]C[6]HO)(C[6]C[6]H)	H(C[6]C[6]2)	C[6](C[6]C[6]HO)(C[6]C[6]2)(H){2|H<1>,2|O<2>,4|C<4>}	C[6](C[6]C[5,6]C[6,6]H)(C[6]C[6]HO)(C[6]C[6]H){1|C<3>,1|O<2>,4|C<4>,5|H<1>}	H(C[6]C[6]2)	117.8280	0.000	1	117.8280	0.000	1	117.3973	0.234	7	117.4605	0.232	8	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	5:3:1:	3:3:1:	3:	C[6,6]-5:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]B[6]Li2)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]B[6]Li2)(C[6]C[6]H)(H){1|B<5>,1|C<3>,1|C<5>,2|H<1>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){2|Li<8>,1|B<5>,1|C<5>,1|H<1>}	H(C[6]C[6,6]C[6])	118.5847	0.099	4	118.5616	0.010	5	118.5616	0.010	5	118.9844	0.434	16	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	5:3:1:	3:3:1:	3:	C[6,6]-5:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6,6]C[6,6]B[6]Li2)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6,6]C[6])	C[6](C[6,6]C[6,6]B[6]Li2)(C[6]C[6]H)(H){1|B<5>,1|C<5>,1|H<1>,2|C<3>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){2|Li<7>,1|B<5>,1|C<5>,1|H<1>}	H(C[6]C[6,6]C[6])	118.4690	0.000	1	118.5616	0.010	5	118.5616	0.010	5	118.9844	0.434	16	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	5:3:1:	3:3:1:	3:	C[6]-5:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]OYY)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]OYY)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){2|Y<14>,1|O<3>,2|C<3>}	H(C[6]C[6]2)	119.5420	0.000	1	119.5420	0.000	1	119.1766	0.516	11	118.9844	0.434	16	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	5:3:1:	3:3:1:	3:	C[6]-5:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6,6]Yb2O)(C[6]C[6]H)(H)	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H)	H(C[6]C[6]2)	C[6](C[6]C[6,6]Yb2O)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|N<3>}	C[6](C[6]C[6,6]H)(C[6]C[6]H)(H){2|Yb<14>,1|O<3>,2|C<3>}	H(C[6]C[6]2)	119.7070	0.000	1	119.7070	0.000	1	119.1766	0.516	11	118.9844	0.434	16	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	5:3:1:	3:3:1:	3:	C[6]-5:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Li3)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Li3)(C[6]C[6]H)(H){1|C<3>,1|H<1>,1|S<3>}	C[6](C[6]C[6]H)2(H){1|Li<3>,1|Si<4>,2|Li<5>,1|C<5>}	H(C[6]C[6]2)	118.1170	0.000	1	118.1170	0.000	1	119.1766	0.516	11	118.9844	0.434	16	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	5:3:1:	3:3:1:	3:	C[6]-5:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Ru3)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Ru3)(C[6]C[6]H)(H){1|Ru<5>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){3|Ru<6>,1|C<5>,1|H<1>}	H(C[6]C[6]2)	118.5635	0.036	2	118.6352	0.009	4	119.1766	0.516	11	118.9844	0.434	16	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	5:3:1:	3:3:1:	3:	C[6]-5:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]C[6]Ru3)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]C[6]Ru3)(C[6]C[6]H)(H){1|Ru<6>,1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Ru<5>,2|Ru<6>,1|C<5>,1|H<1>}	H(C[6]C[6]2)	118.7070	0.079	2	118.6352	0.009	4	119.1766	0.516	11	118.9844	0.434	16	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	5:3:1:	3:3:1:	3:	C[6]-5:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]Ru3)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]Ru3)(C[6]C[6]H)(H){1|C<3>,1|H<1>}	C[6](C[6]C[6]H)2(H){3|Ru<9>,1|H<1>,1|N<4>}	H(C[6]C[6]2)	119.7100	0.000	1	119.7100	0.000	1	119.1766	0.516	11	118.9844	0.434	16	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	5:3:1:	3:3:1:	3:	C[6]-5:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]ThCH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]ThCH)(C[6]C[6]H)(H){1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Th<17>,1|H<1>,1|N<3>,2|C<4>}	H(C[6]C[6]2)	119.0510	0.000	1	119.7753	0.533	3	119.1766	0.516	11	118.9844	0.434	16	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	5:3:1:	3:3:1:	3:	C[6]-5:C[6]-3:H-1:	C[6]-3:C[6]-3:H-1:	C[6]-3:	C[6](C[6]N[6]ThCH)(C[6]C[6]H)(H)	C[6](C[6]C[6]H)2(H)	H(C[6]C[6]2)	C[6](C[6]N[6]ThCH)(C[6]C[6]H)(H){1|C<4>,1|H<1>}	C[6](C[6]C[6]H)2(H){1|Th<21>,1|C<4>,1|C<5>,1|H<1>,1|N<3>}	H(C[6]C[6]2)	120.1375	0.528	2	119.7753	0.533	3	119.1766	0.516	11	118.9844	0.434	16	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	6:3:1:	3:3:1:	3:	C[5x3,5x5,21x6]-6:C[6]-3:H-1:	C[6]-3:C[6,6a]-3:H-1:	C[6]-3:	C[6](C[5x3,5x5,21x6]B[5x3,5x5,20x6]3B[5x3,5x5,21x6]C[5x3,5x5,20x6])(C[6]C[6,6a]H)(H)	C[6](C[6]C[5x3,5x5,21x6]H)(C[6,6a]C[6,6a]C[6a])(H)	H(C[6]C[5x3,5x5,21x6]C[6])	C[6](C[5x3,5x5,21x6]B[5x3,5x5,20x6]3B[5x3,5x5,21x6]C[5x3,5x5,20x6])(C[6]C[6,6a]H)(H){2|C<3>,4|H<1>,5|B<6>}	C[6](C[6]C[5x3,5x5,21x6]H)(C[6,6a]C[6,6a]C[6a])(H){1|C<6>,1|H<1>,2|C<3>,4|B<6>}	H(C[6]C[5x3,5x5,21x6]C[6])	118.5755	0.308	2	118.5755	0.095	2	118.5755	0.095	2	118.5755	0.095	2	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	6:3:1:	3:3:4:	3:	C[5x3,5x5,21x6]-6:C[6]-3:H-1:	C[6]-3:C[6,6a]-3:C-4:	C[6]-3:	C[6](C[5x3,5x5,21x6]B[5x3,5x5,20x6]4C[5x3,5x5,21x6])(C[6]C[6,6a]C)(H)	C[6](C[6]C[5x3,5x5,21x6]H)(C[6,6a]C[6,6a]C[6a])(CCHH)	H(C[6]C[5x3,5x5,21x6]C[6])	C[6](C[5x3,5x5,21x6]B[5x3,5x5,20x6]4C[5x3,5x5,21x6])(C[6]C[6,6a]C)(H){2|C<3>,4|H<1>,5|B<6>}	C[6](C[6]C[5x3,5x5,21x6]H)(C[6,6a]C[6,6a]C[6a])(CCHH){1|C<6>,1|H<1>,2|C<3>,4|B<6>}	H(C[6]C[5x3,5x5,21x6]C[6])	117.5800	0.000	1	117.5800	0.000	1	117.5800	0.000	1	118.3930	0.521	3	119.9939	1.462	261668	119.9922	1.499	264352
762	762	951	0:SP2_SP-NON_SP2	C[6]	C[6]	H	6:3:1:	3:3:4:	3:	C[5x3,5x5,21x6]-6:C[6]-3:H-1:	C[6]-3:C[6]-3:C-4:	C[6]-3:	C[6](C[5x3,5x5,21x6]B[5x3,5x5,20x6]4C[5x3,5x5,21x6])(C[6]C[6]C)(H)	C[6](C[6]C[5x3,5x5,21x6]H)(C[6]C[6]H)(CC3)	H(C[6]C[5x3,5x5,21x6]C[6])	C[6](C[5x3,5x5,21x6]B[5x3,5x5,20x6]4C[5x3,5x5,21x6])(C[6]C[6]C)(H){1|C<3>,5|B<6>,5|H<1>}	C[6](C[6]C[5x3,5x5,21x6]H)(C[6]C[6]H)(CC3){1|C<4>,1|C<6>,4|B<6>}	H(C[6]C[5x3,5x5,21x6]C[6])	118.7995	0.223	2	118.7995	0.050	2	118.7995	0.050	2	118.3930	0.521	3	119.9939	1.462	261668	119.9922	1.499	264352